data_1j3c_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 1j3c _Structure_validation_residue.Date_analyzed 2016-10-06 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 ' 9' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo . . . . . 0 N--CA 1.483 0.902 0 N-CA-C 110.568 -0.589 . . . . 0.0 110.568 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.8 mtpt -56.07 -171.57 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.662 -0.649 . . . . 0.0 110.711 -179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.2 mtt85 -56.64 139.46 75.94 Favored Pre-proline 0 N--CA 1.498 1.933 0 O-C-N 121.412 -0.805 . . . . 0.0 110.456 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.418 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 50.0 Cg_endo -77.03 133.27 13.48 Favored 'Trans proline' 0 C--N 1.318 -1.039 0 O-C-N 123.382 1.201 . . . . 0.0 110.252 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -82.42 -162.5 0.18 Allowed 'Trans proline' 0 C--N 1.319 -0.993 0 O-C-N 123.236 1.124 . . . . 0.0 109.903 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 31.0 t -165.82 63.52 0.11 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.445 -0.784 . . . . 0.0 110.458 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 67.63 -75.54 0.06 Allowed 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.21 -0.931 . . . . 0.0 109.958 -179.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -47.19 -50.48 20.71 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.424 -0.798 . . . . 0.0 111.386 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -59.18 -39.53 82.82 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.614 -0.679 . . . . 0.0 109.746 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 45.0 mt -65.94 -37.19 85.39 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.594 -0.691 . . . . 0.0 109.891 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.492 ' CE2' ' CZ ' ' A' ' 23' ' ' TYR . 28.0 t80 -77.37 -54.06 6.91 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.634 -0.666 . . . . 0.0 110.654 -179.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 14.6 t -56.91 -53.07 62.14 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.459 -0.776 . . . . 0.0 110.707 -179.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 82.7 p -57.77 -25.4 60.44 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.577 -0.702 . . . . 0.0 110.859 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -96.55 -26.44 15.26 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.378 -0.826 . . . . 0.0 111.143 -179.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.492 ' CZ ' ' CE2' ' A' ' 19' ' ' PHE . 6.2 m-85 -88.5 -34.66 17.35 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.322 -0.861 . . . . 0.0 110.96 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.497 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 25.5 mtt180 -48.18 -52.83 38.61 Favored Pre-proline 0 N--CA 1.498 1.947 0 O-C-N 121.338 -0.851 . . . . 0.0 112.12 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 36.3 Cg_endo -59.64 -27.62 85.4 Favored 'Trans proline' 0 N--CA 1.494 1.541 0 O-C-N 123.184 1.097 . . . . 0.0 110.233 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.9 tmtt? -69.76 -45.9 67.02 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.1 mm -57.77 -31.59 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.246 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.528 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 4.8 mmmm -71.26 -36.23 71.67 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 120.004 -0.678 . . . . 0.0 110.427 -177.283 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 39.7 t -63.09 -23.38 67.42 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.393 -0.817 . . . . 0.0 110.8 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -117.14 -18.87 9.9 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.447 -0.783 . . . . 0.0 111.122 -179.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 52.0 m80 -123.25 96.1 44.74 Favored Pre-proline 0 N--CA 1.496 1.85 0 O-C-N 121.374 -0.829 . . . . 0.0 109.676 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -74.87 -36.73 2.49 Favored 'Trans proline' 0 C--N 1.316 -1.171 0 O-C-N 123.461 1.242 . . . . 0.0 110.303 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.403 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -74.37 -16.89 79.73 Favored Glycine 0 N--CA 1.49 2.261 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.74 80.17 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.529 -0.983 . . . . 0.0 111.335 -179.354 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.403 ' N ' ' O ' ' A' ' 33' ' ' GLY . 75.8 p -74.57 173.0 11.01 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.311 -0.868 . . . . 0.0 109.521 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 40.4 mm -52.13 -30.39 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.173 0 O-C-N 121.322 -0.862 . . . . 0.0 110.399 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.22 -68.81 1.5 Allowed Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.338 -1.505 . . . . 0.0 109.338 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.403 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 0.4 OUTLIER -67.82 -28.59 67.7 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.686 -0.891 . . . . 0.0 110.655 179.745 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 78.4 m -66.45 -29.75 69.95 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.297 -0.877 . . . . 0.0 110.014 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.53 -46.09 34.21 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.592 -0.692 . . . . 0.0 109.87 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.86 -13.01 54.69 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.621 -0.674 . . . . 0.0 111.774 -179.446 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 3.7 tppt? -77.46 -59.58 2.72 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 120.986 -1.071 . . . . 0.0 109.825 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.2 mp -53.33 -28.88 30.88 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.419 -0.801 . . . . 0.0 110.578 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -71.24 -44.57 52.57 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.114 -1.595 . . . . 0.0 109.114 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -55.31 -33.63 63.47 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.605 -0.938 . . . . 0.0 110.532 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 65.5 mmm -76.81 -49.62 15.4 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.634 -0.666 . . . . 0.0 109.564 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 70.1 t-105 -50.37 -53.02 32.24 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.563 -0.711 . . . . 0.0 110.964 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.4 t -62.74 -34.6 77.55 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.46 -0.775 . . . . 0.0 110.129 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -63.9 -39.72 94.83 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.558 -0.714 . . . . 0.0 110.141 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -57.54 157.52 6.84 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.602 -0.686 . . . . 0.0 110.594 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 17.5 t -88.51 -148.91 0.17 Allowed 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -89.31 47.58 1.5 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.154 -0.967 . . . . 0.0 110.257 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 40.7 mttp -126.94 -42.51 1.74 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.464 -0.772 . . . . 0.0 110.095 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -54.9 -26.64 37.17 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.42 -0.8 . . . . 0.0 110.926 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 40.9 tttm -107.29 26.85 9.68 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.43 -0.794 . . . . 0.0 110.963 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.421 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 3.9 mm-40 -99.91 -55.24 0.16 Allowed Pre-proline 0 N--CA 1.497 1.897 0 O-C-N 121.338 -0.851 . . . . 0.0 110.966 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.421 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.1 Cg_endo -83.37 -37.2 0.18 Allowed 'Trans proline' 0 C--N 1.322 -0.851 0 O-C-N 122.935 0.966 . . . . 0.0 110.692 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -80.51 4.9 16.79 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.523 -0.735 . . . . 0.0 111.579 -179.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.07 -19.98 18.33 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.178 -0.951 . . . . 0.0 110.567 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -77.48 -24.63 50.11 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.46 -0.775 . . . . 0.0 110.267 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 35.1 tttt -60.76 -41.52 95.64 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.482 -0.761 . . . . 0.0 109.863 179.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.1 -10.41 59.74 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.564 -0.71 . . . . 0.0 110.939 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -98.01 4.3 49.34 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.246 -0.908 . . . . 0.0 110.83 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.66 -40.7 5.67 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.126 -0.984 . . . . 0.0 109.787 179.569 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.4 pp -78.88 -0.16 29.64 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.831 -0.543 . . . . 0.0 110.737 179.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.0 ttpt -92.55 -21.06 20.32 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.243 -0.911 . . . . 0.0 109.871 179.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -83.29 -12.42 56.7 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.46 -0.775 . . . . 0.0 110.196 178.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -105.31 -30.39 9.67 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.327 -0.858 . . . . 0.0 109.347 178.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.418 ' CE2' ' HD3' ' A' ' 12' ' ' PRO . 4.4 t80 -74.8 -53.59 8.88 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.716 -0.615 . . . . 0.0 109.577 179.435 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -56.44 -19.43 15.08 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.614 -0.679 . . . . 0.0 111.405 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.8 mttt -105.95 -29.0 10.24 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.262 -0.899 . . . . 0.0 110.802 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -86.7 -39.57 15.9 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.466 -0.771 . . . . 0.0 111.099 -179.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.4 ' HB ' ' CD1' ' A' ' 69' ' ' TYR . 6.6 tp . . . . . 0 N--CA 1.497 1.888 0 O-C-N 121.378 -0.826 . . . . 0.0 110.919 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.418 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 50.0 Cg_endo . . . . . 0 N--CA 1.485 1.004 0 N-CA-C 110.578 -0.585 . . . . 0.0 110.578 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.02 -168.25 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.494 -0.754 . . . . 0.0 110.016 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -60.15 137.21 91.32 Favored Pre-proline 0 N--CA 1.498 1.936 0 O-C-N 121.447 -0.783 . . . . 0.0 110.208 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -76.5 136.21 17.21 Favored 'Trans proline' 0 C--N 1.318 -1.063 0 O-C-N 123.36 1.19 . . . . 0.0 109.808 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -79.94 -169.84 0.88 Allowed 'Trans proline' 0 C--N 1.317 -1.107 0 O-C-N 123.28 1.147 . . . . 0.0 110.213 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -163.22 61.33 0.18 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.491 -0.756 . . . . 0.0 110.773 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 65.77 -78.88 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.166 -0.959 . . . . 0.0 110.64 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -46.02 -52.26 12.15 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.237 -0.915 . . . . 0.0 111.729 -179.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -57.42 -33.75 68.22 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.499 -0.75 . . . . 0.0 110.131 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 47.8 mt -70.48 -38.3 74.37 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.613 -0.679 . . . . 0.0 110.204 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.497 ' CE2' ' CE1' ' A' ' 23' ' ' TYR . 52.7 t80 -77.21 -54.91 5.91 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.688 -0.632 . . . . 0.0 110.478 -179.537 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -56.81 -53.06 62.13 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.572 -0.705 . . . . 0.0 110.505 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.7 t -59.49 -17.99 36.23 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.578 -0.702 . . . . 0.0 111.131 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -107.89 -11.73 15.3 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.25 -0.906 . . . . 0.0 111.663 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.497 ' CE1' ' CE2' ' A' ' 19' ' ' PHE . 2.5 m-85 -100.35 -33.9 10.2 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.065 -1.022 . . . . 0.0 110.869 -179.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.494 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 27.7 mtt180 -47.8 -51.7 44.44 Favored Pre-proline 0 N--CA 1.498 1.943 0 O-C-N 121.31 -0.869 . . . . 0.0 112.3 -179.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 36.3 Cg_endo -60.43 -26.23 82.26 Favored 'Trans proline' 0 N--CA 1.494 1.539 0 O-C-N 123.252 1.133 . . . . 0.0 110.343 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.2 tmtt? -70.31 -45.38 66.35 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 178.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 47.8 mm -58.83 -28.79 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 CA-C-O 121.173 0.511 . . . . 0.0 110.309 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.502 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 5.7 mmmm -73.27 -33.65 65.36 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.593 -0.692 . . . . 0.0 110.547 -177.247 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 13.1 t -67.69 -23.53 65.31 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.397 -0.814 . . . . 0.0 110.636 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -116.09 -14.42 11.18 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.414 -0.804 . . . . 0.0 111.247 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 44.4 m80 -130.62 94.7 28.54 Favored Pre-proline 0 N--CA 1.496 1.834 0 O-C-N 121.301 -0.874 . . . . 0.0 109.376 179.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -74.95 -38.72 1.49 Allowed 'Trans proline' 0 C--N 1.315 -1.192 0 O-C-N 123.465 1.245 . . . . 0.0 110.401 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.416 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -71.99 -22.57 78.74 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 109.864 -1.294 . . . . 0.0 109.864 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -52.07 86.79 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.627 -0.925 . . . . 0.0 111.775 -179.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.416 ' N ' ' O ' ' A' ' 33' ' ' GLY . 17.2 m -76.27 172.06 13.5 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.513 -0.742 . . . . 0.0 109.653 179.545 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 44.9 mm -56.87 -27.49 26.45 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.975 0 O-C-N 121.407 -0.808 . . . . 0.0 110.095 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.32 -63.78 4.72 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -74.07 -32.35 63.24 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.574 -0.956 . . . . 0.0 110.61 179.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 89.8 m -66.34 -33.86 76.68 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.304 -0.872 . . . . 0.0 110.162 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.1 -31.65 68.06 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.629 -0.669 . . . . 0.0 109.956 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -102.2 -8.05 21.65 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.604 -0.685 . . . . 0.0 111.543 -179.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.38 3.64 46.19 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.001 -1.062 . . . . 0.0 110.203 179.062 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.8 mt -102.21 -33.87 9.47 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.023 -1.048 . . . . 0.0 109.493 179.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -68.48 -31.0 73.3 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.427 -1.469 . . . . 0.0 109.427 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -56.93 -45.8 82.49 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.501 -0.999 . . . . 0.0 110.241 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 25.8 mtt -77.25 -49.6 14.71 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.642 -0.661 . . . . 0.0 109.646 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 73.3 t-105 -54.93 -22.14 14.02 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.613 -0.679 . . . . 0.0 110.879 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.0 p -88.87 -35.26 16.65 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.322 -0.861 . . . . 0.0 109.885 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.13 -34.98 77.39 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.629 -0.669 . . . . 0.0 109.821 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 87.3 mm-40 -63.08 157.6 21.77 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.59 -0.694 . . . . 0.0 109.809 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.2 m -147.33 103.65 3.58 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.514 -0.741 . . . . 0.0 110.339 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 52.95 51.95 14.84 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.472 -0.768 . . . . 0.0 110.994 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.6 tppt? -150.77 -69.77 0.18 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.498 -0.751 . . . . 0.0 109.939 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -64.39 -36.31 83.74 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.353 -0.842 . . . . 0.0 110.437 -179.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -93.28 19.44 8.16 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.436 -0.79 . . . . 0.0 111.358 -179.317 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -92.23 -52.13 0.28 Allowed Pre-proline 0 N--CA 1.496 1.831 0 O-C-N 121.398 -0.814 . . . . 0.0 110.415 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -83.23 -28.53 1.47 Allowed 'Trans proline' 0 C--N 1.319 -0.975 0 O-C-N 123.074 1.039 . . . . 0.0 110.275 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -84.28 1.83 42.98 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.543 -0.723 . . . . 0.0 111.649 -179.051 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.07 -24.65 16.23 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.082 -1.012 . . . . 0.0 110.704 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -75.87 -21.42 57.21 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.413 -0.804 . . . . 0.0 110.217 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 20.0 tttp -59.93 -44.66 94.22 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.46 -0.775 . . . . 0.0 109.932 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.68 -10.41 59.33 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.532 -0.73 . . . . 0.0 110.511 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.09 5.38 37.97 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.235 -0.916 . . . . 0.0 110.383 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 19.9 mmmt -105.48 -33.13 8.23 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.246 -0.909 . . . . 0.0 109.334 179.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.7 mp -80.03 2.87 22.11 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.881 -0.512 . . . . 0.0 111.052 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -95.92 -26.0 15.76 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.081 -1.012 . . . . 0.0 110.009 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -84.88 -15.13 45.68 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.545 -0.722 . . . . 0.0 110.588 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -103.19 -28.83 11.68 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.38 -0.825 . . . . 0.0 109.715 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.418 ' CD2' ' HB2' ' A' ' 9' ' ' PRO . 20.6 t80 -74.61 -53.47 9.3 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.752 -0.593 . . . . 0.0 109.868 179.653 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -68.78 -9.63 51.99 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.737 -0.602 . . . . 0.0 111.587 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 38.5 mttm -104.29 -31.81 9.39 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.143 -0.973 . . . . 0.0 110.779 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -93.99 -28.68 15.64 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.494 -0.754 . . . . 0.0 111.136 -179.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.5 tp . . . . . 0 N--CA 1.497 1.877 0 O-C-N 121.426 -0.796 . . . . 0.0 110.917 -179.392 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo . . . . . 0 N--CA 1.483 0.857 0 N-CA-C 110.412 -0.649 . . . . 0.0 110.412 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.3 pttt -59.93 -163.65 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.615 -0.678 . . . . 0.0 110.363 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -64.3 141.05 98.09 Favored Pre-proline 0 N--CA 1.496 1.837 0 O-C-N 121.543 -0.723 . . . . 0.0 110.236 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -75.66 132.11 14.24 Favored 'Trans proline' 0 C--N 1.318 -1.063 0 O-C-N 123.26 1.137 . . . . 0.0 109.852 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -81.23 -171.2 1.17 Allowed 'Trans proline' 0 C--N 1.317 -1.116 0 O-C-N 123.237 1.125 . . . . 0.0 110.352 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.1 t -166.32 63.02 0.1 Allowed 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.524 -0.735 . . . . 0.0 110.582 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 65.75 -79.0 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.173 -0.954 . . . . 0.0 110.329 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.5 ' CE2' ' CD1' ' A' ' 47' ' ' TRP . 2.8 t80 -47.56 -49.07 27.39 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.217 -0.927 . . . . 0.0 111.403 -179.421 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -58.01 -30.25 65.95 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.658 -0.651 . . . . 0.0 110.074 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.0 mt -79.04 -31.76 44.7 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.48 -0.763 . . . . 0.0 110.489 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.5 ' CE1' ' CZ ' ' A' ' 23' ' ' TYR . 59.4 t80 -79.2 -55.04 5.39 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.518 -0.739 . . . . 0.0 110.669 -179.349 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 5.7 t -56.7 -54.63 43.98 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.406 -0.809 . . . . 0.0 110.581 -179.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 84.2 p -55.88 -21.52 20.54 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.444 -0.785 . . . . 0.0 110.967 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.5 mm-40 -101.23 -24.87 14.17 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.398 -0.814 . . . . 0.0 110.828 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.5 ' CZ ' ' CE1' ' A' ' 19' ' ' PHE . 8.0 m-85 -95.58 11.83 31.79 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.43 -0.794 . . . . 0.0 111.456 -179.293 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.485 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 4.5 mtt180 -87.1 -45.13 0.53 Allowed Pre-proline 0 N--CA 1.488 1.454 0 O-C-N 121.173 -0.955 . . . . 0.0 112.263 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.51 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.0 Cg_endo -66.76 -16.93 51.67 Favored 'Trans proline' 0 N--CA 1.49 1.275 0 O-C-N 122.899 0.947 . . . . 0.0 110.449 -179.203 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.8 tmtt? -71.69 -48.74 45.37 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 178.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 26.9 mm -56.67 -33.38 40.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 CA-C-O 121.376 0.608 . . . . 0.0 110.315 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.51 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 4.6 mmmm -72.1 -38.42 69.35 Favored 'General case' 0 N--CA 1.497 1.92 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.337 -177.072 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.7 t -57.81 -26.29 61.77 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.401 -0.812 . . . . 0.0 110.693 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -114.92 -22.68 9.48 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.53 -0.731 . . . . 0.0 110.721 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 36.5 m80 -122.1 95.7 47.17 Favored Pre-proline 0 N--CA 1.496 1.86 0 O-C-N 121.393 -0.817 . . . . 0.0 109.649 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -75.29 -36.2 2.51 Favored 'Trans proline' 0 C--N 1.316 -1.155 0 O-C-N 123.418 1.22 . . . . 0.0 110.346 -179.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.403 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -75.5 -17.87 80.02 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 110.203 -1.159 . . . . 0.0 110.203 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.79 86.99 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.253 0 O-C-N 121.563 -0.963 . . . . 0.0 111.191 -179.469 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.403 ' N ' ' O ' ' A' ' 33' ' ' GLY . 40.6 t -72.44 171.57 12.04 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.581 -0.7 . . . . 0.0 110.011 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.7 mm -55.84 -28.99 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.072 0 O-C-N 121.411 -0.806 . . . . 0.0 110.125 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.91 -64.15 4.45 Favored Glycine 0 N--CA 1.493 2.471 0 N-CA-C 109.178 -1.569 . . . . 0.0 109.178 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -72.19 -34.01 68.09 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.546 -0.973 . . . . 0.0 110.438 179.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 96.4 m -64.21 -33.15 75.15 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.338 -0.851 . . . . 0.0 110.151 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.01 -36.97 69.88 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.638 -0.664 . . . . 0.0 110.062 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -96.24 -9.56 30.09 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.581 -0.699 . . . . 0.0 111.888 -179.332 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.8 7.33 34.63 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 120.986 -1.072 . . . . 0.0 110.258 179.158 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 16.2 mt -105.6 -30.18 9.66 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.053 -1.029 . . . . 0.0 109.584 179.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.65 -28.83 73.53 Favored Glycine 0 N--CA 1.493 2.44 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -55.02 -44.16 74.33 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.437 -1.037 . . . . 0.0 110.556 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 34.5 mtm -82.31 -46.74 13.23 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.541 -0.725 . . . . 0.0 109.912 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . 0.5 ' CD1' ' CE2' ' A' ' 16' ' ' PHE . 74.6 t-105 -54.68 -22.03 12.53 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.628 -0.67 . . . . 0.0 111.06 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 11.1 t -97.5 -33.16 11.47 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.359 -0.838 . . . . 0.0 110.216 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -62.73 -36.35 82.73 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.566 -0.709 . . . . 0.0 110.032 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 13.4 mm-40 -58.9 156.98 10.5 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.521 -0.737 . . . . 0.0 110.504 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.8 t -86.6 -148.43 0.13 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.671 -0.643 . . . . 0.0 109.369 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.67 49.26 1.77 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.201 -0.937 . . . . 0.0 110.335 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 17.3 mtmm -126.64 -40.19 1.94 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.523 -0.735 . . . . 0.0 110.29 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -55.79 -32.66 63.7 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.366 -0.834 . . . . 0.0 110.845 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.5 tttm -103.24 26.28 8.5 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.41 -0.806 . . . . 0.0 110.931 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.429 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 3.9 mt-30 -99.0 -55.0 0.18 Allowed Pre-proline 0 N--CA 1.495 1.823 0 O-C-N 121.288 -0.882 . . . . 0.0 110.655 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.429 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.0 Cg_endo -83.94 -35.15 0.23 Allowed 'Trans proline' 0 C--N 1.321 -0.912 0 O-C-N 122.918 0.957 . . . . 0.0 110.779 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -81.54 4.33 21.72 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.411 -0.806 . . . . 0.0 111.446 -179.302 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -96.71 -23.0 16.65 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.976 -1.077 . . . . 0.0 110.731 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -75.61 -22.65 56.69 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.458 -0.777 . . . . 0.0 110.239 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 66.0 tttt -60.93 -41.67 96.64 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.426 -0.796 . . . . 0.0 109.93 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.78 -11.34 60.76 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.586 -0.696 . . . . 0.0 110.58 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.68 6.13 36.29 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.327 -0.858 . . . . 0.0 110.503 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 24.7 mmtp -106.12 -33.85 7.73 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.216 -0.928 . . . . 0.0 109.281 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.1 mp -79.42 0.64 28.5 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.881 -0.512 . . . . 0.0 111.004 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 31.7 tttm -91.53 -26.03 18.96 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.171 -0.956 . . . . 0.0 109.839 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -85.06 -14.44 47.24 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.5 -0.75 . . . . 0.0 110.656 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 20.4 mtpt -102.92 -29.92 11.13 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.327 -0.858 . . . . 0.0 109.854 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -75.1 -53.24 9.22 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.631 -0.668 . . . . 0.0 109.684 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -69.28 -9.02 51.3 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.639 -0.663 . . . . 0.0 111.47 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 43.8 mttm -109.02 -33.71 6.82 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.085 -1.009 . . . . 0.0 110.697 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -87.02 -33.95 19.39 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.418 -0.801 . . . . 0.0 111.003 -179.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.2 tp . . . . . 0 N--CA 1.496 1.873 0 O-C-N 121.433 -0.792 . . . . 0.0 110.909 -179.45 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo . . . . . 0 N--CA 1.484 0.968 0 N-CA-C 110.406 -0.652 . . . . 0.0 110.406 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -103.86 33.28 3.49 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.513 -0.742 . . . . 0.0 110.399 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -169.63 100.75 0.47 Allowed Pre-proline 0 N--CA 1.495 1.797 0 O-C-N 121.795 -0.566 . . . . 0.0 110.584 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.42 ' HB3' ' CD2' ' A' ' 69' ' ' TYR . 46.6 Cg_endo -75.26 116.46 4.55 Favored 'Trans proline' 0 C--N 1.319 -1.018 0 O-C-N 123.305 1.161 . . . . 0.0 110.168 179.616 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -81.5 163.82 19.06 Favored 'Trans proline' 0 C--N 1.317 -1.087 0 O-C-N 123.255 1.134 . . . . 0.0 110.38 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.7 t -164.98 62.44 0.13 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.582 -0.699 . . . . 0.0 110.518 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 65.48 -78.1 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.167 -0.958 . . . . 0.0 110.048 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -47.66 -50.11 25.62 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.347 -0.845 . . . . 0.0 111.435 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -58.42 -37.23 74.94 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.538 -0.726 . . . . 0.0 109.924 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 43.7 mt -67.95 -39.71 83.38 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.642 -0.661 . . . . 0.0 110.104 -179.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.497 ' CE2' ' CE1' ' A' ' 23' ' ' TYR . 37.9 t80 -72.69 -52.88 13.4 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.667 -0.645 . . . . 0.0 110.868 -179.324 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 23.3 t -57.57 -50.51 72.86 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.527 -0.733 . . . . 0.0 110.716 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 94.4 p -60.19 -26.97 66.76 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.525 -0.734 . . . . 0.0 110.844 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -95.36 -23.84 17.0 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.407 -0.808 . . . . 0.0 111.372 -179.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.497 ' CE1' ' CE2' ' A' ' 19' ' ' PHE . 7.0 m-85 -91.53 -33.64 15.08 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.278 -0.889 . . . . 0.0 111.003 -179.308 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.502 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 17.9 mtt180 -48.5 -52.72 41.57 Favored Pre-proline 0 N--CA 1.498 1.938 0 O-C-N 121.313 -0.867 . . . . 0.0 112.138 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.502 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 36.2 Cg_endo -59.65 -28.36 87.18 Favored 'Trans proline' 0 N--CA 1.495 1.597 0 O-C-N 123.265 1.14 . . . . 0.0 110.134 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.67 -44.42 74.1 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 178.109 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.3 mm -59.63 -31.09 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.112 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.511 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 5.4 mmmm -72.78 -38.24 67.35 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 120.032 -0.667 . . . . 0.0 110.575 -177.043 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.9 t -57.7 -26.43 61.72 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.384 -0.822 . . . . 0.0 110.756 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -115.25 -22.85 9.21 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.519 -0.738 . . . . 0.0 110.822 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 33.7 m80 -122.18 95.57 47.16 Favored Pre-proline 0 N--CA 1.496 1.87 0 O-C-N 121.452 -0.78 . . . . 0.0 109.635 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -75.13 -40.49 0.85 Allowed 'Trans proline' 0 C--N 1.315 -1.193 0 O-C-N 123.464 1.244 . . . . 0.0 110.189 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.405 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -70.21 -19.33 75.69 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.63 85.3 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.527 -0.984 . . . . 0.0 111.11 -179.509 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.405 ' N ' ' O ' ' A' ' 33' ' ' GLY . 66.3 m -73.4 174.45 8.14 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.432 -0.792 . . . . 0.0 109.836 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 41.3 mm -54.57 -33.22 26.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 O-C-N 121.393 -0.817 . . . . 0.0 110.238 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.05 -64.89 3.93 Favored Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.1 -36.06 77.13 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.613 -0.934 . . . . 0.0 110.267 179.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.0 m -62.66 -30.7 71.57 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.356 -0.84 . . . . 0.0 110.209 179.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.22 -44.26 38.47 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.51 -0.743 . . . . 0.0 110.119 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -86.65 -14.15 43.49 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.542 -0.724 . . . . 0.0 111.784 -179.158 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -87.04 6.95 29.88 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.92 -1.113 . . . . 0.0 110.453 179.319 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 14.6 mt -103.89 -29.58 10.89 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.089 -1.007 . . . . 0.0 109.664 179.355 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -66.83 -29.41 74.63 Favored Glycine 0 N--CA 1.492 2.427 0 N-CA-C 109.449 -1.46 . . . . 0.0 109.449 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -52.4 -44.23 65.24 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.474 -1.015 . . . . 0.0 110.731 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 17.4 mtt -86.32 -42.12 13.98 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.631 -0.668 . . . . 0.0 109.873 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 73.8 t-105 -55.21 -23.18 20.81 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.577 -0.702 . . . . 0.0 110.894 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 38.1 t -94.55 -32.89 13.26 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.44 -0.788 . . . . 0.0 110.006 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -62.69 -37.08 85.04 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.589 -0.694 . . . . 0.0 109.677 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -63.22 156.4 25.48 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.669 -0.645 . . . . 0.0 109.903 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.2 m -104.94 -152.3 0.46 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.733 -0.604 . . . . 0.0 109.382 179.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -84.61 54.19 2.94 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.389 -0.819 . . . . 0.0 109.92 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 52.5 mttm -130.04 -51.56 1.12 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.466 -0.771 . . . . 0.0 110.251 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -75.21 -23.46 57.62 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.478 -0.764 . . . . 0.0 111.347 -179.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 3.5 mppt? -89.89 -40.23 12.54 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.239 -0.913 . . . . 0.0 110.911 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -43.72 -56.71 6.8 Favored Pre-proline 0 N--CA 1.508 2.437 0 O-C-N 121.585 -0.697 . . . . 0.0 112.497 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -70.47 -35.77 10.02 Favored 'Trans proline' 0 C--N 1.316 -1.164 0 O-C-N 122.993 0.996 . . . . 0.0 110.194 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -76.04 -9.86 58.96 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.608 -0.682 . . . . 0.0 110.786 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -76.5 -58.47 3.26 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.218 -0.926 . . . . 0.0 110.005 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -48.81 -27.95 3.36 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.6 -0.688 . . . . 0.0 111.491 -179.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 41.5 tttt -58.35 -53.33 59.55 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.395 -0.815 . . . . 0.0 109.984 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.52 -9.92 59.18 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.581 -0.7 . . . . 0.0 110.436 179.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.92 -0.16 47.19 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.355 -0.841 . . . . 0.0 110.081 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 20.2 mmtt -105.49 -28.12 11.0 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.136 -0.977 . . . . 0.0 109.733 179.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.6 mp -88.24 -10.39 49.86 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.837 -0.54 . . . . 0.0 110.18 178.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 5.3 tppt? -80.55 -32.75 36.6 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.388 -0.82 . . . . 0.0 109.202 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -67.94 -60.23 2.66 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 120.071 -0.652 . . . . 0.0 109.401 179.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.0 mmmt -57.37 -24.78 57.41 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.604 -0.685 . . . . 0.0 110.598 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.42 ' CD2' ' HB3' ' A' ' 12' ' ' PRO . 12.8 t80 -73.27 -66.58 0.67 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.388 -0.82 . . . . 0.0 109.48 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -61.43 -16.23 44.8 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.848 -0.533 . . . . 0.0 111.38 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.8 ttmm -97.76 -24.19 15.57 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.176 -0.952 . . . . 0.0 111.231 -179.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -103.83 -30.1 10.58 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.398 -0.814 . . . . 0.0 110.862 -179.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 7.7 tp . . . . . 0 N--CA 1.496 1.839 0 O-C-N 121.368 -0.832 . . . . 0.0 110.313 -179.682 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo . . . . . 0 N--CA 1.484 0.956 0 N-CA-C 110.419 -0.647 . . . . 0.0 110.419 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.97 -170.0 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.531 -0.731 . . . . 0.0 110.67 -179.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.72 145.61 98.15 Favored Pre-proline 0 N--CA 1.497 1.884 0 O-C-N 121.498 -0.751 . . . . 0.0 110.437 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -76.28 129.65 11.39 Favored 'Trans proline' 0 C--N 1.318 -1.027 0 O-C-N 123.393 1.207 . . . . 0.0 109.883 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -81.8 -173.65 1.86 Allowed 'Trans proline' 0 C--N 1.317 -1.113 0 O-C-N 123.264 1.139 . . . . 0.0 110.428 -179.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 60.6 p -161.7 59.64 0.26 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.567 -0.708 . . . . 0.0 110.516 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 66.82 -76.88 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.083 -1.011 . . . . 0.0 110.169 -179.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.428 ' CE2' ' CD1' ' A' ' 47' ' ' TRP . 5.5 t80 -47.74 -49.88 26.97 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.298 -0.876 . . . . 0.0 111.348 -179.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -57.99 -35.98 71.98 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.643 -0.661 . . . . 0.0 109.982 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 41.6 mt -70.9 -36.85 72.9 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.532 -0.73 . . . . 0.0 110.265 -179.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.503 ' CZ ' ' CE2' ' A' ' 23' ' ' TYR . 50.8 t80 -76.15 -54.23 7.12 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.563 -0.71 . . . . 0.0 110.497 -179.412 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 48.8 t -58.03 -51.78 68.25 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.565 -0.709 . . . . 0.0 110.616 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 72.2 p -57.84 -22.95 50.46 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.536 -0.728 . . . . 0.0 111.036 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.4 mm-40 -102.6 -24.98 13.73 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.354 -0.841 . . . . 0.0 111.446 -179.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.503 ' CE2' ' CZ ' ' A' ' 19' ' ' PHE . 10.4 m-85 -93.09 12.61 23.59 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.308 -0.87 . . . . 0.0 111.595 -179.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.49 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 3.6 mtp180 -85.76 -45.33 0.61 Allowed Pre-proline 0 N--CA 1.489 1.478 0 O-C-N 121.145 -0.972 . . . . 0.0 112.03 179.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.502 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 37.7 Cg_endo -65.83 -15.41 48.94 Favored 'Trans proline' 0 N--CA 1.49 1.318 0 O-C-N 122.883 0.938 . . . . 0.0 110.483 -179.13 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.5 tmtm? -73.4 -51.64 16.6 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 177.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 37.5 mm -52.61 -33.71 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 CA-C-O 121.465 0.65 . . . . 0.0 110.317 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.507 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 5.7 mmmm -72.18 -37.49 69.3 Favored 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.279 -177.243 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.9 t -59.13 -25.48 63.89 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.466 -0.771 . . . . 0.0 110.753 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -116.8 -23.37 8.13 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.421 -0.8 . . . . 0.0 110.873 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 37.4 m80 -120.65 96.33 48.87 Favored Pre-proline 0 N--CA 1.496 1.87 0 O-C-N 121.403 -0.81 . . . . 0.0 109.574 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -75.32 -32.66 4.86 Favored 'Trans proline' 0 C--N 1.316 -1.16 0 O-C-N 123.465 1.245 . . . . 0.0 110.464 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -80.45 -13.44 81.7 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.83 83.19 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.381 -1.07 . . . . 0.0 110.987 -179.5 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 78.2 p -74.72 170.64 15.44 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.541 -0.724 . . . . 0.0 109.78 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.2 mm -52.6 -27.7 11.79 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.155 0 O-C-N 121.218 -0.926 . . . . 0.0 110.369 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -61.56 -71.67 0.77 Allowed Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.118 -1.593 . . . . 0.0 109.118 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.417 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 7.1 t70 -67.33 -25.01 65.8 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.642 -0.917 . . . . 0.0 110.623 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 64.5 m -71.64 -46.98 57.37 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.549 -0.719 . . . . 0.0 109.962 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -52.55 -41.79 63.85 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.545 -0.722 . . . . 0.0 110.069 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -86.03 -10.15 55.52 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.72 -0.613 . . . . 0.0 111.231 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.417 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -74.21 -59.48 2.71 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.004 -1.06 . . . . 0.0 109.449 179.236 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 14.5 mt -53.51 -27.74 27.31 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.806 -0.559 . . . . 0.0 110.899 -179.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -60.34 -45.44 96.15 Favored Glycine 0 N--CA 1.496 2.669 0 N-CA-C 109.614 -1.394 . . . . 0.0 109.614 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -62.32 -48.89 77.84 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.567 -0.96 . . . . 0.0 109.878 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 17.5 mmt -60.13 -24.5 64.75 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.588 -0.695 . . . . 0.0 110.551 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . 0.428 ' CD1' ' CE2' ' A' ' 16' ' ' PHE . 72.4 t-105 -79.71 -48.93 12.84 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.537 -0.727 . . . . 0.0 109.473 179.539 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.1 t -67.66 -26.96 66.46 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.64 -0.663 . . . . 0.0 110.007 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -68.22 -44.72 75.13 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.557 -0.714 . . . . 0.0 109.596 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 19.7 mm-40 -57.17 153.3 12.06 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.618 -0.676 . . . . 0.0 110.372 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.4 t -98.34 -152.47 0.4 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.649 -0.657 . . . . 0.0 109.533 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -88.01 49.55 1.82 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.38 -0.825 . . . . 0.0 110.082 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -127.48 -49.14 1.41 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.512 -0.743 . . . . 0.0 110.289 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -67.2 -27.4 67.23 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.461 -0.774 . . . . 0.0 110.74 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.3 tttt -81.43 -36.53 29.34 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.414 -0.804 . . . . 0.0 110.713 -179.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -43.83 -52.95 13.73 Favored Pre-proline 0 N--CA 1.507 2.386 0 O-C-N 121.507 -0.745 . . . . 0.0 112.324 -178.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -78.53 -37.19 0.73 Allowed 'Trans proline' 0 C--N 1.315 -1.206 0 O-C-N 123.172 1.09 . . . . 0.0 111.073 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.59 1.42 46.1 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.433 -0.792 . . . . 0.0 112.102 -178.362 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.69 -23.86 15.76 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.023 -1.048 . . . . 0.0 110.601 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -77.85 -22.56 49.72 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.442 -0.786 . . . . 0.0 110.29 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 65.4 tttt -61.32 -43.14 99.37 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.411 -0.806 . . . . 0.0 109.944 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -74.2 -10.84 60.01 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.619 -0.676 . . . . 0.0 110.658 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -86.08 3.06 44.17 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.299 -0.875 . . . . 0.0 110.451 179.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 36.7 mmtm -105.64 -31.61 8.84 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.181 -0.949 . . . . 0.0 109.741 179.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.5 mp -82.38 1.73 35.83 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.802 -0.561 . . . . 0.0 110.624 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 65.7 tttt -91.49 -28.46 17.59 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.205 -0.934 . . . . 0.0 109.629 179.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -87.07 -10.89 51.81 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.61 -0.681 . . . . 0.0 110.613 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 34.3 mmtt -103.73 -34.19 8.67 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.336 -0.853 . . . . 0.0 109.551 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -73.78 -53.83 9.41 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.74 -0.6 . . . . 0.0 109.685 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -68.41 -12.31 60.96 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.7 -0.625 . . . . 0.0 111.219 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.83 -31.73 8.7 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.288 -0.882 . . . . 0.0 110.972 -179.471 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -91.22 -35.64 14.39 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.403 -0.811 . . . . 0.0 111.096 -179.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.5 tp . . . . . 0 N--CA 1.5 2.064 0 O-C-N 121.308 -0.87 . . . . 0.0 110.95 -179.179 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo . . . . . 0 N--CA 1.485 0.995 0 N-CA-C 110.688 -0.543 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.61 -161.03 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.638 -0.663 . . . . 0.0 109.974 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.33 140.96 93.13 Favored Pre-proline 0 N--CA 1.497 1.921 0 O-C-N 121.236 -0.915 . . . . 0.0 110.099 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -75.24 135.52 18.75 Favored 'Trans proline' 0 C--N 1.318 -1.077 0 O-C-N 123.314 1.165 . . . . 0.0 109.767 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -80.04 -177.32 3.73 Favored 'Trans proline' 0 C--N 1.317 -1.092 0 O-C-N 123.285 1.15 . . . . 0.0 110.262 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.2 t -159.36 59.5 0.4 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.418 -0.801 . . . . 0.0 110.47 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 67.6 -75.53 0.06 Allowed 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.196 -0.94 . . . . 0.0 110.172 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -48.49 -48.73 37.82 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.333 -0.855 . . . . 0.0 111.271 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -59.66 -41.41 90.53 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.511 -0.743 . . . . 0.0 109.189 179.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.1 mt -62.05 -46.3 89.75 Favored 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.993 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -64.31 -50.37 68.09 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.603 -0.686 . . . . 0.0 110.006 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.6 t -68.64 -19.01 64.4 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.59 -0.693 . . . . 0.0 110.28 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.7 t -76.95 -17.69 58.74 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.286 -0.884 . . . . 0.0 111.725 -178.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -128.58 -14.45 4.65 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.02 -1.05 . . . . 0.0 112.776 -178.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -87.92 13.85 10.06 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 120.944 -1.097 . . . . 0.0 111.671 -179.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.479 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 11.2 mtp180 -87.53 -45.97 0.5 Allowed Pre-proline 0 N--CA 1.49 1.556 0 O-C-N 121.162 -0.961 . . . . 0.0 112.386 179.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.498 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.1 Cg_endo -65.92 -15.97 50.9 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 O-C-N 122.981 0.99 . . . . 0.0 110.663 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.9 tmtt? -73.28 -52.34 14.31 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 177.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 42.1 mm -52.53 -30.98 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 CA-C-O 121.36 0.6 . . . . 0.0 110.439 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.498 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 6.2 mmmm -73.11 -36.78 66.82 Favored 'General case' 0 N--CA 1.498 1.945 0 C-N-CA 120.111 -0.636 . . . . 0.0 110.334 -177.246 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.2 t -58.7 -25.26 62.69 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.429 -0.795 . . . . 0.0 110.679 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -118.26 -22.84 7.52 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.515 -0.741 . . . . 0.0 110.949 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 34.4 m80 -121.11 96.54 48.34 Favored Pre-proline 0 N--CA 1.496 1.863 0 O-C-N 121.281 -0.887 . . . . 0.0 109.669 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -75.23 -35.58 2.91 Favored 'Trans proline' 0 C--N 1.315 -1.192 0 O-C-N 123.426 1.224 . . . . 0.0 110.513 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.78 -11.27 85.59 Favored Glycine 0 N--CA 1.492 2.409 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.44 80.91 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.209 -1.171 . . . . 0.0 110.55 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.4 t -75.03 173.69 10.38 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.522 -0.737 . . . . 0.0 109.485 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 39.0 mm -51.08 -32.02 11.59 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.213 0 O-C-N 121.187 -0.946 . . . . 0.0 110.503 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.6 -74.4 0.37 Allowed Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.223 -1.551 . . . . 0.0 109.223 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.97 -23.24 67.33 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.657 -0.908 . . . . 0.0 110.85 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 38.9 m -72.24 -46.22 56.93 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.366 -0.834 . . . . 0.0 109.904 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -53.34 -49.48 67.01 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.416 -0.803 . . . . 0.0 110.073 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.97 -12.37 60.33 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.763 -0.586 . . . . 0.0 111.152 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.57 -57.93 3.66 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.154 -0.966 . . . . 0.0 109.631 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 22.2 mt -54.5 -34.6 61.94 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.725 -0.609 . . . . 0.0 111.064 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -61.02 -49.68 75.86 Favored Glycine 0 N--CA 1.494 2.558 0 N-CA-C 109.974 -1.25 . . . . 0.0 109.974 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -53.69 -35.59 61.27 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.401 -1.058 . . . . 0.0 110.833 -179.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 20.2 mmt -69.1 -50.95 43.55 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.621 -0.674 . . . . 0.0 109.488 179.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 31.2 t-105 -51.37 -58.31 6.59 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.708 -0.62 . . . . 0.0 110.818 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 12.6 t -60.97 -34.57 74.97 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.517 -0.739 . . . . 0.0 110.382 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -58.48 -41.6 85.65 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.576 -0.702 . . . . 0.0 110.432 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 41.7 mm-40 -67.17 167.79 11.47 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.46 -0.775 . . . . 0.0 110.029 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.1 m -141.06 96.09 2.94 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.53 -0.731 . . . . 0.0 110.506 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 51.84 46.4 26.63 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.409 -0.807 . . . . 0.0 111.133 179.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 11.3 tmtt? -141.48 -63.03 0.46 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.538 -0.726 . . . . 0.0 110.254 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -61.89 -17.45 56.64 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.581 -0.699 . . . . 0.0 110.904 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 53.1 tttm -99.29 -32.38 11.22 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.238 -0.913 . . . . 0.0 110.765 -179.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.412 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 7.4 mt-30 -43.51 -56.72 6.54 Favored Pre-proline 0 N--CA 1.508 2.461 0 O-C-N 121.469 -0.769 . . . . 0.0 112.273 -178.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.412 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.4 Cg_endo -78.75 -35.14 1.11 Allowed 'Trans proline' 0 C--N 1.316 -1.18 0 O-C-N 123.059 1.031 . . . . 0.0 110.658 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -83.85 5.8 23.85 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.445 -0.784 . . . . 0.0 112.186 -178.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -101.35 -21.36 14.86 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 120.965 -1.084 . . . . 0.0 110.625 179.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -78.88 -23.55 44.77 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.422 -0.798 . . . . 0.0 110.277 179.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 48.3 tttm -62.91 -41.35 99.43 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.479 -0.763 . . . . 0.0 109.985 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.12 -9.21 57.67 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.596 -0.69 . . . . 0.0 110.896 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -89.07 4.57 47.94 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.232 -0.917 . . . . 0.0 110.646 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -105.89 -32.61 8.27 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.128 -0.982 . . . . 0.0 109.611 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.9 mp -79.3 1.18 25.88 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.826 -0.546 . . . . 0.0 111.034 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 72.7 tttt -93.2 -23.37 18.57 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.161 -0.962 . . . . 0.0 109.957 179.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -85.24 -12.66 52.0 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.377 -0.827 . . . . 0.0 110.654 179.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -102.8 -31.24 10.4 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.327 -0.858 . . . . 0.0 109.52 179.474 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 22.2 t80 -74.65 -55.08 6.27 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.799 -0.563 . . . . 0.0 109.671 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -66.3 -12.31 55.74 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.756 -0.59 . . . . 0.0 111.437 -179.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -103.68 -31.13 10.03 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.187 -0.945 . . . . 0.0 110.612 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -92.38 -31.12 15.45 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.445 -0.785 . . . . 0.0 110.955 -179.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.6 tp . . . . . 0 N--CA 1.496 1.858 0 O-C-N 121.361 -0.837 . . . . 0.0 110.839 -179.437 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.415 ' O ' ' CD1' ' A' ' 69' ' ' TYR . 55.6 Cg_endo . . . . . 0 N--CA 1.488 1.174 0 N-CA-C 111.515 -0.225 . . . . 0.0 111.515 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.5 tptt -71.97 164.22 26.48 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.021 -1.05 . . . . 0.0 110.228 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 49.17 94.83 0.04 OUTLIER Pre-proline 0 N--CA 1.5 2.056 0 O-C-N 121.579 -0.701 . . . . 0.0 111.604 179.705 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -73.52 136.51 23.83 Favored 'Trans proline' 0 C--N 1.316 -1.176 0 O-C-N 123.431 1.227 . . . . 0.0 109.769 179.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -79.96 167.89 19.63 Favored 'Trans proline' 0 C--N 1.316 -1.134 0 O-C-N 123.273 1.144 . . . . 0.0 110.362 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 57.5 p -161.37 66.38 0.28 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.569 -0.707 . . . . 0.0 110.456 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 65.79 -77.5 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.166 -0.958 . . . . 0.0 110.015 -179.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -51.13 -42.63 60.86 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.246 -0.908 . . . . 0.0 110.924 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -63.99 -25.04 67.95 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.617 -0.677 . . . . 0.0 109.966 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 41.7 mt -84.6 -39.06 19.16 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.508 -0.745 . . . . 0.0 110.363 -179.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.501 ' CE2' ' CZ ' ' A' ' 23' ' ' TYR . 44.5 t80 -69.32 -50.44 46.52 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.578 -0.701 . . . . 0.0 110.464 -179.5 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 35.5 t -65.95 -33.46 75.86 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.541 -0.724 . . . . 0.0 110.083 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 29.4 t -82.16 1.17 37.51 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.513 -0.742 . . . . 0.0 111.599 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -133.96 1.9 3.33 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.975 -1.078 . . . . 0.0 111.881 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.501 ' CZ ' ' CE2' ' A' ' 19' ' ' PHE . 8.6 m-85 -110.88 -27.02 9.01 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 120.969 -1.082 . . . . 0.0 110.878 -179.646 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.503 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 18.5 mtp180 -49.14 -52.03 51.41 Favored Pre-proline 0 N--CA 1.497 1.916 0 O-C-N 121.326 -0.859 . . . . 0.0 112.252 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 35.7 Cg_endo -59.37 -29.11 89.34 Favored 'Trans proline' 0 N--CA 1.495 1.576 0 O-C-N 123.171 1.09 . . . . 0.0 110.28 -179.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.8 tmtm? -68.26 -43.75 77.13 Favored 'General case' 0 N--CA 1.493 1.675 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 178.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.1 mm -60.99 -30.27 47.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.177 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.515 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 5.1 mmmm -73.14 -38.2 66.35 Favored 'General case' 0 N--CA 1.497 1.881 0 C-N-CA 119.937 -0.705 . . . . 0.0 110.633 -177.113 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 13.8 t -56.94 -26.83 60.32 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.324 -0.86 . . . . 0.0 110.707 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -114.86 -24.65 8.56 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.567 -0.708 . . . . 0.0 110.738 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 30.5 m80 -120.63 95.69 48.96 Favored Pre-proline 0 N--CA 1.497 1.897 0 O-C-N 121.464 -0.773 . . . . 0.0 109.649 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -75.06 -41.49 0.64 Allowed 'Trans proline' 0 C--N 1.315 -1.193 0 O-C-N 123.409 1.215 . . . . 0.0 110.19 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.416 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -69.07 -19.93 74.31 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 110.077 -1.209 . . . . 0.0 110.077 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.42 84.98 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.528 -0.983 . . . . 0.0 111.175 -179.397 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.416 ' N ' ' O ' ' A' ' 33' ' ' GLY . 71.9 p -73.27 175.81 6.52 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.452 -0.78 . . . . 0.0 109.657 179.732 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 43.5 mm -56.31 -32.64 35.8 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 O-C-N 121.395 -0.816 . . . . 0.0 110.128 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.7 -65.18 3.67 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.26 -1.536 . . . . 0.0 109.26 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.37 -36.55 79.36 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.56 -0.965 . . . . 0.0 110.299 179.573 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 93.8 m -63.29 -29.93 71.16 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.448 -0.782 . . . . 0.0 110.063 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.75 -44.89 39.44 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.559 -0.713 . . . . 0.0 109.795 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -86.71 -11.78 50.19 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.606 -0.684 . . . . 0.0 111.892 -179.22 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.5 tptt -87.83 6.75 33.81 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 120.813 -1.18 . . . . 0.0 110.495 179.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.9 mt -101.08 -27.76 13.08 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.193 -0.942 . . . . 0.0 109.515 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -68.96 -28.25 73.19 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.168 -1.573 . . . . 0.0 109.168 179.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -57.5 -54.9 41.62 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.445 -1.032 . . . . 0.0 109.875 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 33.6 mtt -68.48 -52.33 33.53 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 120.125 -0.63 . . . . 0.0 109.398 179.203 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . 0.413 ' CH2' ' HG2' ' A' ' 55' ' ' LYS . 54.6 t-105 -50.77 -58.02 6.96 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.49 -0.756 . . . . 0.0 110.936 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 26.6 t -59.19 -34.2 71.85 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.435 -0.791 . . . . 0.0 110.39 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -61.73 -40.88 96.64 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.596 -0.69 . . . . 0.0 109.973 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -60.0 155.52 16.63 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.635 -0.666 . . . . 0.0 110.307 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.6 m -106.49 -152.12 0.47 Allowed 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.01 58.72 3.01 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.332 -0.855 . . . . 0.0 109.953 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 8.8 tttp -139.93 -52.6 0.52 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.401 -0.812 . . . . 0.0 110.211 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -62.45 -25.56 68.04 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.511 -0.743 . . . . 0.0 110.586 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.413 ' HG2' ' CH2' ' A' ' 47' ' ' TRP . 14.7 mtpt -81.57 -34.47 31.02 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.404 -0.81 . . . . 0.0 110.607 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -44.64 -52.53 17.68 Favored Pre-proline 0 N--CA 1.507 2.387 0 O-C-N 121.572 -0.705 . . . . 0.0 111.986 -179.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -78.71 -38.22 0.53 Allowed 'Trans proline' 0 C--N 1.315 -1.227 0 O-C-N 123.263 1.138 . . . . 0.0 110.85 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.1 5.0 23.97 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.51 -0.744 . . . . 0.0 112.055 -178.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.44 -23.07 15.25 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.053 -1.029 . . . . 0.0 110.363 179.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -77.48 -26.22 51.11 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.474 -0.766 . . . . 0.0 110.214 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 72.8 tttt -59.57 -42.26 92.04 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.538 -0.726 . . . . 0.0 110.115 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.48 -11.09 60.54 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.573 -0.705 . . . . 0.0 110.63 179.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.66 4.94 34.17 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.195 -0.941 . . . . 0.0 110.537 179.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 40.4 mmtt -105.82 -34.79 7.55 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.198 -0.939 . . . . 0.0 109.309 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.6 mp -82.36 -2.34 52.62 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.828 -0.545 . . . . 0.0 110.362 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 30.0 tptt -83.3 -33.94 25.83 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.27 -0.894 . . . . 0.0 109.112 179.166 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -67.7 -61.73 1.75 Allowed 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.168 179.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -58.87 -18.54 33.75 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.736 -0.602 . . . . 0.0 111.067 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.415 ' CD1' ' O ' ' A' ' 9' ' ' PRO . 9.5 t80 -78.49 -60.38 2.4 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.229 -0.919 . . . . 0.0 109.494 179.465 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -76.71 -1.04 25.89 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.599 -0.688 . . . . 0.0 111.561 -179.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.7 ttmt -113.0 -37.61 4.75 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.995 -1.066 . . . . 0.0 111.228 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -86.93 -31.19 20.82 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.417 -0.802 . . . . 0.0 111.284 -179.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.0 tp . . . . . 0 N--CA 1.498 1.974 0 O-C-N 121.434 -0.791 . . . . 0.0 111.129 -179.373 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.404 ' O ' ' CD1' ' A' ' 69' ' ' TYR . 49.2 Cg_endo . . . . . 0 N--CA 1.483 0.861 0 N-CA-C 110.268 -0.705 . . . . 0.0 110.268 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.1 pttp -99.66 30.59 3.56 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.479 -0.763 . . . . 0.0 110.853 -179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.53 100.57 0.43 Allowed Pre-proline 0 N--CA 1.497 1.896 0 O-C-N 121.7 -0.625 . . . . 0.0 110.811 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -76.26 118.69 5.03 Favored 'Trans proline' 0 C--N 1.319 -1.02 0 O-C-N 123.263 1.138 . . . . 0.0 110.1 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -81.93 166.41 16.95 Favored 'Trans proline' 0 C--N 1.318 -1.077 0 O-C-N 123.236 1.124 . . . . 0.0 110.446 -179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.4 t -156.69 54.78 0.54 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.466 -0.771 . . . . 0.0 110.582 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 67.99 -76.23 0.06 Allowed 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.256 -0.902 . . . . 0.0 109.965 -179.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -48.81 -49.91 36.84 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.357 -0.839 . . . . 0.0 111.378 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.03 -40.73 81.62 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.541 -0.724 . . . . 0.0 109.629 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 59.9 mt -60.52 -48.07 83.37 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.695 -0.628 . . . . 0.0 110.159 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.409 ' CZ ' ' CE1' ' A' ' 23' ' ' TYR . 60.6 t80 -66.88 -50.19 63.27 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.674 -0.641 . . . . 0.0 110.443 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.5 m -64.07 -31.93 73.3 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.507 -0.746 . . . . 0.0 109.966 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.0 m -65.48 -22.9 66.79 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.636 -0.665 . . . . 0.0 110.768 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -107.2 -25.71 11.4 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.405 -0.809 . . . . 0.0 111.55 -179.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.409 ' CE1' ' CZ ' ' A' ' 19' ' ' PHE . 0.6 OUTLIER -83.21 -34.75 25.83 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.13 -0.981 . . . . 0.0 110.928 -179.133 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.492 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 35.5 mtt180 -48.43 -53.18 37.25 Favored Pre-proline 0 N--CA 1.498 1.925 0 O-C-N 121.275 -0.89 . . . . 0.0 112.022 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.492 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 36.4 Cg_endo -59.93 -27.09 84.16 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 O-C-N 123.169 1.089 . . . . 0.0 110.182 179.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.4 tmtt? -69.55 -44.83 70.12 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.1 mm -59.08 -35.0 54.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 CA-C-O 121.084 0.468 . . . . 0.0 110.094 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.536 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 4.8 mmmm -70.15 -39.92 75.08 Favored 'General case' 0 N--CA 1.497 1.908 0 C-N-CA 120.09 -0.644 . . . . 0.0 110.43 -177.173 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.9 t -57.67 -25.64 60.54 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.348 -0.845 . . . . 0.0 110.891 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -114.0 -23.62 9.47 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.508 -0.745 . . . . 0.0 110.654 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 43.6 m80 -120.7 96.06 48.87 Favored Pre-proline 0 N--CA 1.495 1.784 0 O-C-N 121.414 -0.804 . . . . 0.0 109.482 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -74.96 -36.25 2.7 Favored 'Trans proline' 0 C--N 1.316 -1.161 0 O-C-N 123.462 1.243 . . . . 0.0 110.351 -179.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.4 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -75.3 -16.73 80.44 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 110.174 -1.17 . . . . 0.0 110.174 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.86 83.88 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.486 -1.008 . . . . 0.0 111.255 -179.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 33' ' ' GLY . 19.9 m -75.71 172.89 11.86 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.502 -0.749 . . . . 0.0 109.758 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.5 mm -54.6 -28.36 19.17 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.113 0 O-C-N 121.34 -0.85 . . . . 0.0 110.228 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.18 -70.67 0.94 Allowed Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.146 -1.582 . . . . 0.0 109.146 179.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -67.49 -31.99 72.5 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.672 -0.899 . . . . 0.0 110.388 179.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 78.2 m -65.78 -29.93 70.5 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.457 -0.777 . . . . 0.0 109.913 179.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.16 -44.32 60.19 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.638 -0.664 . . . . 0.0 109.566 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -86.92 -13.39 44.89 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.646 -0.659 . . . . 0.0 111.78 -179.36 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.0 tptt -86.23 6.54 29.05 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 120.941 -1.1 . . . . 0.0 110.696 179.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.8 mt -102.1 -28.58 12.25 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.107 -0.996 . . . . 0.0 109.495 179.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -70.4 -29.7 69.8 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.092 -1.603 . . . . 0.0 109.092 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -55.41 -49.83 71.36 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.475 -1.014 . . . . 0.0 110.22 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 31.3 mmt -73.75 -49.72 24.13 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.663 -0.648 . . . . 0.0 109.643 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 62.2 t-105 -51.71 -59.27 4.49 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.479 -0.763 . . . . 0.0 110.847 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.0 t -61.52 -33.39 73.72 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.479 -0.763 . . . . 0.0 110.274 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -59.58 -39.74 85.11 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.54 -0.725 . . . . 0.0 110.284 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -63.48 162.37 12.76 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.579 -0.701 . . . . 0.0 110.297 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 81.1 p -96.18 -147.37 0.29 Allowed 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -85.72 51.85 2.31 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.152 -0.968 . . . . 0.0 110.095 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 9.8 tptp -125.23 -42.82 1.97 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.42 -0.8 . . . . 0.0 110.121 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -62.34 -37.07 84.23 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.563 -0.71 . . . . 0.0 110.728 -179.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 22.0 tttp -91.03 19.9 5.33 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.375 -0.828 . . . . 0.0 111.348 -179.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.444 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 0.7 OUTLIER -94.25 -57.21 0.22 Allowed Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.012 -1.055 . . . . 0.0 110.341 179.888 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.444 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 57.0 Cg_endo -83.28 -31.26 0.68 Allowed 'Trans proline' 0 N--CA 1.484 0.95 0 O-C-N 122.998 0.999 . . . . 0.0 110.577 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -82.33 2.02 34.2 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.49 -0.757 . . . . 0.0 112.004 -178.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -96.72 -21.92 17.29 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.035 -1.041 . . . . 0.0 110.736 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -82.36 -24.64 34.39 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.425 -0.797 . . . . 0.0 110.201 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 71.0 tttt -62.89 -45.0 94.6 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.514 -0.741 . . . . 0.0 109.846 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -74.27 -10.24 59.4 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.623 -0.673 . . . . 0.0 110.835 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.87 0.65 52.53 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.256 -0.902 . . . . 0.0 110.372 179.163 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.79 -30.43 9.41 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.225 -0.922 . . . . 0.0 109.92 179.494 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 6.5 mp -83.22 -7.16 59.65 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.89 -0.506 . . . . 0.0 110.401 179.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.7 ttpt -81.34 -27.33 34.98 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.272 -0.892 . . . . 0.0 109.457 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -85.22 -6.29 59.28 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.674 -0.641 . . . . 0.0 110.363 179.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 36.6 mmtm -105.38 -35.24 7.57 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.367 -0.833 . . . . 0.0 108.888 178.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.404 ' CD1' ' O ' ' A' ' 9' ' ' PRO . 35.8 t80 -75.5 -57.2 4.03 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 179.392 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -57.69 -19.73 29.08 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.665 -0.647 . . . . 0.0 111.218 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 33.2 mmtm -102.75 -24.62 13.71 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.32 -0.863 . . . . 0.0 111.287 -179.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -98.79 -36.53 9.78 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.33 -0.856 . . . . 0.0 111.314 -179.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.7 tp . . . . . 0 N--CA 1.495 1.795 0 O-C-N 121.304 -0.873 . . . . 0.0 110.616 -179.381 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo . . . . . 0 N--CA 1.485 1.001 0 N-CA-C 110.543 -0.599 . . . . 0.0 110.543 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.1 tptt -60.93 -157.39 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.651 -0.656 . . . . 0.0 110.143 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -49.47 140.22 13.94 Favored Pre-proline 0 N--CA 1.502 2.169 0 O-C-N 121.269 -0.895 . . . . 0.0 111.227 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.417 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.0 Cg_endo -76.83 128.69 10.23 Favored 'Trans proline' 0 C--N 1.318 -1.032 0 O-C-N 123.276 1.145 . . . . 0.0 110.263 -179.803 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -82.18 179.46 5.51 Favored 'Trans proline' 0 C--N 1.319 -1.022 0 O-C-N 123.212 1.111 . . . . 0.0 110.23 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -163.17 65.3 0.18 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.554 -0.716 . . . . 0.0 110.257 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 67.02 -76.63 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.185 0 O-C-N 121.183 -0.948 . . . . 0.0 109.938 -179.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.415 ' CD2' ' CD1' ' A' ' 47' ' ' TRP . 6.6 t80 -51.78 -43.22 62.93 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.249 -0.907 . . . . 0.0 111.022 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -63.77 -30.25 71.37 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.612 -0.68 . . . . 0.0 109.386 179.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.2 mt -75.28 -43.97 48.3 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.589 -0.695 . . . . 0.0 110.037 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -65.56 -48.28 72.96 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.627 -0.671 . . . . 0.0 110.077 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 12.0 t -65.93 -29.5 69.93 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.564 -0.71 . . . . 0.0 109.771 179.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.5 t -90.52 7.12 40.6 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.578 -0.701 . . . . 0.0 111.653 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -138.79 0.75 2.03 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 120.973 -1.08 . . . . 0.0 112.11 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -123.58 22.08 9.2 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 120.872 -1.142 . . . . 0.0 110.905 -179.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.473 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 8.6 mtt180 -85.47 -45.98 0.63 Allowed Pre-proline 0 N--CA 1.488 1.439 0 O-C-N 121.447 -0.783 . . . . 0.0 112.064 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.489 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.3 Cg_endo -66.57 -15.44 47.67 Favored 'Trans proline' 0 N--CA 1.491 1.341 0 O-C-N 122.853 0.922 . . . . 0.0 110.613 -179.286 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? -73.39 -50.84 19.75 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 178.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 30.1 mm -54.51 -33.52 26.86 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.942 0 CA-C-O 121.298 0.57 . . . . 0.0 110.263 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.508 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 5.2 mmmm -71.27 -37.12 71.92 Favored 'General case' 0 N--CA 1.498 1.953 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.147 -177.26 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 24.8 t -58.6 -25.61 62.79 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.422 -0.799 . . . . 0.0 110.637 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -115.29 -24.22 8.55 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.55 -0.719 . . . . 0.0 110.618 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 41.2 m80 -119.63 96.56 49.72 Favored Pre-proline 0 N--CA 1.496 1.864 0 O-C-N 121.45 -0.781 . . . . 0.0 109.568 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -75.37 -28.42 8.6 Favored 'Trans proline' 0 C--N 1.315 -1.233 0 O-C-N 123.4 1.211 . . . . 0.0 110.502 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -84.44 -13.55 73.15 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.39 82.36 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.356 -1.085 . . . . 0.0 111.019 -179.441 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.1 t -69.74 170.19 11.43 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.487 -0.758 . . . . 0.0 109.977 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 38.6 mm -52.7 -30.08 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.262 -0.899 . . . . 0.0 110.264 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.0 -65.88 3.1 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.33 -1.508 . . . . 0.0 109.33 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -69.55 -30.49 68.3 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.617 -0.931 . . . . 0.0 110.591 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.2 m -63.76 -29.32 70.54 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.331 -0.856 . . . . 0.0 110.249 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.41 -44.8 27.9 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.576 -0.702 . . . . 0.0 110.169 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -86.02 -13.28 47.95 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.554 -0.716 . . . . 0.0 111.669 -179.398 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.9 tptt -76.88 -59.69 2.67 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.055 -1.028 . . . . 0.0 109.718 179.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 45.1 mt -48.67 -25.12 1.62 Allowed 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.474 -0.766 . . . . 0.0 111.458 -179.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -71.08 -36.98 64.14 Favored Glycine 0 N--CA 1.492 2.403 0 N-CA-C 109.051 -1.62 . . . . 0.0 109.051 179.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -53.86 -38.18 64.42 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.577 -0.955 . . . . 0.0 110.746 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 28.3 mtp -76.41 -49.69 16.09 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.599 -0.688 . . . . 0.0 109.861 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . 0.415 ' CD1' ' CD2' ' A' ' 16' ' ' PHE . 57.6 t-105 -49.99 -53.39 26.86 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.527 -0.733 . . . . 0.0 111.067 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.3 t -59.34 -36.14 75.14 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.447 -0.783 . . . . 0.0 110.459 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -62.29 -39.29 92.46 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.612 -0.68 . . . . 0.0 110.046 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -57.52 154.21 11.56 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.546 -0.721 . . . . 0.0 110.539 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.1 m -102.01 -151.55 0.42 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.694 -0.629 . . . . 0.0 109.457 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.06 52.48 2.53 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.306 -0.871 . . . . 0.0 110.124 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -132.54 -51.75 0.93 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.408 -0.808 . . . . 0.0 110.034 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -64.95 -25.0 67.69 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.687 -0.633 . . . . 0.0 110.47 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 37.7 tttp -81.09 -35.33 31.8 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.524 -0.735 . . . . 0.0 110.534 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -44.23 -52.75 15.57 Favored Pre-proline 0 N--CA 1.507 2.391 0 O-C-N 121.498 -0.751 . . . . 0.0 112.048 -179.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -78.41 -37.42 0.72 Allowed 'Trans proline' 0 C--N 1.315 -1.189 0 O-C-N 123.232 1.122 . . . . 0.0 111.045 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -84.85 4.67 32.11 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.344 -0.847 . . . . 0.0 112.146 -178.433 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -101.02 -24.15 14.38 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.002 -1.061 . . . . 0.0 110.552 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -75.28 -23.32 57.4 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.446 -0.784 . . . . 0.0 110.284 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 66.7 tttt -60.42 -41.66 94.39 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.561 -0.712 . . . . 0.0 110.145 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.41 -11.51 60.49 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.494 -0.754 . . . . 0.0 110.569 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -83.69 2.62 36.83 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.222 -0.923 . . . . 0.0 110.383 179.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 26.6 mmtm -105.33 -32.12 8.74 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.196 -0.94 . . . . 0.0 109.742 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 6.2 mp -83.57 1.73 40.67 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.832 -0.543 . . . . 0.0 110.685 179.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 74.4 tttt -92.28 -32.02 15.18 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.232 -0.918 . . . . 0.0 109.508 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -83.53 -12.8 55.75 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.658 -0.651 . . . . 0.0 110.56 179.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -105.07 -28.19 11.18 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.318 -0.864 . . . . 0.0 109.464 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.417 ' CE2' ' HD3' ' A' ' 12' ' ' PRO . 17.5 t80 -76.74 -54.54 6.5 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.775 -0.578 . . . . 0.0 109.6 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -64.04 -14.2 52.65 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.578 -0.702 . . . . 0.0 111.348 -179.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt -106.79 -29.96 9.21 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.26 -0.9 . . . . 0.0 111.125 -179.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -96.02 -34.34 11.8 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.289 -0.882 . . . . 0.0 111.555 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 5.0 tp . . . . . 0 N--CA 1.497 1.897 0 O-C-N 121.187 -0.946 . . . . 0.0 110.731 -179.256 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.436 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 44.4 Cg_endo . . . . . 0 N--CA 1.484 0.947 0 N-CA-C 110.656 -0.555 . . . . 0.0 110.656 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.7 mtpt -67.14 -172.37 0.2 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.694 -0.628 . . . . 0.0 109.956 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.0 mtt85 -52.37 136.34 41.37 Favored Pre-proline 0 N--CA 1.5 2.071 0 O-C-N 121.309 -0.87 . . . . 0.0 110.665 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -74.51 128.85 12.23 Favored 'Trans proline' 0 C--N 1.319 -1.004 0 O-C-N 123.257 1.135 . . . . 0.0 110.262 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -82.25 174.47 9.92 Favored 'Trans proline' 0 C--N 1.317 -1.094 0 O-C-N 123.25 1.132 . . . . 0.0 110.223 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.2 t -157.14 67.44 0.53 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.427 -0.796 . . . . 0.0 110.599 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 65.61 -76.44 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.107 -0.996 . . . . 0.0 110.531 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -48.48 -43.86 35.28 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.262 -0.899 . . . . 0.0 111.229 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -63.86 -26.77 68.76 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 120.126 -0.63 . . . . 0.0 109.949 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 20.7 mt -89.23 -28.35 20.01 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.377 -0.827 . . . . 0.0 110.379 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.495 ' CZ ' ' CE2' ' A' ' 23' ' ' TYR . 36.9 t80 -76.92 -54.62 6.35 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.551 -0.718 . . . . 0.0 110.716 -179.267 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 10.7 t -63.04 -35.66 80.96 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.608 -0.682 . . . . 0.0 110.224 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 46.6 t -69.81 -19.73 63.47 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.564 -0.71 . . . . 0.0 111.063 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -111.6 -17.59 13.0 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.261 -0.899 . . . . 0.0 111.555 -179.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.495 ' CE2' ' CZ ' ' A' ' 19' ' ' PHE . 6.2 m-85 -89.0 -32.24 17.71 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.274 -0.891 . . . . 0.0 110.91 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.507 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 5.3 mtp180 -49.11 -52.23 49.55 Favored Pre-proline 0 N--CA 1.497 1.91 0 O-C-N 121.307 -0.871 . . . . 0.0 111.811 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.507 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 36.2 Cg_endo -59.55 -28.08 86.55 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 O-C-N 123.133 1.07 . . . . 0.0 110.054 179.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.8 tmtt? -69.9 -46.44 65.44 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 108.107 -1.072 . . . . 0.0 108.107 177.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 41.7 mm -56.94 -34.64 44.9 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.051 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.546 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 3.4 mmmm -70.16 -38.85 75.54 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.629 -0.67 . . . . 0.0 110.543 -177.518 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.0 t -58.29 -25.67 62.09 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.482 -0.761 . . . . 0.0 110.941 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -115.86 -24.28 8.24 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.455 -0.778 . . . . 0.0 110.853 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 40.3 m80 -119.96 96.25 49.35 Favored Pre-proline 0 N--CA 1.495 1.802 0 O-C-N 121.522 -0.736 . . . . 0.0 109.456 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -75.21 -29.59 7.75 Favored 'Trans proline' 0 C--N 1.315 -1.203 0 O-C-N 123.434 1.228 . . . . 0.0 110.543 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.401 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -82.72 -15.96 71.8 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.52 82.54 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.501 -1.0 . . . . 0.0 111.28 -179.333 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.401 ' N ' ' O ' ' A' ' 33' ' ' GLY . 66.4 m -69.94 -179.15 1.77 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.39 -0.818 . . . . 0.0 109.66 179.672 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 43.8 mm -56.93 -37.76 56.06 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 O-C-N 121.378 -0.826 . . . . 0.0 110.141 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -57.75 -59.39 10.91 Favored Glycine 0 N--CA 1.494 2.506 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.429 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 45.2 m-20 -67.8 -41.01 83.8 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.613 -0.933 . . . . 0.0 109.998 179.135 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 96.3 m -59.77 -26.93 66.11 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.217 -0.927 . . . . 0.0 110.271 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -83.81 -49.18 9.31 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.545 -0.722 . . . . 0.0 110.416 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -81.2 -12.33 59.19 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.548 -0.72 . . . . 0.0 111.975 -179.068 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.429 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -83.94 -61.56 1.79 Allowed 'General case' 0 N--CA 1.5 2.04 0 O-C-N 120.998 -1.064 . . . . 0.0 109.704 179.542 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 61.8 mt -52.18 -24.51 7.25 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.457 -0.777 . . . . 0.0 111.182 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.1 -39.75 83.61 Favored Glycine 0 N--CA 1.493 2.434 0 N-CA-C 109.728 -1.349 . . . . 0.0 109.728 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -56.71 -33.85 66.88 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.467 -1.019 . . . . 0.0 110.584 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 9.6 mtt -75.82 -51.26 12.96 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.601 -0.687 . . . . 0.0 110.18 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -47.69 -38.97 16.19 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.593 -0.692 . . . . 0.0 111.602 -179.233 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.0 t -81.83 -27.13 33.76 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.33 -0.856 . . . . 0.0 110.341 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -63.61 -41.95 98.27 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.544 -0.722 . . . . 0.0 110.312 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.2 169.33 7.24 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.515 -0.74 . . . . 0.0 109.941 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.6 m -155.52 107.16 2.59 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.493 -0.754 . . . . 0.0 110.529 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 51.92 42.05 29.94 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.475 -0.765 . . . . 0.0 110.915 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.9 mttm -139.3 -76.37 0.35 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.548 -0.72 . . . . 0.0 110.348 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -61.98 -25.98 67.94 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.508 -0.745 . . . . 0.0 110.701 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.4 ttpm? -82.89 -33.71 26.88 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.427 -0.795 . . . . 0.0 110.603 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -44.52 -52.17 18.36 Favored Pre-proline 0 N--CA 1.506 2.35 0 O-C-N 121.526 -0.734 . . . . 0.0 111.907 -179.168 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -79.83 -37.53 0.45 Allowed 'Trans proline' 0 C--N 1.315 -1.186 0 O-C-N 123.262 1.138 . . . . 0.0 110.804 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -84.62 8.76 15.71 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.571 -0.706 . . . . 0.0 112.034 -178.452 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.03 -24.28 13.23 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 120.955 -1.091 . . . . 0.0 110.19 179.511 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -74.87 -26.6 59.79 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.494 -0.754 . . . . 0.0 110.137 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 42.1 tttt -57.21 -43.3 82.67 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.569 -0.707 . . . . 0.0 110.5 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.63 -11.18 60.34 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.452 -0.78 . . . . 0.0 110.774 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.92 -3.52 57.1 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.249 -0.907 . . . . 0.0 110.515 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 64.8 mmtt -97.55 -33.16 11.46 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.254 -0.904 . . . . 0.0 109.655 179.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.9 mp -84.11 5.44 26.11 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.842 -0.536 . . . . 0.0 110.964 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -98.99 -32.79 11.11 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.333 -0.855 . . . . 0.0 109.331 179.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -63.27 -46.67 85.76 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 120.237 -0.585 . . . . 0.0 110.079 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 22.0 tptt -71.29 -63.84 1.03 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.469 -0.769 . . . . 0.0 109.6 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.436 ' CD2' ' HB2' ' A' ' 9' ' ' PRO . 24.4 t80 -36.06 -49.27 0.64 Allowed 'General case' 0 N--CA 1.509 2.486 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -179.296 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -67.16 -32.18 73.1 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.464 -0.773 . . . . 0.0 111.377 -179.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.7 ttmt -95.73 -23.79 16.81 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.323 -0.861 . . . . 0.0 111.703 -178.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -92.14 -24.9 18.95 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.291 -0.881 . . . . 0.0 111.334 -178.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.5 tp . . . . . 0 N--CA 1.495 1.812 0 O-C-N 121.433 -0.792 . . . . 0.0 110.93 -179.527 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo . . . . . 0 N--CA 1.485 0.996 0 N-CA-C 110.229 -0.72 . . . . 0.0 110.229 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -128.82 31.43 4.94 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.553 -0.717 . . . . 0.0 110.514 -179.816 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.1 mtt85 -161.97 85.5 1.6 Allowed Pre-proline 0 N--CA 1.494 1.775 0 O-C-N 121.815 -0.553 . . . . 0.0 110.042 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.417 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.2 Cg_endo -82.24 118.14 2.92 Favored 'Trans proline' 0 C--N 1.317 -1.097 0 O-C-N 123.411 1.216 . . . . 0.0 110.339 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -80.45 173.56 12.23 Favored 'Trans proline' 0 C--N 1.318 -1.04 0 O-C-N 123.278 1.146 . . . . 0.0 110.099 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 41.0 t -166.84 61.29 0.09 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.5 -0.75 . . . . 0.0 110.501 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 68.27 -77.47 0.05 OUTLIER 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.127 -0.983 . . . . 0.0 110.041 -179.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -50.66 -45.28 57.87 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.194 -0.941 . . . . 0.0 110.893 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -60.84 -29.7 69.66 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 120.201 -0.599 . . . . 0.0 109.801 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.4 mt -80.68 -36.54 32.2 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.542 -0.724 . . . . 0.0 110.219 -179.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.499 ' CE2' ' CE2' ' A' ' 23' ' ' TYR . 18.1 t80 -69.41 -52.3 28.25 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.592 -0.692 . . . . 0.0 110.35 -179.588 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 4.4 t -64.43 -29.81 70.85 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.521 -0.737 . . . . 0.0 109.909 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.3 m -70.01 -15.32 63.0 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.6 -0.688 . . . . 0.0 111.536 -179.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.2 -17.64 4.25 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.034 -1.041 . . . . 0.0 112.466 -179.02 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.499 ' CE2' ' CE2' ' A' ' 19' ' ' PHE . 12.9 m-85 -91.27 15.11 12.63 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 120.949 -1.094 . . . . 0.0 111.551 -179.378 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.471 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 17.4 mtt180 -91.92 -42.36 0.37 Allowed Pre-proline 0 N--CA 1.489 1.485 0 O-C-N 121.278 -0.889 . . . . 0.0 112.476 179.429 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.494 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.2 Cg_endo -68.08 -16.19 44.37 Favored 'Trans proline' 0 N--CA 1.49 1.298 0 O-C-N 122.759 0.873 . . . . 0.0 110.386 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -73.16 -51.78 16.59 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 177.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 40.3 mm -52.54 -29.07 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 CA-C-O 121.304 0.573 . . . . 0.0 110.495 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.494 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 6.4 mmmm -75.19 -32.68 61.28 Favored 'General case' 0 N--CA 1.496 1.845 0 C-N-CA 120.091 -0.643 . . . . 0.0 110.214 -177.359 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.9 t -62.59 -25.82 68.28 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.576 -0.702 . . . . 0.0 110.422 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -118.2 -19.39 9.02 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.539 -0.726 . . . . 0.0 111.14 -179.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 34.1 m80 -124.4 95.71 42.78 Favored Pre-proline 0 N--CA 1.498 1.97 0 O-C-N 121.294 -0.878 . . . . 0.0 109.706 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -75.57 -33.95 3.7 Favored 'Trans proline' 0 C--N 1.316 -1.163 0 O-C-N 123.472 1.249 . . . . 0.0 110.248 -179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.411 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -77.03 -18.36 78.75 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.21 83.78 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.491 -1.005 . . . . 0.0 111.297 -179.287 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.411 ' N ' ' O ' ' A' ' 33' ' ' GLY . 63.9 m -75.14 171.01 14.9 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.487 -0.758 . . . . 0.0 109.848 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.0 mm -53.1 -27.57 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 121.343 -0.848 . . . . 0.0 110.303 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -61.22 -67.07 2.29 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.207 -1.557 . . . . 0.0 109.207 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -71.87 -28.55 63.61 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.529 -0.983 . . . . 0.0 110.679 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 86.8 m -65.89 -33.79 76.65 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.36 -0.838 . . . . 0.0 110.159 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.63 -39.35 67.28 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.56 -0.712 . . . . 0.0 110.276 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -91.51 -12.11 35.48 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.6 -0.687 . . . . 0.0 111.597 -179.577 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.0 tptt -77.61 -59.29 2.84 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.042 -1.036 . . . . 0.0 109.731 179.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 34.5 mt -47.28 -28.32 1.91 Allowed 'General case' 0 N--CA 1.504 2.242 0 O-C-N 121.554 -0.716 . . . . 0.0 111.416 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -64.28 -35.07 91.5 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.2 -1.56 . . . . 0.0 109.2 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -50.83 -36.08 35.66 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.535 -0.979 . . . . 0.0 111.037 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 34.0 mtt -86.62 -40.98 14.63 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.522 -0.736 . . . . 0.0 110.237 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . 0.418 ' CH2' ' HG2' ' A' ' 55' ' ' LYS . 73.1 t-105 -55.34 -22.52 19.55 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.551 -0.718 . . . . 0.0 111.028 -179.566 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 66.6 p -93.55 -33.3 13.8 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.286 -0.884 . . . . 0.0 110.166 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -63.42 -36.72 84.68 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.561 -0.712 . . . . 0.0 110.015 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -63.04 152.66 36.34 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.583 -0.698 . . . . 0.0 110.194 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 9.3 t -101.26 -152.61 0.43 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.685 -0.634 . . . . 0.0 109.423 179.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -83.51 55.44 3.2 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.397 -0.814 . . . . 0.0 110.023 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 39.6 mttt -132.24 -48.92 0.92 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.415 -0.803 . . . . 0.0 110.324 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -67.86 -28.1 67.25 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.532 -0.73 . . . . 0.0 110.774 -179.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.418 ' HG2' ' CH2' ' A' ' 47' ' ' TRP . 18.7 mtmt -79.79 -36.74 36.58 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.372 -0.83 . . . . 0.0 110.572 -179.639 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -44.22 -53.37 14.01 Favored Pre-proline 0 N--CA 1.507 2.385 0 O-C-N 121.505 -0.747 . . . . 0.0 112.33 -178.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -77.2 -37.33 1.07 Allowed 'Trans proline' 0 C--N 1.315 -1.226 0 O-C-N 123.129 1.068 . . . . 0.0 111.258 -179.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.48 -5.27 58.6 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.454 -0.779 . . . . 0.0 112.026 -178.462 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.96 -24.1 21.37 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.992 -1.068 . . . . 0.0 111.072 -179.328 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -78.47 -22.09 48.07 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.325 -0.859 . . . . 0.0 110.626 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 73.8 tttt -64.7 -42.35 95.35 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.365 -0.834 . . . . 0.0 109.803 179.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -80.86 -15.14 57.14 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.558 -0.714 . . . . 0.0 110.068 179.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.34 -35.38 75.52 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.379 -0.826 . . . . 0.0 110.029 179.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -72.62 -62.81 1.31 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.454 -0.779 . . . . 0.0 109.783 179.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.0 mp -51.22 -24.05 3.97 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.443 -0.786 . . . . 0.0 111.25 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 10.9 tttt -70.36 -52.54 21.84 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.395 -0.816 . . . . 0.0 109.506 179.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -62.19 -50.33 72.25 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.609 -0.682 . . . . 0.0 109.543 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -58.45 -20.62 46.47 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.557 -0.715 . . . . 0.0 110.548 179.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.417 ' CE2' ' HD3' ' A' ' 12' ' ' PRO . 23.4 t80 -86.82 -58.31 2.65 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.449 -0.782 . . . . 0.0 110.026 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -69.37 -32.67 71.86 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.629 -0.669 . . . . 0.0 111.868 -178.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.0 mmtm -85.47 -14.34 46.4 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.267 -0.895 . . . . 0.0 111.823 -178.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -107.31 -20.69 13.2 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.143 -0.973 . . . . 0.0 111.34 -179.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.7 tp . . . . . 0 N--CA 1.497 1.883 0 O-C-N 121.3 -0.875 . . . . 0.0 110.825 -179.781 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo . . . . . 0 N--CA 1.484 0.938 0 N-CA-C 110.425 -0.644 . . . . 0.0 110.425 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.48 -166.91 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.586 -0.696 . . . . 0.0 109.917 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -60.94 146.19 87.82 Favored Pre-proline 0 N--CA 1.496 1.872 0 O-C-N 121.509 -0.744 . . . . 0.0 110.085 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.418 ' HD3' ' CZ ' ' A' ' 69' ' ' TYR . 47.0 Cg_endo -74.21 124.41 8.99 Favored 'Trans proline' 0 C--N 1.317 -1.13 0 O-C-N 123.299 1.157 . . . . 0.0 110.159 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -81.43 -179.93 5.33 Favored 'Trans proline' 0 C--N 1.318 -1.055 0 O-C-N 123.286 1.15 . . . . 0.0 110.079 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 38.1 t -168.93 62.16 0.06 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.461 -0.775 . . . . 0.0 110.811 -179.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 69.6 -77.65 0.05 Allowed 'General case' 0 N--CA 1.503 2.203 0 O-C-N 120.945 -1.097 . . . . 0.0 110.533 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.443 ' CE2' ' CD1' ' A' ' 47' ' ' TRP . 3.3 t80 -49.49 -46.93 48.83 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.12 -0.987 . . . . 0.0 111.114 -179.578 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -60.31 -28.29 68.0 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.551 -0.718 . . . . 0.0 110.281 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 23.7 mt -83.99 -35.63 23.77 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.352 -0.843 . . . . 0.0 110.532 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.485 ' CE1' ' CE1' ' A' ' 23' ' ' TYR . 59.0 t80 -71.93 -52.68 16.01 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.531 -0.731 . . . . 0.0 110.718 -179.214 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 36.4 t -56.78 -55.16 37.88 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.395 -0.816 . . . . 0.0 110.658 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 9.2 t -55.35 -23.99 27.01 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.502 -0.749 . . . . 0.0 110.989 -179.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -98.97 -21.19 16.38 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.4 -0.812 . . . . 0.0 111.288 -179.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.485 ' CE1' ' CE1' ' A' ' 19' ' ' PHE . 5.6 m-85 -100.11 15.93 25.75 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.349 -0.845 . . . . 0.0 111.352 -179.364 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.461 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 0.5 OUTLIER -92.25 -42.92 0.36 Allowed Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.314 -0.867 . . . . 0.0 112.744 179.663 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.517 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.2 Cg_endo -67.36 -17.94 49.64 Favored 'Trans proline' 0 N--CA 1.491 1.344 0 O-C-N 122.798 0.893 . . . . 0.0 110.493 -178.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? -71.78 -49.34 39.72 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 178.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 26.4 mm -56.06 -30.13 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 CA-C-O 121.257 0.551 . . . . 0.0 110.628 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.517 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 6.0 mmmm -73.84 -34.98 64.75 Favored 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 120.058 -0.657 . . . . 0.0 110.259 -177.236 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.9 t -62.76 -24.19 67.58 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.472 -0.767 . . . . 0.0 110.647 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -118.33 -16.57 9.62 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.415 -0.803 . . . . 0.0 111.194 -179.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 41.6 m80 -127.33 95.24 36.5 Favored Pre-proline 0 N--CA 1.498 1.949 0 O-C-N 121.351 -0.843 . . . . 0.0 109.578 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -74.95 -35.91 2.91 Favored 'Trans proline' 0 C--N 1.315 -1.231 0 O-C-N 123.492 1.259 . . . . 0.0 110.342 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.408 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -74.9 -19.07 80.1 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 110.099 -1.2 . . . . 0.0 110.099 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.2 83.81 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.584 -0.951 . . . . 0.0 111.312 -179.374 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.408 ' N ' ' O ' ' A' ' 33' ' ' GLY . 46.7 t -72.71 175.99 5.95 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.422 -0.799 . . . . 0.0 109.542 179.701 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 43.0 mm -56.48 -29.82 29.81 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 O-C-N 121.362 -0.836 . . . . 0.0 110.122 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.31 -64.91 3.83 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.408 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 0.6 OUTLIER -71.65 -31.81 67.24 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.66 -0.906 . . . . 0.0 110.564 179.803 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.5 m -67.09 -32.2 73.19 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.387 -0.821 . . . . 0.0 109.901 179.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.09 -35.34 69.2 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.621 -0.674 . . . . 0.0 109.914 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -97.92 -12.68 21.79 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.602 -0.686 . . . . 0.0 111.764 -179.422 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 6.1 tptt -85.16 5.18 31.07 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.044 -1.035 . . . . 0.0 110.528 179.377 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 18.3 mt -101.8 -33.51 9.79 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.029 -1.044 . . . . 0.0 109.316 179.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -66.25 -30.31 76.52 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.391 -1.484 . . . . 0.0 109.391 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.53 -41.39 63.44 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.38 -1.071 . . . . 0.0 110.679 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 11.6 mmt -87.03 -42.78 12.82 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.59 -0.694 . . . . 0.0 109.999 179.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . 0.443 ' CD1' ' CE2' ' A' ' 16' ' ' PHE . 72.9 t-105 -55.74 -23.76 31.13 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.505 -0.747 . . . . 0.0 110.723 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.4 t -85.79 -35.68 20.56 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.366 -0.834 . . . . 0.0 109.997 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -63.45 -33.67 76.08 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.66 -0.65 . . . . 0.0 109.839 179.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 89.8 mm-40 -63.32 151.26 41.23 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.676 -0.64 . . . . 0.0 110.094 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 88.6 p -103.06 -153.02 0.46 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.733 -0.605 . . . . 0.0 109.578 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -82.7 56.4 3.36 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.342 -0.849 . . . . 0.0 110.05 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 15.3 tttt -133.74 -51.18 0.85 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.448 -0.783 . . . . 0.0 110.204 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -67.78 -26.19 65.98 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.542 -0.724 . . . . 0.0 110.616 -179.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.423 ' O ' ' N ' ' A' ' 59' ' ' GLU . 10.9 ttmt -82.7 -36.88 25.49 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.563 -0.711 . . . . 0.0 110.668 -179.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -43.42 -52.53 13.08 Favored Pre-proline 0 N--CA 1.508 2.466 0 O-C-N 121.455 -0.778 . . . . 0.0 112.47 -178.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -78.34 -37.45 0.74 Allowed 'Trans proline' 0 C--N 1.315 -1.218 0 O-C-N 123.129 1.068 . . . . 0.0 111.848 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -84.66 -10.38 57.37 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.345 -0.847 . . . . 0.0 112.409 -177.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.423 ' N ' ' O ' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -85.46 -26.9 26.05 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.064 -1.022 . . . . 0.0 110.933 -179.036 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -75.4 -18.26 59.98 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.435 -0.791 . . . . 0.0 110.947 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 59.2 tttt -65.02 -43.67 91.68 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.278 -0.888 . . . . 0.0 110.204 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -76.38 -12.84 60.12 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.494 -0.754 . . . . 0.0 110.328 179.393 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.96 -40.83 94.85 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.31 -0.869 . . . . 0.0 110.42 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -69.87 -62.39 1.4 Allowed 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.237 -0.914 . . . . 0.0 109.705 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.6 mp -46.29 -24.27 0.45 Allowed 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.606 -0.684 . . . . 0.0 112.142 -179.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.5 tptt -71.33 -45.39 63.07 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.295 -0.878 . . . . 0.0 109.517 179.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -66.1 -57.39 7.78 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.71 -0.619 . . . . 0.0 109.873 179.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 59.1 mttt -54.83 -25.47 28.65 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.56 -0.713 . . . . 0.0 110.71 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.418 ' CZ ' ' HD3' ' A' ' 12' ' ' PRO . 46.0 t80 -78.12 -66.19 0.88 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.517 -0.74 . . . . 0.0 109.611 179.514 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -58.58 -22.56 56.3 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.728 -0.608 . . . . 0.0 111.288 -179.267 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 39.2 mttt -93.79 -18.84 21.61 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.288 -0.883 . . . . 0.0 111.574 -179.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -110.04 -27.06 9.38 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.249 -0.907 . . . . 0.0 111.02 -179.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.7 tp . . . . . 0 N--CA 1.495 1.814 0 O-C-N 121.389 -0.819 . . . . 0.0 110.459 -179.563 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo . . . . . 0 N--CA 1.485 1.011 0 N-CA-C 110.727 -0.528 . . . . 0.0 110.727 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.26 -165.14 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.593 -0.692 . . . . 0.0 110.432 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 7.5 mpt_? -56.83 148.56 47.67 Favored Pre-proline 0 N--CA 1.498 1.953 0 O-C-N 121.455 -0.778 . . . . 0.0 110.732 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.427 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.5 Cg_endo -79.26 126.65 7.05 Favored 'Trans proline' 0 C--N 1.317 -1.1 0 O-C-N 123.387 1.204 . . . . 0.0 110.069 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -81.68 178.45 6.56 Favored 'Trans proline' 0 C--N 1.318 -1.067 0 O-C-N 123.266 1.14 . . . . 0.0 110.379 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.7 t -160.23 63.33 0.33 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.502 -0.748 . . . . 0.0 110.526 -179.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 67.19 -76.42 0.05 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.092 -1.005 . . . . 0.0 109.914 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.419 ' CD1' ' CD1' ' A' ' 47' ' ' TRP . 18.6 t80 -51.58 -42.54 61.97 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.326 -0.858 . . . . 0.0 110.814 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -62.62 -29.16 70.4 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.696 -0.627 . . . . 0.0 109.357 179.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 45.0 mt -81.36 -40.35 23.66 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.67 -0.644 . . . . 0.0 110.276 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -63.4 -49.74 72.58 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.485 -0.759 . . . . 0.0 109.865 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 9.0 t -60.85 -27.52 68.16 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.621 -0.674 . . . . 0.0 109.743 179.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 10.6 t -102.9 20.81 16.75 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.587 -0.696 . . . . 0.0 110.875 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -142.26 -12.01 0.83 Allowed 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.19 -0.944 . . . . 0.0 112.099 179.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -119.23 24.38 10.78 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.854 -1.154 . . . . 0.0 110.862 -179.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.469 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 8.0 mtt180 -85.45 -45.93 0.63 Allowed Pre-proline 0 N--CA 1.489 1.485 0 O-C-N 121.512 -0.742 . . . . 0.0 112.126 179.699 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.484 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.7 Cg_endo -66.91 -14.76 44.94 Favored 'Trans proline' 0 N--CA 1.49 1.281 0 O-C-N 122.925 0.961 . . . . 0.0 110.675 -179.11 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.84 -53.07 11.04 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 177.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 27.1 mm -52.03 -31.73 14.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 CA-C-O 121.417 0.627 . . . . 0.0 110.48 179.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.491 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 5.4 mmmm -72.71 -37.28 67.85 Favored 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.225 -177.39 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 26.4 t -58.64 -25.09 62.37 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.495 -0.753 . . . . 0.0 110.764 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -117.52 -21.58 8.53 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.531 -0.73 . . . . 0.0 110.96 -179.59 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 41.0 m80 -121.7 96.59 47.2 Favored Pre-proline 0 N--CA 1.496 1.857 0 O-C-N 121.247 -0.908 . . . . 0.0 109.783 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -75.23 -37.9 1.73 Allowed 'Trans proline' 0 C--N 1.315 -1.195 0 O-C-N 123.446 1.235 . . . . 0.0 110.433 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.32 -9.41 85.78 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 110.452 -1.059 . . . . 0.0 110.452 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.52 82.34 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.163 -1.198 . . . . 0.0 110.33 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.6 t -76.49 173.06 11.97 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.503 -0.748 . . . . 0.0 109.703 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 40.0 mm -50.94 -29.72 8.03 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.186 0 O-C-N 121.271 -0.893 . . . . 0.0 110.6 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.87 -75.29 0.29 Allowed Glycine 0 N--CA 1.492 2.389 0 N-CA-C 109.069 -1.612 . . . . 0.0 109.069 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.427 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 29.3 t70 -66.2 -18.84 65.6 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.701 -0.882 . . . . 0.0 111.039 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 36.3 m -73.95 -45.58 49.43 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.243 -0.91 . . . . 0.0 109.954 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -52.32 -44.83 65.33 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.442 -0.787 . . . . 0.0 110.15 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.32 -11.19 59.74 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.76 -0.587 . . . . 0.0 111.243 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.427 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -82.0 2.47 30.76 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 120.93 -1.106 . . . . 0.0 110.815 179.111 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.4 mt -106.34 -30.35 9.2 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.204 -0.935 . . . . 0.0 109.599 179.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -78.99 -42.11 12.99 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 108.854 -1.698 . . . . 0.0 108.854 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -55.11 -42.89 73.52 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.533 -0.98 . . . . 0.0 110.401 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 17.6 mmt -74.18 -50.5 18.98 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.571 -0.706 . . . . 0.0 109.535 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . 0.419 ' CD1' ' CD1' ' A' ' 16' ' ' PHE . 69.2 t-105 -49.61 -52.95 26.85 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.642 -0.661 . . . . 0.0 111.047 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 45.0 t -59.92 -35.48 74.99 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.407 -0.808 . . . . 0.0 110.326 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -63.58 -40.27 96.52 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.567 -0.708 . . . . 0.0 109.934 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 89.3 mm-40 -57.52 155.2 9.9 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.576 -0.702 . . . . 0.0 110.556 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 21.7 t -99.87 -150.67 0.38 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.722 -0.612 . . . . 0.0 109.511 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -89.65 47.46 1.47 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.281 -0.887 . . . . 0.0 110.275 179.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 62.0 mttt -126.8 -50.71 1.47 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.551 -0.718 . . . . 0.0 110.069 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -64.16 -24.74 67.79 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.67 -0.644 . . . . 0.0 110.405 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 66.1 tttt -81.96 -35.16 29.3 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.467 -0.771 . . . . 0.0 110.432 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -44.44 -52.22 17.89 Favored Pre-proline 0 N--CA 1.506 2.343 0 O-C-N 121.513 -0.742 . . . . 0.0 112.022 -179.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -78.96 -37.73 0.54 Allowed 'Trans proline' 0 C--N 1.315 -1.204 0 O-C-N 123.188 1.099 . . . . 0.0 110.958 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -84.53 4.29 32.64 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.38 -0.825 . . . . 0.0 112.043 -178.325 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.01 -23.89 14.77 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.072 -1.017 . . . . 0.0 110.446 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -76.36 -23.76 54.16 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.394 -0.816 . . . . 0.0 110.251 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 50.6 tttm -61.44 -39.82 92.19 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.421 -0.799 . . . . 0.0 109.856 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -78.1 -13.06 60.01 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.6 -0.687 . . . . 0.0 110.365 179.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.35 1.75 35.58 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.397 -0.814 . . . . 0.0 110.291 178.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 26.3 mmtm -104.35 -30.36 10.15 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.147 -0.971 . . . . 0.0 109.735 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.1 mp -86.48 1.51 51.22 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.894 -0.504 . . . . 0.0 110.592 179.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.5 tptt -94.38 -34.28 12.84 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.156 -0.965 . . . . 0.0 109.428 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -82.93 -11.59 58.05 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.751 -0.593 . . . . 0.0 110.394 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -105.04 -28.78 10.84 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.439 -0.788 . . . . 0.0 109.467 179.111 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.427 ' CE2' ' HD3' ' A' ' 12' ' ' PRO . 19.3 t80 -75.76 -54.41 6.98 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.6 -0.688 . . . . 0.0 109.59 179.575 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -68.08 -14.68 63.16 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.719 -0.613 . . . . 0.0 111.306 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 60.8 mttt -101.33 -30.53 11.44 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.256 -0.903 . . . . 0.0 110.709 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -92.48 -31.31 15.3 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.483 -0.76 . . . . 0.0 110.852 -179.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.7 tp . . . . . 0 N--CA 1.498 1.931 0 O-C-N 121.398 -0.814 . . . . 0.0 110.953 -179.57 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.437 ' HB2' ' CG ' ' A' ' 69' ' ' TYR . 45.1 Cg_endo . . . . . 0 N--CA 1.483 0.896 0 N-CA-C 110.775 -0.51 . . . . 0.0 110.775 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.6 pttt -67.06 -153.92 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.575 -0.703 . . . . 0.0 109.615 179.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -57.75 138.21 82.61 Favored Pre-proline 0 N--CA 1.499 2.01 0 O-C-N 121.269 -0.895 . . . . 0.0 110.145 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -74.56 134.37 18.53 Favored 'Trans proline' 0 C--N 1.318 -1.078 0 O-C-N 123.246 1.129 . . . . 0.0 110.082 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -80.56 179.7 5.88 Favored 'Trans proline' 0 C--N 1.318 -1.07 0 O-C-N 123.208 1.11 . . . . 0.0 110.164 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -170.0 61.65 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.398 -0.814 . . . . 0.0 110.827 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 68.13 -78.71 0.04 OUTLIER 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.072 -1.018 . . . . 0.0 110.473 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.417 ' CE2' ' CD1' ' A' ' 47' ' ' TRP . 3.9 t80 -48.65 -49.36 37.73 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.163 -0.961 . . . . 0.0 111.231 -179.463 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -57.15 -31.07 64.99 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.575 -0.703 . . . . 0.0 110.14 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.2 mt -78.57 -31.63 47.39 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.534 -0.729 . . . . 0.0 110.181 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.502 ' CZ ' ' CZ ' ' A' ' 23' ' ' TYR . 52.1 t80 -76.79 -55.03 5.85 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.607 -0.683 . . . . 0.0 110.731 -179.306 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.8 t -57.7 -52.9 63.56 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.435 -0.791 . . . . 0.0 110.526 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 8.0 t -55.71 -24.19 33.24 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.5 -0.75 . . . . 0.0 110.855 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -98.72 -24.85 14.88 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.426 -0.796 . . . . 0.0 111.001 -179.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.502 ' CZ ' ' CZ ' ' A' ' 19' ' ' PHE . 2.2 m-85 -88.22 -36.4 16.78 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.378 -0.826 . . . . 0.0 110.685 -179.57 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.516 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 6.8 mtt180 -48.43 -51.38 51.74 Favored Pre-proline 0 N--CA 1.496 1.861 0 O-C-N 121.44 -0.788 . . . . 0.0 111.992 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.516 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 36.4 Cg_endo -60.11 -28.69 87.51 Favored 'Trans proline' 0 N--CA 1.495 1.566 0 O-C-N 123.21 1.111 . . . . 0.0 109.977 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.3 tmtt? -67.8 -44.68 76.76 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 178.022 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 46.4 mm -59.54 -23.37 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 CA-C-N 116.152 -0.477 . . . . 0.0 109.877 179.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.52 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 5.9 mmmm -83.56 -38.55 21.54 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.458 -0.777 . . . . 0.0 110.058 -177.693 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.7 t -57.43 -26.62 61.45 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.354 -0.841 . . . . 0.0 110.097 179.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -109.19 -48.05 3.32 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.611 -0.681 . . . . 0.0 109.857 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 14.2 m80 -103.31 103.58 35.93 Favored Pre-proline 0 N--CA 1.497 1.884 0 O-C-N 121.642 -0.661 . . . . 0.0 109.685 -179.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -81.38 -40.99 0.15 Allowed 'Trans proline' 0 C--N 1.314 -1.287 0 O-C-N 123.367 1.193 . . . . 0.0 109.975 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.08 -23.26 69.52 Favored Glycine 0 N--CA 1.488 2.146 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 179.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.79 91.76 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.529 -0.983 . . . . 0.0 110.909 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 68.7 m -74.35 175.41 7.69 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.583 -0.698 . . . . 0.0 109.755 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.5 mp -59.65 -31.81 47.85 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.348 -0.845 . . . . 0.0 109.584 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.15 -61.41 7.36 Favored Glycine 0 N--CA 1.495 2.607 0 N-CA-C 109.02 -1.632 . . . . 0.0 109.02 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.452 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 16.5 t0 -71.36 -35.92 71.3 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.694 -0.886 . . . . 0.0 110.091 179.163 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 80.5 m -64.6 -29.9 70.92 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.138 -0.976 . . . . 0.0 109.82 179.157 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.56 -37.9 59.62 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.641 -0.662 . . . . 0.0 110.245 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.3 ptpt -95.87 -13.71 23.75 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.525 -0.734 . . . . 0.0 111.922 -178.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.452 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -86.04 4.49 37.77 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 120.974 -1.079 . . . . 0.0 110.626 179.7 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.4 ' CD1' ' CG ' ' A' ' 24' ' ' ARG . 80.1 mt -106.77 -34.27 7.33 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.262 -0.899 . . . . 0.0 109.488 179.467 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -64.57 -32.7 85.08 Favored Glycine 0 N--CA 1.493 2.476 0 N-CA-C 109.79 -1.324 . . . . 0.0 109.79 -179.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -51.18 -33.95 29.48 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.403 -1.057 . . . . 0.0 110.794 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 39.2 mtt -87.43 -41.05 13.85 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.604 -0.685 . . . . 0.0 109.888 179.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . 0.417 ' CD1' ' CE2' ' A' ' 16' ' ' PHE . 71.7 t-105 -56.19 -23.89 38.23 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.55 -0.718 . . . . 0.0 110.858 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 21.9 t -85.28 -36.08 21.1 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.48 -0.763 . . . . 0.0 110.066 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -63.03 -33.02 74.53 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.633 -0.667 . . . . 0.0 109.828 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 -64.81 149.64 49.0 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.645 -0.659 . . . . 0.0 110.12 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.6 m -104.44 -153.22 0.48 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.669 -0.644 . . . . 0.0 109.526 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.88 58.29 3.33 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.376 -0.827 . . . . 0.0 109.915 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 26.7 tttt -136.24 -50.79 0.7 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.399 -0.813 . . . . 0.0 110.297 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -69.81 -27.95 65.31 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.557 -0.715 . . . . 0.0 110.726 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.419 ' O ' ' N ' ' A' ' 59' ' ' GLU . 32.6 ttpt -80.0 -37.71 33.65 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.444 -0.785 . . . . 0.0 110.695 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -44.14 -53.01 14.56 Favored Pre-proline 0 N--CA 1.508 2.439 0 O-C-N 121.472 -0.768 . . . . 0.0 112.513 -178.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -77.66 -37.43 0.92 Allowed 'Trans proline' 0 C--N 1.315 -1.2 0 O-C-N 123.078 1.041 . . . . 0.0 111.744 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -81.86 -14.86 55.67 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.395 -0.815 . . . . 0.0 112.089 -178.111 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.419 ' N ' ' O ' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -82.84 -24.97 33.04 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.202 -0.936 . . . . 0.0 111.086 -178.934 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -79.83 -20.59 45.7 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.451 -0.781 . . . . 0.0 110.845 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 43.1 tttm -63.04 -48.39 78.9 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.409 -0.807 . . . . 0.0 110.195 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -81.12 -13.36 58.76 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.447 -0.783 . . . . 0.0 110.316 179.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.87 -28.14 69.83 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.321 -0.862 . . . . 0.0 109.154 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -81.75 -66.06 0.94 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.577 -0.702 . . . . 0.0 109.17 178.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.402 ' O ' ' CD1' ' A' ' 69' ' ' TYR . 3.1 mp -48.32 -22.56 0.7 Allowed 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.602 -0.687 . . . . 0.0 112.117 -179.356 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 23.9 tptt -65.49 -45.46 83.54 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.14 -0.975 . . . . 0.0 109.851 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -66.66 -54.51 22.42 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.662 -0.649 . . . . 0.0 110.349 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 68.9 mttt -56.4 -29.93 62.12 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.487 -0.758 . . . . 0.0 110.478 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.437 ' CG ' ' HB2' ' A' ' 9' ' ' PRO . 3.8 m-85 -75.72 -70.07 0.45 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.576 -0.703 . . . . 0.0 109.834 179.652 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -49.53 -29.26 6.56 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.662 -0.649 . . . . 0.0 111.342 -179.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.8 ttmm -84.47 -58.04 2.9 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.529 -0.732 . . . . 0.0 110.47 -179.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -64.11 -30.23 71.31 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.624 -0.673 . . . . 0.0 111.112 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 9.7 tp . . . . . 0 N--CA 1.496 1.829 0 O-C-N 121.351 -0.843 . . . . 0.0 110.442 -179.485 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo . . . . . 0 N--CA 1.484 0.938 0 N-CA-C 110.458 -0.631 . . . . 0.0 110.458 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.5 pttt -60.12 -162.44 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.664 -0.648 . . . . 0.0 110.337 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.68 144.59 98.8 Favored Pre-proline 0 N--CA 1.495 1.821 0 O-C-N 121.421 -0.799 . . . . 0.0 110.069 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.417 ' HG3' ' CE2' ' A' ' 69' ' ' TYR . 49.3 Cg_endo -75.24 131.0 13.54 Favored 'Trans proline' 0 C--N 1.317 -1.082 0 O-C-N 123.296 1.156 . . . . 0.0 109.802 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -81.26 -176.75 3.27 Favored 'Trans proline' 0 C--N 1.317 -1.115 0 O-C-N 123.197 1.104 . . . . 0.0 110.172 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 76.4 p -165.48 59.21 0.11 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.513 -0.742 . . . . 0.0 110.807 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 68.52 -77.09 0.05 Allowed 'General case' 0 N--CA 1.504 2.258 0 O-C-N 121.12 -0.987 . . . . 0.0 110.662 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -46.99 -51.6 16.74 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.299 -0.876 . . . . 0.0 111.47 -179.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -57.55 -36.95 72.31 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.497 -0.752 . . . . 0.0 109.945 179.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.1 mt -70.08 -38.63 75.75 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.619 -0.676 . . . . 0.0 110.347 -179.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.492 ' CE1' ' CE1' ' A' ' 23' ' ' TYR . 63.1 t80 -71.94 -53.05 14.3 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.517 -0.739 . . . . 0.0 110.621 -179.507 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 34.6 t -56.83 -53.82 53.46 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.368 -0.833 . . . . 0.0 110.657 -179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 11.8 t -56.22 -29.01 60.39 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.534 -0.729 . . . . 0.0 110.822 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -90.82 -27.75 18.65 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.468 -0.77 . . . . 0.0 110.798 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.492 ' CE1' ' CE1' ' A' ' 19' ' ' PHE . 9.1 m-85 -94.74 14.69 20.43 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.511 -0.743 . . . . 0.0 111.287 -179.433 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.484 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 4.2 mtp180 -88.59 -43.82 0.46 Allowed Pre-proline 0 N--CA 1.488 1.446 0 O-C-N 121.253 -0.904 . . . . 0.0 112.53 179.741 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.496 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 37.8 Cg_endo -65.66 -17.41 56.67 Favored 'Trans proline' 0 N--CA 1.491 1.365 0 O-C-N 122.865 0.929 . . . . 0.0 110.563 -178.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.8 tmtt? -72.02 -50.43 28.64 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 177.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 24.5 mm -54.86 -33.79 29.23 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 CA-C-O 121.224 0.535 . . . . 0.0 110.631 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.503 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 6.2 mmmm -71.01 -38.35 72.64 Favored 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 120.121 -0.632 . . . . 0.0 110.321 -177.073 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.6 t -58.65 -24.47 61.22 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.515 -0.741 . . . . 0.0 110.797 -179.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -117.29 -23.04 7.99 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.435 -0.79 . . . . 0.0 110.978 -179.565 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 43.0 m80 -120.56 96.58 48.91 Favored Pre-proline 0 N--CA 1.495 1.82 0 O-C-N 121.342 -0.848 . . . . 0.0 109.709 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -75.59 -29.07 7.68 Favored 'Trans proline' 0 C--N 1.315 -1.226 0 O-C-N 123.416 1.219 . . . . 0.0 110.54 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -85.04 -12.2 74.55 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 110.571 -1.012 . . . . 0.0 110.571 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.56 83.67 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.257 -1.143 . . . . 0.0 110.658 -179.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 71.5 p -72.52 171.1 13.0 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.512 -0.742 . . . . 0.0 109.847 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -53.6 -28.6 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.122 0 O-C-N 121.281 -0.887 . . . . 0.0 109.944 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.49 -71.13 0.83 Allowed Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.242 -1.543 . . . . 0.0 109.242 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -66.53 -27.41 67.74 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.698 -0.883 . . . . 0.0 110.456 179.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 33.2 m -67.38 -27.72 67.34 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.494 -0.754 . . . . 0.0 109.893 179.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.38 -47.37 23.52 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.574 -0.704 . . . . 0.0 109.685 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.69 -17.1 52.18 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.605 -0.684 . . . . 0.0 111.377 -179.64 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.0 tptt -76.66 -59.15 2.9 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.111 -0.993 . . . . 0.0 109.885 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 54.7 mt -47.03 -27.42 1.32 Allowed 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.648 -0.657 . . . . 0.0 111.544 -179.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.91 -36.2 91.79 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.182 -1.567 . . . . 0.0 109.182 179.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -51.01 -37.36 44.65 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.508 -0.995 . . . . 0.0 111.074 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 65.0 mtt -82.47 -42.8 18.03 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.598 -0.689 . . . . 0.0 110.318 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 69.9 t-105 -49.37 -32.93 12.43 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.523 -0.736 . . . . 0.0 111.585 -179.199 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.3 t -93.02 -24.06 18.47 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.306 -0.872 . . . . 0.0 110.592 -179.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -64.02 -43.3 96.02 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.413 -0.805 . . . . 0.0 109.993 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 52.2 mm-40 -61.83 157.62 17.74 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.719 -0.613 . . . . 0.0 110.329 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.3 t -87.23 -147.7 0.14 Allowed 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -83.58 54.11 2.75 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.181 -0.949 . . . . 0.0 110.125 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.0 tttt -129.62 -37.08 1.6 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.465 -0.772 . . . . 0.0 110.596 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -58.61 -38.62 78.4 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.304 -0.873 . . . . 0.0 110.791 -179.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -92.92 24.13 3.84 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.35 -0.844 . . . . 0.0 111.458 -179.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.438 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 4.4 mm-40 -98.05 -56.89 0.18 Allowed Pre-proline 0 N--CA 1.498 1.959 0 O-C-N 121.219 -0.926 . . . . 0.0 110.539 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.438 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.7 Cg_endo -83.23 -32.16 0.55 Allowed 'Trans proline' 0 N--CA 1.482 0.84 0 O-C-N 122.817 0.904 . . . . 0.0 110.666 179.76 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -82.09 -0.85 46.47 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.493 -0.754 . . . . 0.0 111.769 -178.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.54 -24.52 18.73 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.084 -1.01 . . . . 0.0 110.814 -179.577 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -79.26 -23.91 43.34 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.443 -0.785 . . . . 0.0 110.332 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -61.66 -44.83 96.21 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.432 -0.792 . . . . 0.0 109.92 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.22 -11.43 60.89 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.598 -0.689 . . . . 0.0 110.482 179.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -88.57 7.45 33.19 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.262 -0.899 . . . . 0.0 110.315 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 58.9 mmtt -107.02 -34.39 7.19 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.222 -0.923 . . . . 0.0 109.111 178.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 6.2 mp -81.04 -4.12 54.14 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.984 -0.448 . . . . 0.0 110.342 178.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.9 tppt? -80.82 -31.53 35.54 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.264 -0.898 . . . . 0.0 109.301 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -69.23 -63.26 1.1 Allowed 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 119.876 -0.73 . . . . 0.0 109.603 179.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -55.2 -24.21 26.04 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.531 -0.731 . . . . 0.0 111.107 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.417 ' CE2' ' HG3' ' A' ' 12' ' ' PRO . 29.5 t80 -79.18 -69.56 0.57 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.306 -0.871 . . . . 0.0 110.29 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -62.9 -14.06 41.93 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.551 -0.718 . . . . 0.0 111.768 -179.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.7 tttt -98.24 -27.02 14.34 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.104 -0.998 . . . . 0.0 110.893 -179.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -104.39 -24.56 13.05 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.434 -0.791 . . . . 0.0 111.079 -179.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.2 tp . . . . . 0 N--CA 1.497 1.882 0 O-C-N 121.407 -0.808 . . . . 0.0 110.421 -179.543 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo . . . . . 0 N--CA 1.484 0.94 0 N-CA-C 110.443 -0.637 . . . . 0.0 110.443 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.6 pttm -65.6 -155.49 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.599 -0.688 . . . . 0.0 109.658 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -55.44 145.88 46.06 Favored Pre-proline 0 N--CA 1.499 2.015 0 O-C-N 121.291 -0.881 . . . . 0.0 110.365 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -73.57 126.28 10.75 Favored 'Trans proline' 0 C--N 1.316 -1.162 0 O-C-N 123.378 1.199 . . . . 0.0 110.319 -179.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -81.57 173.44 11.41 Favored 'Trans proline' 0 C--N 1.318 -1.043 0 O-C-N 123.239 1.126 . . . . 0.0 109.799 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.5 t -171.83 64.57 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.429 -0.794 . . . . 0.0 111.001 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 71.32 -74.26 0.09 Allowed 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.124 -0.985 . . . . 0.0 110.876 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -46.67 -52.87 12.83 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.274 -0.891 . . . . 0.0 111.556 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -58.31 -39.24 78.84 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.575 -0.703 . . . . 0.0 109.865 179.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.4 mt -64.59 -42.94 95.26 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.667 -0.646 . . . . 0.0 109.814 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.501 ' CE1' ' CE1' ' A' ' 23' ' ' TYR . 80.9 t80 -68.71 -51.73 38.38 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.647 -0.658 . . . . 0.0 110.268 -179.827 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.3 m -55.7 -56.05 24.97 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.545 -0.722 . . . . 0.0 110.69 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 84.8 p -55.87 -30.78 62.07 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.48 -0.762 . . . . 0.0 110.831 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -87.54 -27.31 22.68 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.464 -0.773 . . . . 0.0 110.909 -179.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.501 ' CE1' ' CE1' ' A' ' 19' ' ' PHE . 9.6 m-85 -98.87 14.85 27.46 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.458 -0.776 . . . . 0.0 111.369 -179.5 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.48 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 14.2 mtp180 -87.91 -45.01 0.49 Allowed Pre-proline 0 N--CA 1.488 1.437 0 O-C-N 121.151 -0.968 . . . . 0.0 112.505 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.483 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.0 Cg_endo -65.47 -17.61 57.88 Favored 'Trans proline' 0 N--CA 1.491 1.353 0 O-C-N 122.802 0.896 . . . . 0.0 110.539 -178.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.1 tmtm? -71.71 -49.8 36.08 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 177.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 23.7 mm -55.49 -34.14 34.1 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 CA-C-O 121.322 0.582 . . . . 0.0 110.566 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.508 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 5.7 mmmm -70.98 -38.6 72.75 Favored 'General case' 0 N--CA 1.497 1.886 0 C-N-CA 120.167 -0.613 . . . . 0.0 110.299 -176.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.9 t -59.91 -23.52 63.57 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.461 -0.775 . . . . 0.0 110.816 -179.564 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -117.52 -21.04 8.78 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.484 -0.76 . . . . 0.0 111.116 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 48.5 m80 -121.96 96.45 46.79 Favored Pre-proline 0 N--CA 1.495 1.824 0 O-C-N 121.348 -0.845 . . . . 0.0 109.784 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -75.38 -28.75 8.29 Favored 'Trans proline' 0 C--N 1.315 -1.185 0 O-C-N 123.416 1.219 . . . . 0.0 110.455 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -84.14 -13.83 73.32 Favored Glycine 0 N--CA 1.488 2.127 0 N-CA-C 110.504 -1.038 . . . . 0.0 110.504 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.08 82.8 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.334 -1.097 . . . . 0.0 110.892 -179.522 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 33.4 t -75.05 171.54 13.93 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.506 -0.746 . . . . 0.0 109.78 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 40.8 mm -52.12 -27.73 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.175 0 O-C-N 121.284 -0.885 . . . . 0.0 110.369 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -61.42 -71.63 0.77 Allowed Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.227 -1.549 . . . . 0.0 109.227 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -67.33 -26.04 66.3 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.628 -0.925 . . . . 0.0 110.765 179.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 56.2 m -68.46 -28.79 67.36 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.458 -0.777 . . . . 0.0 109.926 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.58 -47.13 34.25 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.536 -0.728 . . . . 0.0 109.747 179.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -81.49 -14.71 56.67 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.573 -0.704 . . . . 0.0 111.366 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 6.9 tptt -76.4 -58.82 3.06 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.085 -1.009 . . . . 0.0 109.727 179.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 45.0 mt -48.28 -27.09 2.29 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.493 -0.754 . . . . 0.0 111.287 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.92 -38.73 96.5 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 109.17 -1.572 . . . . 0.0 109.17 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -51.7 -39.34 58.14 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.524 -0.986 . . . . 0.0 110.852 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.0 mmt -72.91 -45.63 57.07 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.617 -0.677 . . . . 0.0 109.516 179.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 51.7 t-105 -52.14 -58.16 7.41 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.671 -0.643 . . . . 0.0 110.771 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 9.0 t -59.35 -32.6 70.26 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.453 -0.779 . . . . 0.0 110.305 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -63.68 -42.33 98.04 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.574 -0.704 . . . . 0.0 109.945 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -64.43 154.93 34.21 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.651 -0.655 . . . . 0.0 110.404 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 76.2 p -99.31 -150.15 0.37 Allowed 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.94 57.41 3.06 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.203 -0.935 . . . . 0.0 110.15 179.656 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 22.5 tttt -134.99 -43.25 0.73 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.352 -0.842 . . . . 0.0 110.212 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -63.41 -32.29 73.69 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.487 -0.758 . . . . 0.0 110.56 -179.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.2 ttpt -91.83 22.97 3.86 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.332 -0.855 . . . . 0.0 111.325 -179.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.438 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 8.0 mm-40 -96.95 -59.98 0.15 Allowed Pre-proline 0 N--CA 1.497 1.881 0 O-C-N 121.103 -0.998 . . . . 0.0 110.843 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.438 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.4 Cg_endo -80.45 -30.29 2.04 Favored 'Trans proline' 0 N--CA 1.486 1.047 0 O-C-N 122.871 0.932 . . . . 0.0 110.897 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -82.49 -8.92 59.6 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.492 -0.755 . . . . 0.0 112.01 -178.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -84.3 -25.37 29.34 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.095 -1.003 . . . . 0.0 111.113 -179.331 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -79.09 -21.94 45.96 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.461 -0.774 . . . . 0.0 110.791 -179.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 44.9 tttt -66.0 -44.05 85.92 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.336 -0.853 . . . . 0.0 109.858 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -79.9 -15.13 57.96 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.534 -0.728 . . . . 0.0 110.134 179.411 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.02 -31.33 69.85 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.269 -0.894 . . . . 0.0 109.42 179.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -74.1 -62.75 1.4 Allowed 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 178.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -43.61 -25.36 0.16 Allowed 'General case' 0 N--CA 1.506 2.336 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -179.297 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -65.02 -44.22 89.89 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.223 -0.923 . . . . 0.0 109.169 178.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -66.24 -57.4 7.65 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.755 -0.59 . . . . 0.0 109.787 179.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.7 mptm? -51.31 -31.31 21.12 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.397 -0.815 . . . . 0.0 110.718 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 34.8 t80 -75.62 -64.37 1.09 Allowed 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 179.095 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -59.67 -17.81 37.03 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.881 -0.512 . . . . 0.0 111.322 -179.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.4 mmmt -99.47 -23.75 15.01 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.169 -0.957 . . . . 0.0 111.45 -179.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -103.95 -28.66 11.43 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.27 -0.894 . . . . 0.0 110.983 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.1 tp . . . . . 0 N--CA 1.495 1.809 0 O-C-N 121.427 -0.796 . . . . 0.0 110.186 -179.655 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo . . . . . 0 N--CA 1.485 0.972 0 N-CA-C 110.218 -0.724 . . . . 0.0 110.218 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.53 -155.0 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.63 -0.669 . . . . 0.0 110.323 -179.715 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -61.0 133.92 92.67 Favored Pre-proline 0 N--CA 1.497 1.899 0 O-C-N 121.492 -0.755 . . . . 0.0 110.153 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.424 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.8 Cg_endo -76.82 137.72 18.08 Favored 'Trans proline' 0 C--N 1.319 -0.992 0 O-C-N 123.192 1.101 . . . . 0.0 109.847 179.4 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -79.29 -169.41 0.79 Allowed 'Trans proline' 0 C--N 1.316 -1.177 0 O-C-N 123.174 1.092 . . . . 0.0 110.154 -179.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 66.5 p -163.0 63.67 0.19 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.439 -0.788 . . . . 0.0 110.92 -179.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 66.49 -78.06 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.002 -1.061 . . . . 0.0 110.518 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -48.47 -48.19 37.9 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.351 -0.843 . . . . 0.0 111.447 -179.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -59.78 -33.99 72.42 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.583 -0.698 . . . . 0.0 109.737 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 42.4 mt -72.29 -33.03 67.12 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.707 -0.621 . . . . 0.0 109.488 179.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.492 ' CZ ' ' CZ ' ' A' ' 23' ' ' TYR . 22.9 t80 -73.3 -52.48 13.76 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.78 -0.575 . . . . 0.0 110.489 -179.758 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 17.0 p -60.81 -31.79 71.18 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.477 -0.764 . . . . 0.0 110.38 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 91.8 p -71.14 -23.86 62.16 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.781 -0.574 . . . . 0.0 112.111 -178.451 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.9 -24.71 9.39 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.022 -1.049 . . . . 0.0 112.384 -178.611 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.492 ' CZ ' ' CZ ' ' A' ' 19' ' ' PHE . 4.9 m-85 -80.33 -36.93 33.51 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 120.925 -1.109 . . . . 0.0 111.099 -179.207 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.492 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 10.3 mtp180 -48.0 -52.91 36.85 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.319 -0.863 . . . . 0.0 112.198 -179.61 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.492 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 36.2 Cg_endo -59.67 -27.7 85.57 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 O-C-N 123.274 1.144 . . . . 0.0 110.261 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.8 tmtm? -69.63 -45.95 67.33 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 177.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.2 mm -57.77 -29.67 35.72 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.28 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.509 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 5.4 mmmm -73.09 -35.49 66.63 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 119.968 -0.693 . . . . 0.0 110.571 -177.183 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 28.9 t -66.27 -22.6 66.31 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.445 -0.784 . . . . 0.0 110.62 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -116.19 -16.06 11.01 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.528 -0.733 . . . . 0.0 111.142 -179.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 44.6 m80 -129.83 94.75 30.76 Favored Pre-proline 0 N--CA 1.497 1.889 0 O-C-N 121.306 -0.871 . . . . 0.0 109.238 179.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -74.72 -36.09 3.03 Favored 'Trans proline' 0 C--N 1.316 -1.148 0 O-C-N 123.514 1.27 . . . . 0.0 110.479 -179.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -75.34 -19.17 79.71 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 110.051 -1.22 . . . . 0.0 110.051 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.11 86.28 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.522 -0.987 . . . . 0.0 111.378 -179.385 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.404 ' N ' ' O ' ' A' ' 33' ' ' GLY . 42.8 t -80.34 171.24 15.32 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.549 -0.719 . . . . 0.0 109.471 179.552 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 43.3 mm -53.33 -26.2 11.92 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 O-C-N 121.326 -0.859 . . . . 0.0 110.347 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -61.08 -71.77 0.74 Allowed Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.238 -1.545 . . . . 0.0 109.238 179.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.405 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 16.4 t70 -69.32 -28.22 66.06 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.688 -0.889 . . . . 0.0 110.502 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 86.6 m -68.68 -32.27 71.98 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.413 -0.804 . . . . 0.0 109.769 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.89 -39.61 76.14 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 120.073 -0.651 . . . . 0.0 109.484 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -91.51 -15.12 29.24 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.644 -0.66 . . . . 0.0 111.493 -179.399 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 30.7 tptt -83.29 1.14 42.5 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.022 -1.049 . . . . 0.0 110.526 179.378 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 25.7 mt -97.45 -35.1 10.77 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.12 -0.987 . . . . 0.0 108.958 178.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.35 -31.98 71.75 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 108.841 -1.704 . . . . 0.0 108.841 179.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -55.35 -47.63 75.45 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.595 -0.944 . . . . 0.0 110.179 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 16.2 mtp -70.61 -48.98 52.43 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 70.0 t-105 -52.92 -58.42 7.01 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.708 -0.62 . . . . 0.0 110.555 179.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 46.6 t -60.76 -34.34 74.31 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.472 -0.767 . . . . 0.0 110.26 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -58.02 -39.11 77.52 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.603 -0.686 . . . . 0.0 110.26 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 57.5 mm-40 -67.54 164.96 17.83 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.592 -0.692 . . . . 0.0 110.075 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.1 m -150.09 107.2 3.58 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.544 -0.723 . . . . 0.0 110.17 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 53.01 47.1 25.41 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.347 -0.845 . . . . 0.0 110.655 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.9 mtpt -149.26 -64.76 0.23 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.556 -0.715 . . . . 0.0 109.86 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -59.78 -31.28 69.53 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.5 -0.75 . . . . 0.0 110.562 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.4 tttm -96.05 22.36 7.64 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.427 -0.796 . . . . 0.0 111.191 -179.447 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.422 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 1.3 mm-40 -99.1 -55.02 0.18 Allowed Pre-proline 0 N--CA 1.496 1.842 0 O-C-N 121.195 -0.941 . . . . 0.0 110.61 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.422 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.0 Cg_endo -83.73 -36.76 0.18 Allowed 'Trans proline' 0 C--N 1.321 -0.873 0 O-C-N 122.925 0.961 . . . . 0.0 110.825 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -80.6 5.33 15.76 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.539 -0.725 . . . . 0.0 111.787 -179.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.8 -20.35 17.59 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.079 -1.013 . . . . 0.0 110.619 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -77.67 -24.33 49.38 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.441 -0.787 . . . . 0.0 110.364 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 26.4 tttp -58.81 -45.36 90.09 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.409 -0.807 . . . . 0.0 110.027 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.7 -10.08 59.24 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.596 -0.69 . . . . 0.0 110.58 179.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -86.31 2.97 45.35 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.253 -0.905 . . . . 0.0 110.503 179.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 24.4 mmtp -105.12 -32.86 8.49 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.231 -0.918 . . . . 0.0 109.462 179.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.8 mp -80.83 4.25 19.8 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.909 -0.494 . . . . 0.0 111.039 179.553 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -97.29 -26.76 14.79 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.141 -0.974 . . . . 0.0 109.926 179.503 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -84.71 -14.52 48.13 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.521 -0.737 . . . . 0.0 110.62 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.4 mmtt -103.57 -29.19 11.28 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.309 -0.869 . . . . 0.0 109.711 179.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.424 ' CE2' ' HD3' ' A' ' 12' ' ' PRO . 11.6 t80 -75.26 -53.34 8.95 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.63 -0.669 . . . . 0.0 109.628 179.71 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -63.99 -13.34 45.63 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.618 -0.676 . . . . 0.0 111.494 -179.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.4 mmtm -108.1 -32.42 7.53 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.129 -0.982 . . . . 0.0 110.901 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -89.69 -36.39 15.25 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.443 -0.785 . . . . 0.0 111.281 -179.079 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.7 tp . . . . . 0 N--CA 1.497 1.898 0 O-C-N 121.27 -0.894 . . . . 0.0 110.864 -179.316 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.423 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 53.3 Cg_endo . . . . . 0 N--CA 1.482 0.807 0 N-CA-C 110.282 -0.699 . . . . 0.0 110.282 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -110.0 26.34 10.77 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.465 -0.772 . . . . 0.0 110.98 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.5 ttm180 -159.19 94.61 1.77 Allowed Pre-proline 0 N--CA 1.493 1.681 0 O-C-N 121.734 -0.604 . . . . 0.0 110.488 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -76.98 114.05 3.74 Favored 'Trans proline' 0 C--N 1.317 -1.127 0 O-C-N 123.491 1.259 . . . . 0.0 110.491 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -81.04 164.65 19.8 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 O-C-N 123.282 1.149 . . . . 0.0 110.251 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 94.6 p -157.06 53.9 0.51 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.43 -0.794 . . . . 0.0 110.806 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 68.12 -76.57 0.05 Allowed 'General case' 0 N--CA 1.503 2.221 0 O-C-N 121.135 -0.978 . . . . 0.0 109.993 -179.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -48.16 -50.62 28.21 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.315 -0.866 . . . . 0.0 111.227 -179.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -57.52 -40.09 77.97 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.596 -0.69 . . . . 0.0 109.528 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.3 mt -64.43 -44.26 91.74 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.757 -0.589 . . . . 0.0 110.242 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -66.3 -51.81 53.59 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.573 -0.705 . . . . 0.0 110.359 -179.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 48.1 t -66.77 -21.39 66.06 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.579 -0.7 . . . . 0.0 110.299 179.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.9 m -73.57 -20.63 60.57 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.383 -0.823 . . . . 0.0 111.728 -179.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -127.15 -14.28 5.48 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.017 -1.052 . . . . 0.0 112.972 -178.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -88.69 16.02 7.33 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 120.774 -1.204 . . . . 0.0 111.73 -178.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.456 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 33.2 mtp180 -92.16 -44.27 0.35 Allowed Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.197 -0.939 . . . . 0.0 112.543 179.615 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.492 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.1 Cg_endo -66.82 -15.15 46.4 Favored 'Trans proline' 0 N--CA 1.49 1.307 0 O-C-N 122.917 0.956 . . . . 0.0 110.382 -179.299 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.76 -54.28 8.42 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 177.531 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 38.2 mm -51.2 -26.02 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.985 0 O-C-N 121.89 -0.507 . . . . 0.0 110.738 179.381 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.492 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 6.8 mmmm -78.22 -31.71 49.46 Favored 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 119.84 -0.744 . . . . 0.0 110.014 -177.853 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 15.1 t -67.09 -21.96 65.84 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.563 -0.711 . . . . 0.0 110.525 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -119.54 -13.67 9.18 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.384 -0.822 . . . . 0.0 111.282 -179.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -130.63 94.75 28.38 Favored Pre-proline 0 N--CA 1.497 1.899 0 O-C-N 121.19 -0.944 . . . . 0.0 109.502 179.453 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -75.25 -35.45 2.96 Favored 'Trans proline' 0 C--N 1.316 -1.173 0 O-C-N 123.575 1.303 . . . . 0.0 110.061 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.15 -15.33 81.5 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 179.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.62 87.78 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.327 -1.102 . . . . 0.0 110.887 -179.611 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 80.1 p -79.91 169.19 18.25 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.594 -0.691 . . . . 0.0 109.56 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 36.9 mm -50.01 -27.02 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.237 0 O-C-N 121.449 -0.782 . . . . 0.0 110.379 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.435 ' O ' ' HD3' ' A' ' 41' ' ' LYS . . . -58.95 -68.78 1.52 Allowed Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.135 -1.586 . . . . 0.0 109.135 179.554 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -78.09 -15.97 58.41 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.719 -0.871 . . . . 0.0 111.876 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 51.2 m -61.49 -40.88 96.18 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.023 -1.048 . . . . 0.0 109.277 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.58 -37.69 87.4 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.32 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.435 ' HD3' ' O ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -70.15 -31.72 69.35 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.789 -0.57 . . . . 0.0 110.133 -179.481 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.51 -11.75 60.55 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.26 -0.9 . . . . 0.0 110.515 179.683 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 77.2 mt -97.04 -27.87 14.41 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.301 -0.874 . . . . 0.0 110.172 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -89.63 -46.34 4.32 Favored Glycine 0 N--CA 1.493 2.472 0 N-CA-C 109.629 -1.389 . . . . 0.0 109.629 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -51.43 -31.9 24.62 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.388 -1.066 . . . . 0.0 110.825 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 75.7 mtp -87.77 -41.47 13.27 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.563 -0.711 . . . . 0.0 109.817 179.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -57.2 -22.2 38.99 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.609 -0.682 . . . . 0.0 110.804 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -94.04 -35.67 12.48 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.381 -0.825 . . . . 0.0 110.131 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -61.38 -34.23 74.98 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.524 -0.735 . . . . 0.0 109.968 179.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -58.04 150.2 21.52 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.572 -0.705 . . . . 0.0 110.507 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 17.1 t -89.43 -151.63 0.23 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.616 -0.678 . . . . 0.0 109.588 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -84.01 54.66 3.0 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.249 -0.907 . . . . 0.0 110.181 179.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.4 mttp -136.87 -41.59 0.6 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.473 -0.767 . . . . 0.0 110.435 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -62.31 -37.45 85.63 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.522 -0.736 . . . . 0.0 110.388 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -96.28 20.41 10.45 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.371 -0.83 . . . . 0.0 110.918 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.453 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 3.7 mt-30 -88.33 -59.03 0.26 Allowed Pre-proline 0 N--CA 1.496 1.867 0 O-C-N 121.165 -0.959 . . . . 0.0 109.759 179.571 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.453 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 57.3 Cg_endo -81.58 -23.89 4.63 Favored 'Trans proline' 0 C--N 1.32 -0.971 0 O-C-N 122.99 0.995 . . . . 0.0 110.353 179.013 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -81.56 -20.31 40.19 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.59 -0.694 . . . . 0.0 111.827 -178.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.37 -22.06 35.63 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.145 -0.972 . . . . 0.0 110.79 -179.564 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -84.02 -24.09 30.65 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.379 -0.825 . . . . 0.0 110.422 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -62.39 -47.29 84.78 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.44 -0.787 . . . . 0.0 109.778 179.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -74.53 -9.44 58.58 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.595 -0.691 . . . . 0.0 110.916 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.64 -0.61 55.58 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.3 -0.875 . . . . 0.0 110.283 179.015 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 47.7 mmtt -105.48 -29.18 10.37 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.21 -0.931 . . . . 0.0 109.943 179.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.2 mp -86.85 -14.23 42.66 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.963 -0.461 . . . . 0.0 110.031 178.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.8 tptt -76.3 -30.35 57.7 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.284 -0.885 . . . . 0.0 109.469 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -67.42 -59.72 3.16 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.651 -0.655 . . . . 0.0 109.484 179.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.9 mmpt? -60.25 -25.71 65.88 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.641 -0.662 . . . . 0.0 110.511 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.423 ' CD2' ' HB2' ' A' ' 9' ' ' PRO . 21.4 t80 -71.5 -65.14 0.79 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.37 -0.831 . . . . 0.0 109.255 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -61.29 -17.5 53.86 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.836 -0.54 . . . . 0.0 111.082 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -98.62 -20.83 16.78 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.283 -0.885 . . . . 0.0 111.568 -179.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -106.36 -32.69 8.03 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.23 -0.919 . . . . 0.0 111.064 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 8.4 tp . . . . . 0 N--CA 1.495 1.816 0 O-C-N 121.419 -0.801 . . . . 0.0 110.372 -179.573 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo . . . . . 0 N--CA 1.485 0.973 0 N-CA-C 110.008 -0.805 . . . . 0.0 110.008 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 35.87 -156.49 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.324 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 178.596 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -108.43 153.92 41.78 Favored Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.583 -0.698 . . . . 0.0 109.483 179.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -73.15 113.96 3.91 Favored 'Trans proline' 0 C--N 1.316 -1.155 0 O-C-N 123.316 1.166 . . . . 0.0 110.803 -179.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -82.98 173.18 10.34 Favored 'Trans proline' 0 C--N 1.318 -1.045 0 O-C-N 123.37 1.194 . . . . 0.0 110.122 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 42.2 t -165.4 63.33 0.12 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.492 -0.755 . . . . 0.0 110.616 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 66.64 -77.25 0.04 OUTLIER 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.114 -0.991 . . . . 0.0 110.361 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -47.7 -49.49 27.66 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.302 -0.874 . . . . 0.0 111.401 -179.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -59.07 -35.86 74.08 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.616 -0.677 . . . . 0.0 109.945 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 23.0 mt -74.27 -32.62 62.99 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.624 -0.673 . . . . 0.0 110.323 -179.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.422 ' CE1' ' CZ ' ' A' ' 23' ' ' TYR . 68.1 t80 -79.65 -55.26 5.15 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.498 -0.751 . . . . 0.0 110.647 -179.363 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.9 t -57.15 -54.58 45.13 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.526 -0.734 . . . . 0.0 110.686 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.1 t -55.74 -22.49 24.13 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.438 -0.788 . . . . 0.0 110.982 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 41.1 mm-40 -100.93 -25.1 14.2 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.406 -0.809 . . . . 0.0 110.936 -179.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.422 ' CZ ' ' CE1' ' A' ' 19' ' ' PHE . 10.9 m-85 -96.71 12.43 31.94 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.395 -0.815 . . . . 0.0 111.522 -179.376 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.484 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 50.9 mtt180 -87.04 -45.02 0.53 Allowed Pre-proline 0 N--CA 1.489 1.482 0 O-C-N 121.226 -0.921 . . . . 0.0 112.164 179.538 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.497 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.1 Cg_endo -66.71 -15.67 48.11 Favored 'Trans proline' 0 N--CA 1.49 1.308 0 O-C-N 122.89 0.942 . . . . 0.0 110.484 -179.231 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -72.88 -50.19 25.32 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 177.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 28.0 mm -54.62 -32.96 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 CA-C-O 121.377 0.608 . . . . 0.0 110.288 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.502 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 5.0 mmmm -72.3 -36.59 68.98 Favored 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.3 -177.149 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.8 t -60.02 -25.76 65.56 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.551 -0.718 . . . . 0.0 110.661 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -115.35 -22.73 9.22 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.545 -0.722 . . . . 0.0 110.766 -179.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 39.2 m80 -121.41 96.07 48.01 Favored Pre-proline 0 N--CA 1.496 1.865 0 O-C-N 121.485 -0.76 . . . . 0.0 109.596 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -75.21 -31.17 6.16 Favored 'Trans proline' 0 C--N 1.315 -1.221 0 O-C-N 123.393 1.207 . . . . 0.0 110.344 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.409 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -80.38 -16.37 76.23 Favored Glycine 0 N--CA 1.489 2.193 0 N-CA-C 110.298 -1.121 . . . . 0.0 110.298 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.16 82.64 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.408 -1.054 . . . . 0.0 111.222 -179.356 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.409 ' N ' ' O ' ' A' ' 33' ' ' GLY . 71.8 m -69.55 172.43 7.34 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.479 -0.763 . . . . 0.0 109.701 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.5 mp -56.15 -28.39 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.108 0 O-C-N 121.273 -0.892 . . . . 0.0 109.735 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.79 -65.34 3.39 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.235 -1.546 . . . . 0.0 109.235 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -70.02 -30.82 68.22 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.604 -0.939 . . . . 0.0 110.466 179.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 54.7 m -63.97 -30.66 71.72 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.494 -0.754 . . . . 0.0 109.96 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.78 -43.29 47.19 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.562 -0.711 . . . . 0.0 110.118 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -87.72 -10.02 52.38 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.62 -0.675 . . . . 0.0 111.695 -179.525 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.42 -60.99 2.11 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.05 -1.031 . . . . 0.0 109.683 179.571 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 21.8 mt -49.23 -25.66 2.43 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.518 -0.739 . . . . 0.0 111.378 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -66.28 -36.89 92.34 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 109.365 -1.494 . . . . 0.0 109.365 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -51.92 -34.61 42.35 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.474 -1.015 . . . . 0.0 111.016 -179.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 7.6 mtt -85.14 -43.01 14.23 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.495 -0.753 . . . . 0.0 109.998 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . 0.421 ' CH2' ' HG2' ' A' ' 55' ' ' LYS . 64.4 t-105 -51.19 -36.69 42.58 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.528 -0.733 . . . . 0.0 111.174 -179.532 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 6.9 t -85.53 -27.8 25.34 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.438 -0.789 . . . . 0.0 110.117 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -58.63 -39.04 79.39 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.479 -0.763 . . . . 0.0 110.113 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.28 167.33 16.58 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.58 -0.7 . . . . 0.0 109.749 179.523 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.4 m -146.57 101.39 3.46 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.608 -0.683 . . . . 0.0 110.498 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 51.51 48.55 22.71 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.409 -0.807 . . . . 0.0 110.969 179.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 14.1 tttp -141.6 -65.57 0.42 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.553 -0.717 . . . . 0.0 110.236 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -64.48 -24.88 67.77 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.524 -0.735 . . . . 0.0 110.721 -179.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.421 ' HG2' ' CH2' ' A' ' 47' ' ' TRP . 39.9 mtpt -80.45 -35.14 35.34 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.476 -0.765 . . . . 0.0 110.759 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -46.4 -53.22 24.88 Favored Pre-proline 0 N--CA 1.505 2.303 0 O-C-N 121.51 -0.744 . . . . 0.0 112.021 -179.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -77.62 -39.98 0.47 Allowed 'Trans proline' 0 C--N 1.314 -1.257 0 O-C-N 123.171 1.09 . . . . 0.0 110.956 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -80.21 5.33 14.86 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.453 -0.779 . . . . 0.0 112.07 -178.404 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.32 -18.68 16.68 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.876 -1.14 . . . . 0.0 110.727 179.466 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -79.86 -28.12 40.02 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.261 -0.9 . . . . 0.0 110.224 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 45.6 tttm -60.25 -41.24 92.77 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.544 -0.722 . . . . 0.0 110.097 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.05 -10.93 60.03 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.596 -0.69 . . . . 0.0 110.817 179.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -90.27 6.17 44.04 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.122 -0.986 . . . . 0.0 110.634 179.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -106.2 -36.94 6.73 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.254 -0.903 . . . . 0.0 109.028 178.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 6.8 mp -76.85 -0.08 22.75 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.912 -0.493 . . . . 0.0 111.07 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 19.1 tttm -91.3 -22.83 20.35 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.062 -1.024 . . . . 0.0 110.005 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -84.02 -16.16 44.94 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.475 -0.765 . . . . 0.0 110.522 179.55 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -102.2 -27.57 12.8 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.307 -0.871 . . . . 0.0 109.981 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 17.0 t80 -78.05 -51.05 10.92 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.62 -0.675 . . . . 0.0 109.799 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -60.67 -15.53 29.68 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.783 -0.573 . . . . 0.0 111.419 -179.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -107.3 -30.47 8.7 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.092 -1.005 . . . . 0.0 110.056 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -86.14 -31.27 21.92 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.559 -0.713 . . . . 0.0 110.488 -179.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 6.0 tp . . . . . 0 N--CA 1.495 1.793 0 O-C-N 121.539 -0.725 . . . . 0.0 109.993 -179.905 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo . . . . . 0 N--CA 1.484 0.925 0 N-CA-C 110.27 -0.704 . . . . 0.0 110.27 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.31 -165.98 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.522 -0.736 . . . . 0.0 109.993 179.823 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -70.57 145.8 93.08 Favored Pre-proline 0 N--CA 1.496 1.874 0 O-C-N 121.429 -0.795 . . . . 0.0 110.207 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.426 ' HD3' ' CZ ' ' A' ' 69' ' ' TYR . 47.8 Cg_endo -76.25 128.85 10.8 Favored 'Trans proline' 0 C--N 1.318 -1.04 0 O-C-N 123.342 1.18 . . . . 0.0 109.993 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -81.65 -175.82 2.77 Favored 'Trans proline' 0 C--N 1.318 -1.048 0 O-C-N 123.24 1.126 . . . . 0.0 110.181 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.6 t -168.74 56.77 0.05 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.53 -0.731 . . . . 0.0 110.628 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 70.32 -76.92 0.06 Allowed 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.15 -0.969 . . . . 0.0 110.198 -179.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -49.19 -49.81 40.98 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.228 -0.92 . . . . 0.0 111.058 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -57.88 -37.72 74.47 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.604 -0.685 . . . . 0.0 109.457 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.3 mt -67.06 -45.48 77.24 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.725 -0.609 . . . . 0.0 109.992 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -63.58 -50.17 70.5 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.541 -0.724 . . . . 0.0 109.728 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.9 t -62.87 -29.38 70.71 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 120.05 -0.66 . . . . 0.0 109.597 179.309 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 65.4 p -95.26 14.74 21.29 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.627 -0.671 . . . . 0.0 111.034 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -139.51 -5.02 1.41 Allowed 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.137 -0.977 . . . . 0.0 111.965 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -121.19 -29.22 4.56 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.902 -1.124 . . . . 0.0 110.895 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.486 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 5.9 mtt180 -47.64 -53.28 31.75 Favored Pre-proline 0 N--CA 1.498 1.944 0 O-C-N 121.284 -0.885 . . . . 0.0 112.491 -179.506 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.486 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 35.3 Cg_endo -58.61 -27.74 83.79 Favored 'Trans proline' 0 N--CA 1.495 1.611 0 O-C-N 123.188 1.099 . . . . 0.0 110.202 -179.594 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -69.23 -45.73 69.11 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 177.505 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.9 mm -60.4 -17.46 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.847 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.487 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 8.2 mmmm -86.89 -27.37 23.46 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.078 -1.014 . . . . 0.0 110.39 -177.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 6.6 t -70.11 -14.32 62.6 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.425 -0.797 . . . . 0.0 110.992 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -133.26 2.47 3.57 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.14 -0.975 . . . . 0.0 111.784 -179.551 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 31.5 m80 -142.39 93.46 7.1 Favored Pre-proline 0 N--CA 1.498 1.927 0 O-C-N 121.073 -1.017 . . . . 0.0 109.298 179.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -75.0 -33.98 4.18 Favored 'Trans proline' 0 C--N 1.315 -1.204 0 O-C-N 123.52 1.274 . . . . 0.0 110.29 -179.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.407 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -72.48 -30.93 63.73 Favored Glycine 0 N--CA 1.487 2.076 0 N-CA-C 109.304 -1.518 . . . . 0.0 109.304 179.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -46.01 90.65 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.76 -0.847 . . . . 0.0 111.925 -179.487 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.407 ' N ' ' O ' ' A' ' 33' ' ' GLY . 22.8 t -88.72 170.94 10.35 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.558 -0.714 . . . . 0.0 109.596 179.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.2 mp -53.12 -24.63 8.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.073 0 O-C-N 121.372 -0.83 . . . . 0.0 110.26 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.3 -66.4 2.62 Favored Glycine 0 N--CA 1.493 2.467 0 N-CA-C 108.958 -1.657 . . . . 0.0 108.958 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -75.16 -28.29 60.04 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.755 -0.85 . . . . 0.0 110.216 179.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 88.3 m -68.87 -28.51 66.78 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.573 -0.704 . . . . 0.0 110.347 179.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -79.6 -25.37 41.51 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.453 -0.78 . . . . 0.0 109.975 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -105.17 -11.94 16.33 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.617 -0.677 . . . . 0.0 111.014 179.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.4 tptt -84.77 -10.76 56.9 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.026 -1.046 . . . . 0.0 110.483 179.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 28.8 mt -90.16 -31.99 16.83 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.331 -0.856 . . . . 0.0 109.294 179.096 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.53 -32.3 71.3 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 108.717 -1.753 . . . . 0.0 108.717 179.119 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -55.96 -40.05 72.67 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.62 -0.929 . . . . 0.0 110.576 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 9.2 mmt -78.73 -46.09 19.74 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.568 -0.708 . . . . 0.0 110.209 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . 0.43 ' CE2' ' HG2' ' A' ' 55' ' ' LYS . 67.1 t-105 -59.95 -17.3 36.89 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.543 -0.723 . . . . 0.0 111.245 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.6 t -103.48 -37.72 7.47 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.226 -0.921 . . . . 0.0 111.575 -179.095 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -75.12 -32.89 61.51 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.284 -0.885 . . . . 0.0 111.745 -178.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 13.5 mm-40 -59.27 156.78 11.86 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.21 -0.931 . . . . 0.0 110.919 -179.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 77.2 p -77.87 -137.8 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 179.161 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -90.5 36.1 0.89 Allowed 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.854 -1.154 . . . . 0.0 110.795 179.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 11.6 mptt -116.11 -35.56 4.35 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.359 -0.838 . . . . 0.0 109.67 179.483 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -92.92 53.66 2.04 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 108.485 -0.932 . . . . 0.0 108.485 178.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.43 ' HG2' ' CE2' ' A' ' 47' ' ' TRP . 0.0 OUTLIER -173.01 -65.18 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 179.696 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.406 ' CB ' ' CD ' ' A' ' 57' ' ' PRO . 0.3 OUTLIER -40.2 -58.05 2.53 Favored Pre-proline 0 N--CA 1.506 2.346 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -179.253 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.406 ' CD ' ' CB ' ' A' ' 56' ' ' GLN . 42.4 Cg_endo -67.37 -32.38 32.6 Favored 'Trans proline' 0 N--CA 1.488 1.16 0 O-C-N 123.072 1.038 . . . . 0.0 110.833 -179.285 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -82.99 -14.18 54.53 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.5 -0.75 . . . . 0.0 110.69 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.403 ' N ' ' O ' ' A' ' 55' ' ' LYS . 29.0 mm-40 -77.9 -64.03 1.25 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.348 -0.845 . . . . 0.0 110.132 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -53.05 -23.52 7.84 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.548 -0.72 . . . . 0.0 111.366 -179.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 66.4 tttt -63.08 -48.73 77.37 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.465 -0.772 . . . . 0.0 110.13 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -78.05 -16.31 58.16 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.559 -0.713 . . . . 0.0 110.176 179.187 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.7 -35.08 77.0 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.428 -0.795 . . . . 0.0 110.454 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 67.5 mmtt -74.58 -63.41 1.25 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.322 -0.861 . . . . 0.0 110.102 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.0 mp -45.59 -26.59 0.62 Allowed 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.599 -0.688 . . . . 0.0 111.882 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 32.4 tptt -65.68 -45.08 84.21 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.324 -0.86 . . . . 0.0 109.507 179.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -66.17 -55.16 17.73 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.665 -0.647 . . . . 0.0 110.121 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -55.0 -31.49 61.06 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.466 -0.771 . . . . 0.0 110.485 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.426 ' CZ ' ' HD3' ' A' ' 12' ' ' PRO . 76.5 t80 -75.92 -68.64 0.56 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.538 -0.726 . . . . 0.0 109.674 179.621 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -48.73 -28.45 3.62 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.687 -0.633 . . . . 0.0 111.284 -179.612 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.2 mmmt -86.22 -57.72 2.91 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.6 -0.687 . . . . 0.0 110.545 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -62.88 -30.92 71.9 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.504 -0.747 . . . . 0.0 110.968 -179.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.7 tp . . . . . 0 N--CA 1.495 1.807 0 O-C-N 121.419 -0.8 . . . . 0.0 110.496 -179.475 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo . . . . . 0 N--CA 1.484 0.935 0 N-CA-C 110.561 -0.592 . . . . 0.0 110.561 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -166.2 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.484 -0.76 . . . . 0.0 110.018 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.72 141.24 92.69 Favored Pre-proline 0 N--CA 1.497 1.913 0 O-C-N 121.509 -0.745 . . . . 0.0 109.938 179.943 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -74.37 132.56 16.46 Favored 'Trans proline' 0 C--N 1.317 -1.099 0 O-C-N 123.309 1.163 . . . . 0.0 109.972 179.786 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -81.12 -173.15 1.72 Allowed 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.184 1.097 . . . . 0.0 110.004 -179.737 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 31.1 t -167.98 59.41 0.07 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.41 -0.806 . . . . 0.0 110.549 -179.898 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 69.43 -75.76 0.07 Allowed 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.256 -0.902 . . . . 0.0 110.303 -179.527 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -47.3 -52.53 16.05 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.323 -0.861 . . . . 0.0 111.439 -179.388 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -58.1 -39.98 80.01 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.578 -0.701 . . . . 0.0 109.656 179.666 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.4 mt -62.32 -45.41 93.33 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.646 -0.659 . . . . 0.0 109.84 179.833 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.497 ' CZ ' ' CE2' ' A' ' 23' ' ' TYR . 43.0 t80 -68.48 -51.62 41.39 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.757 -0.59 . . . . 0.0 110.421 -179.649 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.6 m -56.4 -54.98 39.21 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.523 -0.735 . . . . 0.0 110.813 -179.613 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 88.7 p -57.42 -30.09 64.68 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.466 -0.771 . . . . 0.0 110.856 -179.666 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 -89.95 -23.55 21.52 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.475 -0.766 . . . . 0.0 111.302 -179.29 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.497 ' CE2' ' CZ ' ' A' ' 19' ' ' PHE . 9.0 m-85 -96.02 -34.25 11.83 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.352 -0.842 . . . . 0.0 110.927 -179.423 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.497 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 29.8 mtt-85 -48.28 -53.02 37.72 Favored Pre-proline 0 N--CA 1.498 1.959 0 O-C-N 121.376 -0.828 . . . . 0.0 112.109 -179.881 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.5 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.1 Cg_endo -59.38 -28.61 88.03 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 O-C-N 123.218 1.115 . . . . 0.0 110.155 179.968 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.0 tmtt? -68.89 -45.2 71.54 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 177.918 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 47.4 mm -58.93 -27.4 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.233 179.755 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.5 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.6 mmmm -75.66 -35.23 60.46 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 119.789 -0.765 . . . . 0.0 110.214 -177.53 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 13.4 t -64.94 -21.39 66.82 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.444 -0.785 . . . . 0.0 110.591 179.932 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -121.42 -10.36 8.89 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.307 -0.871 . . . . 0.0 111.415 -179.56 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -134.36 94.2 17.98 Favored Pre-proline 0 N--CA 1.497 1.911 0 O-C-N 121.227 -0.92 . . . . 0.0 109.449 179.175 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -74.95 -32.63 5.29 Favored 'Trans proline' 0 C--N 1.315 -1.198 0 O-C-N 123.531 1.28 . . . . 0.0 110.193 -179.679 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.411 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -76.36 -23.11 71.69 Favored Glycine 0 N--CA 1.488 2.118 0 N-CA-C 109.767 -1.333 . . . . 0.0 109.767 179.674 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -54.78 86.01 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.696 -0.885 . . . . 0.0 111.37 -179.548 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.411 ' N ' ' O ' ' A' ' 33' ' ' GLY . 75.7 m -77.6 172.09 13.92 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.466 -0.771 . . . . 0.0 109.523 179.573 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.2 mm -52.74 -30.02 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.133 0 O-C-N 121.31 -0.868 . . . . 0.0 110.322 -179.934 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.98 -66.64 2.55 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.197 -1.561 . . . . 0.0 109.197 179.7 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.87 -31.41 69.22 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.622 -0.928 . . . . 0.0 110.381 179.639 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 91.1 m -65.26 -31.35 72.46 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.403 -0.81 . . . . 0.0 110.0 179.514 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.89 -42.63 48.55 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.551 -0.718 . . . . 0.0 110.303 179.973 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -88.2 -12.58 43.41 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.522 -0.736 . . . . 0.0 111.853 -179.284 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.7 tptt -77.73 -58.86 3.04 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 120.941 -1.099 . . . . 0.0 109.869 179.694 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 39.9 mt -48.11 -28.27 2.81 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 121.528 -0.732 . . . . 0.0 111.184 -179.579 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -64.56 -37.58 94.59 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.236 -1.545 . . . . 0.0 109.236 179.6 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -49.42 -34.98 17.81 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.551 -0.97 . . . . 0.0 111.225 -179.639 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 7.9 mmt -89.63 -36.64 15.16 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.578 -0.701 . . . . 0.0 110.112 179.763 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . 0.418 ' CZ2' ' HG2' ' A' ' 55' ' ' LYS . 73.6 t-105 -65.27 -12.29 50.06 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.603 -0.686 . . . . 0.0 111.254 -179.596 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 27.8 t -99.94 -42.7 6.67 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.109 -0.994 . . . . 0.0 110.781 -179.684 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -66.13 -29.21 69.47 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.441 -0.787 . . . . 0.0 110.493 -179.696 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -58.37 150.36 22.39 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.506 -0.746 . . . . 0.0 110.309 179.902 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.4 t -94.13 -154.08 0.4 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.612 -0.68 . . . . 0.0 109.684 179.75 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -86.19 52.32 2.46 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.361 -0.837 . . . . 0.0 110.028 179.624 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 22.4 mttp -127.63 -46.89 1.42 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.544 -0.722 . . . . 0.0 110.302 -179.855 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -67.97 -31.32 70.96 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.577 -0.702 . . . . 0.0 111.214 -179.203 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.418 ' HG2' ' CZ2' ' A' ' 47' ' ' TRP . 34.3 mtpt -80.43 -37.64 31.65 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.344 -0.847 . . . . 0.0 111.127 -179.198 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -43.46 -56.12 7.37 Favored Pre-proline 0 N--CA 1.509 2.476 0 O-C-N 121.451 -0.781 . . . . 0.0 112.7 -178.443 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -76.2 -35.92 2.12 Favored 'Trans proline' 0 C--N 1.315 -1.203 0 O-C-N 123.049 1.026 . . . . 0.0 111.417 -179.35 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -82.04 -8.85 59.69 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.39 -0.819 . . . . 0.0 112.132 -178.314 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.07 -23.76 22.46 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.021 -1.049 . . . . 0.0 111.201 -179.193 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -78.98 -20.79 48.27 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.376 -0.828 . . . . 0.0 110.804 -179.823 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 22.1 tttp -60.43 -50.04 75.18 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.365 -0.834 . . . . 0.0 110.301 179.997 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.48 -10.84 59.71 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 119.839 -0.744 . . . . 0.0 110.429 179.493 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.9 -25.73 67.29 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.286 -0.884 . . . . 0.0 109.469 179.277 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -79.57 -64.8 1.1 Allowed 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.835 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.8 mp -42.07 -20.52 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.279 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 -178.914 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 57.2 tttt -70.39 -32.83 70.64 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.646 -1.284 . . . . 0.0 109.067 178.491 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -85.99 -5.3 59.25 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.703 -0.623 . . . . 0.0 110.751 179.451 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.2 tptt -102.4 -37.77 7.89 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.251 -0.906 . . . . 0.0 108.952 179.234 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.421 ' CE2' HD11 ' A' ' 73' ' ' ILE . 19.0 t80 -75.7 -56.58 4.55 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 179.149 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -57.22 -20.28 26.21 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.839 -0.538 . . . . 0.0 111.236 -179.674 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.0 mttt -98.9 -23.64 15.26 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.226 -0.921 . . . . 0.0 111.07 -179.379 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -103.3 -31.35 10.1 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.428 -0.795 . . . . 0.0 111.125 -179.216 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . 0.421 HD11 ' CE2' ' A' ' 69' ' ' TYR . 2.5 tp . . . . . 0 N--CA 1.497 1.88 0 O-C-N 121.43 -0.794 . . . . 0.0 110.539 -179.422 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.424 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 48.0 Cg_endo . . . . . 0 N--CA 1.484 0.948 0 N-CA-C 110.521 -0.607 . . . . 0.0 110.521 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.4 pttm -144.18 31.37 1.24 Allowed 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.646 -0.659 . . . . 0.0 110.451 -179.966 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 43.1 mtt180 -147.17 68.78 11.49 Favored Pre-proline 0 N--CA 1.493 1.711 0 C-N-CA 120.444 -0.502 . . . . 0.0 110.183 -179.807 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.416 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.3 Cg_endo -77.31 123.6 6.69 Favored 'Trans proline' 0 C--N 1.316 -1.149 0 O-C-N 123.264 1.139 . . . . 0.0 110.452 -179.932 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -81.52 176.44 8.58 Favored 'Trans proline' 0 C--N 1.318 -1.053 0 O-C-N 123.26 1.137 . . . . 0.0 109.835 179.793 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 52.4 p -167.48 56.54 0.07 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.379 -0.826 . . . . 0.0 111.043 -179.753 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 68.94 -79.81 0.04 OUTLIER 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.143 -0.973 . . . . 0.0 110.807 -179.905 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -47.36 -51.04 20.77 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.117 -0.989 . . . . 0.0 111.412 -179.33 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -54.97 -27.73 46.14 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.523 -0.735 . . . . 0.0 110.28 179.743 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 21.3 mt -85.17 -24.63 27.84 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.523 -0.735 . . . . 0.0 110.386 -179.925 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.496 ' CE1' ' CE1' ' A' ' 23' ' ' TYR . 80.5 t80 -81.27 -57.45 3.49 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.469 -0.769 . . . . 0.0 110.756 -179.267 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.7 t -60.18 -48.8 80.19 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.502 -0.749 . . . . 0.0 110.403 -179.717 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 30.7 t -57.43 -21.5 37.13 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.636 -0.665 . . . . 0.0 110.881 -179.768 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -107.67 -13.61 15.0 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.35 -0.843 . . . . 0.0 111.442 -179.489 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.496 ' CE1' ' CE1' ' A' ' 19' ' ' PHE . 2.6 m-85 -94.69 -37.76 11.14 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.173 -0.955 . . . . 0.0 110.602 -179.592 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.503 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 5.9 mtt180 -46.88 -51.77 37.04 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.437 -0.789 . . . . 0.0 112.265 -179.625 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 36.5 Cg_endo -60.2 -26.52 82.77 Favored 'Trans proline' 0 N--CA 1.493 1.486 0 O-C-N 123.24 1.126 . . . . 0.0 110.089 179.779 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.0 tmtt? -69.65 -47.37 63.57 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 177.494 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.4 ' O ' ' HB2' ' A' ' 31' ' ' HIS . 46.4 mm -57.97 -18.67 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.607 179.543 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.497 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 7.1 mmmm -85.24 -28.58 25.29 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.189 -0.944 . . . . 0.0 110.293 -177.843 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.1 t -68.55 -18.74 64.41 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.507 -0.745 . . . . 0.0 110.846 -179.979 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -127.59 -1.59 6.14 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.313 -0.867 . . . . 0.0 111.611 -179.598 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.4 ' HB2' ' O ' ' A' ' 27' ' ' ILE . 26.7 m80 -140.71 93.58 8.49 Favored Pre-proline 0 N--CA 1.497 1.925 0 O-C-N 121.135 -0.978 . . . . 0.0 109.057 179.035 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -74.68 -37.32 2.32 Favored 'Trans proline' 0 C--N 1.316 -1.155 0 O-C-N 123.511 1.269 . . . . 0.0 110.384 -179.467 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.68 -26.73 73.56 Favored Glycine 0 N--CA 1.488 2.159 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 179.571 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -48.2 90.87 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.616 -0.932 . . . . 0.0 111.704 -179.501 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.1 p -76.71 -179.67 5.49 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.533 -0.729 . . . . 0.0 109.475 179.595 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.0 mp -60.54 -33.91 56.29 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 O-C-N 121.37 -0.831 . . . . 0.0 109.297 179.822 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.09 -54.61 36.6 Favored Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.024 -1.631 . . . . 0.0 109.024 179.483 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.421 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 23.8 m-20 -73.39 -36.9 66.1 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.763 -0.845 . . . . 0.0 110.031 179.017 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.9 m -65.3 -25.13 67.49 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.238 -0.914 . . . . 0.0 110.263 179.265 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -84.43 -33.02 23.79 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.418 -0.802 . . . . 0.0 110.328 -179.942 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.0 ptpt -100.06 -14.7 18.5 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.442 -0.786 . . . . 0.0 111.79 -179.179 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.421 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -85.06 -5.21 59.35 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.921 -1.112 . . . . 0.0 110.547 179.338 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 86.4 mt -96.83 -38.74 9.74 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.283 -0.886 . . . . 0.0 109.237 179.337 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -59.22 -32.76 72.59 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 109.863 -1.295 . . . . 0.0 109.863 -179.943 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -55.36 -37.22 67.21 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.513 -0.992 . . . . 0.0 110.419 -179.992 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 14.3 mtt -76.14 -44.42 38.47 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.621 -0.674 . . . . 0.0 109.598 179.408 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 70.7 t-105 -54.64 -22.69 14.34 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.621 -0.674 . . . . 0.0 110.897 -179.955 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.1 t -88.82 -31.49 18.3 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.282 -0.886 . . . . 0.0 110.117 179.94 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -90.88 -4.8 56.27 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.533 -0.73 . . . . 0.0 110.995 179.674 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.4 pp0? -59.03 -167.35 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.217 -0.927 . . . . 0.0 110.621 179.928 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.2 t -156.75 -147.07 0.18 Allowed 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 179.897 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.88 -3.82 31.2 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.135 -0.978 . . . . 0.0 111.035 179.684 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.4 mtmt -90.89 -38.78 12.69 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.92 -1.113 . . . . 0.0 110.901 -179.524 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -87.91 49.87 1.88 Allowed 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.339 -0.851 . . . . 0.0 110.777 -179.366 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.417 ' O ' ' N ' ' A' ' 59' ' ' GLU . 17.6 mtmt -159.82 -59.81 0.06 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.581 -0.699 . . . . 0.0 109.697 178.673 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 -41.15 -52.29 7.29 Favored Pre-proline 0 N--CA 1.506 2.352 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -179.097 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -75.29 -36.03 2.61 Favored 'Trans proline' 0 N--CA 1.489 1.213 0 O-C-N 123.129 1.068 . . . . 0.0 112.182 -179.208 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -87.68 -17.85 30.87 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 121.221 -0.925 . . . . 0.0 111.848 -178.611 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.417 ' N ' ' O ' ' A' ' 55' ' ' LYS . 0.2 OUTLIER -85.35 -30.9 23.3 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.25 -0.907 . . . . 0.0 110.018 -179.417 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -77.71 -24.74 49.11 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.748 -0.595 . . . . 0.0 110.159 179.494 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 73.1 tttt -62.91 -43.1 99.71 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.46 -0.775 . . . . 0.0 109.858 179.728 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -78.94 -16.38 57.04 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.515 -0.741 . . . . 0.0 109.943 178.987 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.25 -42.75 87.08 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.404 -0.81 . . . . 0.0 110.449 179.954 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -70.08 -62.27 1.45 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.306 -0.871 . . . . 0.0 110.055 -179.989 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.3 mp -45.69 -27.15 0.75 Allowed 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.688 -0.632 . . . . 0.0 111.815 -179.419 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.1 tptt -64.25 -51.85 61.56 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.42 -0.8 . . . . 0.0 109.421 179.142 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -60.82 -52.0 66.94 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.647 -0.658 . . . . 0.0 109.846 179.499 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 69.5 mttt -56.19 -26.11 49.5 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.527 -0.733 . . . . 0.0 110.536 179.926 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.424 ' CD2' ' HB2' ' A' ' 9' ' ' PRO . 32.8 t80 -81.92 -63.37 1.4 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.396 -0.815 . . . . 0.0 109.538 179.468 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -55.21 -23.87 24.36 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.475 -0.766 . . . . 0.0 110.682 179.718 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 25.3 ttmt -89.42 -59.86 2.1 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.452 -0.78 . . . . 0.0 110.426 -179.924 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -56.28 -23.09 34.29 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.529 -0.732 . . . . 0.0 111.084 -179.403 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 7.1 tp . . . . . 0 N--CA 1.496 1.858 0 O-C-N 121.342 -0.849 . . . . 0.0 109.88 179.764 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo . . . . . 0 N--CA 1.485 0.978 0 N-CA-C 110.286 -0.698 . . . . 0.0 110.286 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.53 -164.78 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.631 -0.668 . . . . 0.0 110.438 -179.779 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.4 mpt_? -60.6 142.27 91.5 Favored Pre-proline 0 N--CA 1.496 1.854 0 O-C-N 121.618 -0.677 . . . . 0.0 110.124 -179.989 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -75.13 131.55 14.28 Favored 'Trans proline' 0 C--N 1.318 -1.076 0 O-C-N 123.324 1.171 . . . . 0.0 110.053 179.876 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -81.72 -177.08 3.36 Favored 'Trans proline' 0 C--N 1.318 -1.075 0 O-C-N 123.195 1.103 . . . . 0.0 110.21 -179.815 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.7 t -166.31 65.2 0.1 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.513 -0.742 . . . . 0.0 110.527 -179.846 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 66.91 -76.59 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.057 -1.027 . . . . 0.0 110.043 -179.388 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -48.8 -46.81 42.23 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.354 -0.841 . . . . 0.0 111.274 -179.812 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -60.38 -32.75 71.6 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.597 -0.689 . . . . 0.0 110.118 179.784 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 22.2 mt -79.4 -30.43 42.42 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.571 -0.706 . . . . 0.0 110.433 -179.496 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.498 ' CE2' ' CE1' ' A' ' 23' ' ' TYR . 31.0 t80 -77.41 -54.43 6.45 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.562 -0.711 . . . . 0.0 110.685 -179.392 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 45.3 t -57.91 -50.38 73.53 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.578 -0.702 . . . . 0.0 110.675 -179.539 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 99.5 p -59.01 -24.48 62.83 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.553 -0.717 . . . . 0.0 110.944 -179.688 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -99.36 -25.62 14.41 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.398 -0.813 . . . . 0.0 111.305 -179.251 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.498 ' CE1' ' CE2' ' A' ' 19' ' ' PHE . 4.6 m-85 -86.5 -34.41 20.03 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.345 -0.847 . . . . 0.0 111.123 -179.281 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.461 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 4.0 mtt180 -46.6 -54.45 18.95 Favored Pre-proline 0 N--CA 1.499 1.995 0 O-C-N 121.384 -0.823 . . . . 0.0 112.251 -179.59 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.461 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 37.0 Cg_endo -61.09 -25.73 81.65 Favored 'Trans proline' 0 N--CA 1.494 1.507 0 O-C-N 123.305 1.161 . . . . 0.0 110.194 179.895 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -69.87 -46.6 65.16 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.179 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 35.9 mm -57.67 -29.61 35.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 CA-C-O 121.171 0.51 . . . . 0.0 110.402 179.873 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.524 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 5.5 mmmm -74.04 -36.28 64.39 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 120.01 -0.676 . . . . 0.0 110.204 -177.068 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.4 t -67.51 -19.15 65.28 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.458 -0.776 . . . . 0.0 110.48 179.7 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -118.65 -12.28 9.75 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.333 -0.854 . . . . 0.0 111.356 -179.628 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 42.3 m80 -133.54 94.25 19.86 Favored Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 121.152 -0.967 . . . . 0.0 109.737 179.515 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -75.65 -33.73 3.78 Favored 'Trans proline' 0 C--N 1.316 -1.155 0 O-C-N 123.592 1.312 . . . . 0.0 110.109 -179.841 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.43 -21.15 75.88 Favored Glycine 0 N--CA 1.489 2.198 0 N-CA-C 109.845 -1.302 . . . . 0.0 109.845 179.643 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.18 91.11 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.497 -1.002 . . . . 0.0 111.373 -179.691 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 50.6 p -77.35 165.49 24.38 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.53 -0.731 . . . . 0.0 109.757 179.707 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.4 mp -52.12 -27.38 9.62 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 O-C-N 121.432 -0.793 . . . . 0.0 110.171 -179.953 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.15 -61.44 6.65 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.054 -1.618 . . . . 0.0 109.054 179.607 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.422 ' O ' ' N ' ' A' ' 42' ' ' LYS . 32.8 t0 -76.86 -25.26 52.91 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.735 -0.862 . . . . 0.0 110.584 179.865 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 49.3 m -52.93 -45.55 67.7 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 120.867 -1.146 . . . . 0.0 110.072 179.451 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.15 -44.04 40.08 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 178.475 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.74 -30.3 65.46 Favored 'General case' 0 N--CA 1.497 1.924 0 CA-C-O 121.378 0.609 . . . . 0.0 110.034 179.272 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.422 ' N ' ' O ' ' A' ' 38' ' ' ASP . 2.7 tptt -88.19 -3.02 58.93 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.636 -0.665 . . . . 0.0 110.964 -179.583 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.9 mt -90.17 -42.79 10.85 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.261 -0.9 . . . . 0.0 109.064 179.322 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -70.7 -32.24 67.25 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 108.762 -1.735 . . . . 0.0 108.762 179.264 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -58.58 -54.28 48.84 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.65 -0.912 . . . . 0.0 109.835 179.522 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 58.4 mtt -65.86 -54.59 24.69 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.643 -0.661 . . . . 0.0 109.438 179.206 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 68.2 t-105 -51.21 -56.45 12.78 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.605 -0.684 . . . . 0.0 110.787 -179.858 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 35.1 t -61.41 -34.34 75.2 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.436 -0.79 . . . . 0.0 110.252 -179.972 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -61.71 -39.84 92.92 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.578 -0.701 . . . . 0.0 110.114 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 31.4 mm-40 -57.97 155.69 10.38 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.62 -0.675 . . . . 0.0 110.614 -179.906 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.0 t -92.75 -149.58 0.26 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.69 -0.631 . . . . 0.0 109.41 179.527 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.04 50.33 1.99 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.211 -0.931 . . . . 0.0 110.312 179.726 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.59 -42.91 1.28 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.445 -0.784 . . . . 0.0 110.044 179.944 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -60.08 -29.79 68.8 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.454 -0.779 . . . . 0.0 110.584 -179.671 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 44.2 tttt -95.3 22.7 6.55 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.283 -0.886 . . . . 0.0 111.214 -179.368 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.405 ' CB ' ' CD ' ' A' ' 57' ' ' PRO . 10.0 mp0 -100.36 -61.09 0.1 OUTLIER Pre-proline 0 N--CA 1.497 1.876 0 O-C-N 121.349 -0.844 . . . . 0.0 111.047 179.683 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.405 ' CD ' ' CB ' ' A' ' 56' ' ' GLN . 55.5 Cg_endo -76.96 -36.76 1.33 Allowed 'Trans proline' 0 N--CA 1.485 0.987 0 O-C-N 122.618 0.799 . . . . 0.0 110.7 179.884 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -79.79 3.6 19.02 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.407 -0.808 . . . . 0.0 111.916 -178.929 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -98.31 -18.86 18.12 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.075 -1.016 . . . . 0.0 110.882 179.983 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -77.64 -24.39 49.5 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.286 -0.884 . . . . 0.0 110.363 179.817 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 55.0 tttt -59.82 -40.02 87.04 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.462 -0.774 . . . . 0.0 109.718 179.456 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.42 -10.71 59.2 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.626 -0.671 . . . . 0.0 110.537 179.312 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.85 6.78 33.78 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.163 -0.961 . . . . 0.0 110.439 179.218 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 38.1 mmtt -105.78 -35.04 7.48 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.255 -0.903 . . . . 0.0 109.078 178.86 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.1 mp -78.38 -0.0 27.38 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.936 -0.478 . . . . 0.0 110.888 179.44 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 59.5 tttt -89.3 -26.16 21.28 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.168 -0.958 . . . . 0.0 109.805 179.292 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -83.27 -15.77 48.96 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.573 -0.704 . . . . 0.0 110.478 179.425 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 32.8 mtpt -101.48 -27.17 13.27 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.307 -0.87 . . . . 0.0 109.992 179.688 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -77.68 -51.47 10.55 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.557 -0.714 . . . . 0.0 109.642 179.627 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -70.51 -6.82 38.95 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.685 -0.634 . . . . 0.0 111.589 -179.632 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 47.8 mttt -110.66 -33.9 6.43 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.077 -1.014 . . . . 0.0 110.174 179.868 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -87.34 -29.88 21.23 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.556 -0.715 . . . . 0.0 110.833 -179.47 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.2 tp . . . . . 0 N--CA 1.498 1.927 0 O-C-N 121.401 -0.812 . . . . 0.0 110.436 -179.69 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo . . . . . 0 N--CA 1.484 0.939 0 N-CA-C 110.628 -0.566 . . . . 0.0 110.628 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.56 -163.08 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.803 -0.56 . . . . 0.0 110.302 -179.821 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 7.1 mpt_? -55.22 154.62 10.62 Favored Pre-proline 0 N--CA 1.5 2.045 0 O-C-N 121.37 -0.831 . . . . 0.0 110.768 -179.889 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -73.74 121.9 7.38 Favored 'Trans proline' 0 C--N 1.317 -1.122 0 O-C-N 123.541 1.285 . . . . 0.0 110.01 179.795 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -82.23 162.48 17.62 Favored 'Trans proline' 0 C--N 1.317 -1.099 0 O-C-N 123.208 1.11 . . . . 0.0 110.353 -179.614 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -162.75 65.76 0.21 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.554 -0.716 . . . . 0.0 110.223 -179.758 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 66.83 -76.58 0.05 OUTLIER 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.171 -0.956 . . . . 0.0 109.926 -179.35 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.439 ' CD1' ' CD1' ' A' ' 47' ' ' TRP . 11.7 t80 -51.64 -42.16 61.85 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.206 -0.934 . . . . 0.0 110.807 179.878 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -65.16 -26.34 68.13 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 120.085 -0.646 . . . . 0.0 109.824 179.716 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.9 mt -84.03 -39.2 19.92 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.5 -0.75 . . . . 0.0 110.064 -179.736 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -67.16 -49.77 63.56 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.557 -0.715 . . . . 0.0 110.223 -179.862 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 9.0 t -67.2 -28.29 67.96 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.62 -0.675 . . . . 0.0 109.964 179.561 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 42.0 t -87.57 4.23 44.46 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.491 -0.756 . . . . 0.0 111.632 -179.415 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 50.8 mm-40 -141.51 2.58 1.64 Allowed 'General case' 0 N--CA 1.499 1.997 0 O-C-N 120.974 -1.079 . . . . 0.0 112.367 -179.568 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 33.9 m-85 -122.27 22.2 10.17 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 120.826 -1.171 . . . . 0.0 111.129 -179.671 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.463 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 15.3 mtp180 -87.82 -45.49 0.49 Allowed Pre-proline 0 N--CA 1.489 1.49 0 O-C-N 121.361 -0.837 . . . . 0.0 112.403 179.815 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.5 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.4 Cg_endo -66.83 -14.68 44.71 Favored 'Trans proline' 0 N--CA 1.492 1.393 0 O-C-N 122.917 0.956 . . . . 0.0 110.686 -179.035 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -74.25 -52.58 11.92 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 177.837 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 30.2 mm -52.46 -31.26 15.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 CA-C-O 121.297 0.57 . . . . 0.0 110.454 179.649 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.5 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.9 mmmm -72.54 -33.45 66.84 Favored 'General case' 0 N--CA 1.496 1.855 0 C-N-CA 120.123 -0.631 . . . . 0.0 110.176 -177.303 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.7 t -62.03 -25.98 67.98 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.589 -0.694 . . . . 0.0 110.508 -179.922 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -115.7 -24.55 8.19 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.551 -0.718 . . . . 0.0 110.79 -179.669 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -119.3 96.75 50.13 Favored Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.476 -0.765 . . . . 0.0 109.543 -179.889 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -75.33 -28.79 8.36 Favored 'Trans proline' 0 C--N 1.313 -1.293 0 O-C-N 123.444 1.234 . . . . 0.0 110.49 -179.813 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -83.88 -13.94 73.81 Favored Glycine 0 N--CA 1.488 2.129 0 N-CA-C 110.506 -1.037 . . . . 0.0 110.506 -179.947 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.71 79.56 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.413 -1.051 . . . . 0.0 111.273 -179.333 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.404 ' N ' ' O ' ' A' ' 33' ' ' GLY . 79.5 p -69.48 174.79 4.55 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.394 -0.816 . . . . 0.0 109.581 179.847 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 40.3 mm -54.33 -29.9 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 O-C-N 121.308 -0.87 . . . . 0.0 110.15 179.895 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.7 -65.91 3.1 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 179.906 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -69.83 -29.72 67.05 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.622 -0.928 . . . . 0.0 110.757 179.857 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 73.7 m -64.65 -31.0 72.02 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.393 -0.817 . . . . 0.0 110.133 179.707 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.38 -43.78 48.41 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.584 -0.698 . . . . 0.0 110.158 -179.983 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.23 -12.06 47.87 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.596 -0.69 . . . . 0.0 111.822 -179.403 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.4 tptt -77.59 -59.64 2.7 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.987 -1.071 . . . . 0.0 109.797 179.529 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 43.8 mt -48.95 -26.08 2.3 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.413 -0.805 . . . . 0.0 111.336 -179.729 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.1 -37.87 82.79 Favored Glycine 0 N--CA 1.492 2.425 0 N-CA-C 109.277 -1.529 . . . . 0.0 109.277 179.673 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -50.9 -35.04 30.94 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.462 -1.022 . . . . 0.0 110.919 -179.839 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 22.8 mmt -81.84 -42.85 19.05 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.66 -0.65 . . . . 0.0 109.591 179.587 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . 0.439 ' CD1' ' CD1' ' A' ' 16' ' ' PHE . 45.4 t-105 -51.86 -52.66 47.93 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.526 -0.734 . . . . 0.0 110.788 -179.862 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.9 t -68.17 -32.1 72.11 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.381 -0.824 . . . . 0.0 110.506 -179.572 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -58.68 -38.84 79.1 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.516 -0.74 . . . . 0.0 110.252 -179.86 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -73.63 172.09 12.04 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.514 -0.741 . . . . 0.0 109.944 179.668 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 88.6 p -164.17 110.86 1.07 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.486 -0.758 . . . . 0.0 110.507 -179.918 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 51.6 35.34 14.49 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.429 -0.794 . . . . 0.0 111.054 179.611 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 70.8 mttt -135.39 -73.51 0.46 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.547 -0.721 . . . . 0.0 110.302 179.961 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -66.87 -20.67 65.96 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.511 -0.743 . . . . 0.0 110.687 -179.937 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.415 ' HG2' ' CH2' ' A' ' 47' ' ' TRP . 50.3 mttt -82.99 -35.27 26.0 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.368 -0.833 . . . . 0.0 110.678 -179.763 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -45.78 -51.55 29.26 Favored Pre-proline 0 N--CA 1.507 2.395 0 O-C-N 121.569 -0.707 . . . . 0.0 111.759 -179.176 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -79.09 -39.29 0.35 Allowed 'Trans proline' 0 C--N 1.314 -1.239 0 O-C-N 123.186 1.098 . . . . 0.0 110.747 179.889 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -81.51 4.68 20.38 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.605 -0.684 . . . . 0.0 112.104 -178.657 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.84 -20.35 17.56 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 120.996 -1.065 . . . . 0.0 110.358 179.387 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -77.72 -26.35 49.97 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.442 -0.786 . . . . 0.0 110.085 179.598 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 50.4 tttt -61.89 -40.38 95.24 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.571 -0.706 . . . . 0.0 110.092 179.855 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -79.34 -14.0 59.27 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.482 -0.761 . . . . 0.0 110.539 179.606 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -81.16 0.34 36.84 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.313 -0.867 . . . . 0.0 110.299 179.159 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 24.0 mmtp -105.72 -29.81 9.84 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.164 -0.96 . . . . 0.0 109.93 179.4 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.9 mp -87.15 -2.47 58.65 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.882 -0.511 . . . . 0.0 110.361 178.834 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.5 tptt -83.98 -35.64 23.79 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.299 -0.876 . . . . 0.0 108.771 178.916 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -66.95 -59.57 3.38 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 119.939 -0.704 . . . . 0.0 109.324 179.323 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -58.85 -20.3 49.56 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.607 -0.683 . . . . 0.0 111.02 -179.888 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -77.5 -61.25 2.05 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.158 -0.964 . . . . 0.0 109.579 179.471 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -64.2 -12.49 41.03 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.613 -0.679 . . . . 0.0 111.334 -179.955 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.1 mmtm -102.49 -29.31 11.67 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.131 -0.981 . . . . 0.0 110.516 -179.949 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -99.78 -26.96 13.87 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.528 -0.732 . . . . 0.0 110.95 -179.612 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.3 tp . . . . . 0 N--CA 1.497 1.886 0 O-C-N 121.276 -0.89 . . . . 0.0 109.907 179.891 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo . . . . . 0 N--CA 1.481 0.776 0 N-CA-C 110.123 -0.761 . . . . 0.0 110.123 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.35 -166.43 0.09 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.616 -0.678 . . . . 0.0 110.326 -179.706 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -58.37 146.34 72.06 Favored Pre-proline 0 N--CA 1.497 1.883 0 O-C-N 121.551 -0.718 . . . . 0.0 110.408 -179.92 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -74.35 125.3 9.57 Favored 'Trans proline' 0 C--N 1.317 -1.113 0 O-C-N 123.433 1.228 . . . . 0.0 110.009 179.783 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -82.21 174.81 9.67 Favored 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.232 1.122 . . . . 0.0 110.181 -179.731 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -169.59 69.07 0.06 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.556 -0.715 . . . . 0.0 110.495 -179.956 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 67.11 -77.64 0.04 OUTLIER 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.045 -1.035 . . . . 0.0 110.574 -179.794 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -47.79 -47.87 30.69 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.237 -0.914 . . . . 0.0 111.508 -179.34 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -61.83 -29.92 70.49 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.621 -0.674 . . . . 0.0 109.87 179.812 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 18.2 mt -83.16 -29.9 28.26 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.479 -0.763 . . . . 0.0 109.989 -179.82 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.498 ' CE2' ' CE1' ' A' ' 23' ' ' TYR . 55.8 t80 -77.56 -54.58 6.24 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.542 -0.724 . . . . 0.0 110.481 -179.463 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.7 t -58.43 -50.93 71.93 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.535 -0.728 . . . . 0.0 110.646 -179.704 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.1 t -58.23 -21.67 48.95 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.518 -0.739 . . . . 0.0 110.916 -179.798 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -101.63 -23.63 14.23 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.343 -0.848 . . . . 0.0 111.003 -179.662 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.498 ' CE1' ' CE2' ' A' ' 19' ' ' PHE . 2.4 m-85 -86.7 -33.87 19.9 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.479 -0.763 . . . . 0.0 110.681 -179.61 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.509 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 4.4 mtt-85 -48.35 -52.23 44.46 Favored Pre-proline 0 N--CA 1.498 1.93 0 O-C-N 121.318 -0.864 . . . . 0.0 111.85 179.903 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.509 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 36.2 Cg_endo -60.28 -27.9 85.8 Favored 'Trans proline' 0 N--CA 1.492 1.431 0 O-C-N 123.218 1.115 . . . . 0.0 109.933 179.797 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.8 tmtm? -69.64 -46.64 65.73 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 177.872 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 44.5 mm -56.42 -31.2 32.76 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.032 179.711 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.533 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 4.7 mmmm -72.95 -37.58 67.07 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 120.079 -0.649 . . . . 0.0 110.449 -177.552 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.4 t -60.56 -24.43 65.4 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.501 -0.749 . . . . 0.0 110.649 -179.633 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -117.62 -17.03 10.04 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.49 -0.756 . . . . 0.0 111.158 -179.625 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 39.8 m80 -127.77 95.15 35.54 Favored Pre-proline 0 N--CA 1.496 1.865 0 O-C-N 121.297 -0.877 . . . . 0.0 109.528 179.736 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -75.1 -36.14 2.66 Favored 'Trans proline' 0 C--N 1.315 -1.197 0 O-C-N 123.54 1.284 . . . . 0.0 110.307 -179.736 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.402 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -75.58 -18.46 79.77 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 179.771 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.79 88.14 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.465 -1.021 . . . . 0.0 111.375 -179.507 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.402 ' N ' ' O ' ' A' ' 33' ' ' GLY . 45.2 t -70.88 175.91 4.7 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.517 -0.739 . . . . 0.0 109.741 179.722 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.1 mp -59.64 -34.23 54.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.306 -0.871 . . . . 0.0 109.513 179.953 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.13 -58.83 12.53 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 109.104 -1.598 . . . . 0.0 109.104 179.63 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.432 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 6.5 t70 -70.21 -37.76 75.13 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.742 -0.858 . . . . 0.0 110.063 179.107 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.9 m -61.78 -31.08 71.26 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.159 -0.963 . . . . 0.0 110.107 179.268 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.94 -43.03 46.84 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.568 -0.708 . . . . 0.0 110.398 -179.845 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.3 ptpt -89.44 -12.97 38.69 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.595 -0.691 . . . . 0.0 111.979 -178.925 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -88.98 5.7 42.98 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 120.892 -1.13 . . . . 0.0 110.602 179.721 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 91.0 mt -107.92 -31.23 8.08 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.133 -0.979 . . . . 0.0 109.546 179.486 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.56 -31.9 82.34 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -61.76 -53.84 50.51 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.564 -0.963 . . . . 0.0 109.895 179.918 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 23.6 mtt -64.19 -23.55 67.36 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.589 -0.694 . . . . 0.0 110.345 179.803 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 77.0 t-105 -78.08 -38.92 43.12 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.46 -0.775 . . . . 0.0 110.121 179.794 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.9 m -80.14 -25.07 40.01 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.514 -0.741 . . . . 0.0 110.58 -179.899 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -70.21 -43.86 69.8 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.42 -0.8 . . . . 0.0 109.774 179.72 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 16.3 mm-40 -56.27 154.39 8.14 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.514 -0.742 . . . . 0.0 110.579 -179.92 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.4 m -93.52 -149.76 0.27 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.653 -0.654 . . . . 0.0 109.571 179.698 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -92.26 41.81 1.08 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.262 -0.899 . . . . 0.0 110.259 179.685 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -119.46 -49.06 2.38 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.529 -0.732 . . . . 0.0 110.109 179.899 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -61.62 -27.5 68.7 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.584 -0.698 . . . . 0.0 110.533 -179.831 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.8 ttpt -82.92 -34.38 26.61 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.434 -0.791 . . . . 0.0 110.638 -179.747 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -43.33 -53.09 11.84 Favored Pre-proline 0 N--CA 1.507 2.407 0 O-C-N 121.472 -0.768 . . . . 0.0 112.317 -178.861 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -79.12 -36.44 0.71 Allowed 'Trans proline' 0 C--N 1.315 -1.19 0 O-C-N 123.14 1.074 . . . . 0.0 111.273 179.999 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -85.21 0.02 53.16 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.454 -0.779 . . . . 0.0 112.319 -178.065 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.84 -25.41 15.04 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 120.938 -1.101 . . . . 0.0 110.699 -179.384 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -73.99 -21.56 59.95 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.468 -0.77 . . . . 0.0 110.644 179.94 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -60.32 -43.11 96.67 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.49 -0.756 . . . . 0.0 110.233 179.877 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.23 -12.32 59.93 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.4 -0.813 . . . . 0.0 110.131 179.153 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.38 -38.99 78.42 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.244 -0.91 . . . . 0.0 109.229 179.223 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.6 ttpt -67.52 -61.47 1.88 Allowed 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 178.513 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -44.74 -23.63 0.14 Allowed 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.798 -0.564 . . . . 0.0 112.328 -179.582 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 58.9 tttt -71.89 -44.43 63.76 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.256 -0.902 . . . . 0.0 108.658 178.241 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -82.26 -9.93 59.31 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.738 -0.601 . . . . 0.0 110.058 178.597 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.94 -32.56 11.6 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.309 -0.869 . . . . 0.0 109.153 179.267 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 58.8 t80 -77.28 -51.13 11.42 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.131 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -70.91 -8.31 51.99 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.606 -0.684 . . . . 0.0 111.113 179.837 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.7 ttmm -108.87 -34.35 6.67 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.063 -1.023 . . . . 0.0 110.596 -179.907 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -82.24 -31.11 30.36 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.466 -0.772 . . . . 0.0 110.502 -179.853 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.4 tp . . . . . 0 N--CA 1.496 1.863 0 O-C-N 121.517 -0.739 . . . . 0.0 110.447 179.964 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo . . . . . 0 N--CA 1.486 1.033 0 N-CA-C 110.722 -0.53 . . . . 0.0 110.722 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.7 pttt -59.47 -160.38 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.644 -0.66 . . . . 0.0 110.452 -179.724 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -57.05 149.35 45.96 Favored Pre-proline 0 N--CA 1.499 1.995 0 O-C-N 121.282 -0.886 . . . . 0.0 110.786 -179.884 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.419 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.6 Cg_endo -76.41 124.37 7.68 Favored 'Trans proline' 0 C--N 1.317 -1.114 0 O-C-N 123.455 1.24 . . . . 0.0 109.651 179.31 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -81.2 177.08 8.17 Favored 'Trans proline' 0 C--N 1.316 -1.139 0 O-C-N 123.261 1.137 . . . . 0.0 110.158 -179.644 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.9 t -167.77 60.13 0.07 Allowed 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.458 -0.776 . . . . 0.0 110.684 -179.766 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 70.14 -74.79 0.08 Allowed 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.199 -0.938 . . . . 0.0 110.1 -179.469 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -48.76 -50.42 33.97 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.347 -0.846 . . . . 0.0 111.241 -179.643 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -58.91 -40.96 86.11 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.593 -0.692 . . . . 0.0 109.477 179.431 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.413 ' HB3' ' CE2' ' A' ' 58' ' ' TYR . 53.2 mt -61.67 -46.61 89.01 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.681 -0.637 . . . . 0.0 109.884 179.732 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.499 ' CE2' ' CE2' ' A' ' 23' ' ' TYR . 23.6 t80 -65.88 -50.43 64.56 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.715 -0.616 . . . . 0.0 110.252 -179.891 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.3 m -65.71 -29.1 69.59 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.673 -0.642 . . . . 0.0 110.057 179.981 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.7 m -67.85 -23.68 65.18 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.559 -0.713 . . . . 0.0 110.75 -179.749 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -110.2 -27.76 8.97 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.38 -0.825 . . . . 0.0 111.42 -179.104 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.499 ' CE2' ' CE2' ' A' ' 19' ' ' PHE . 7.2 m-85 -81.6 -37.23 27.96 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.18 -0.95 . . . . 0.0 110.849 -179.238 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.512 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 11.2 mtt85 -48.76 -51.75 51.27 Favored Pre-proline 0 N--CA 1.495 1.802 0 O-C-N 121.305 -0.872 . . . . 0.0 111.823 -179.974 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.512 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 36.0 Cg_endo -59.71 -27.62 85.39 Favored 'Trans proline' 0 N--CA 1.492 1.421 0 O-C-N 123.137 1.072 . . . . 0.0 109.821 179.455 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.88 -48.09 48.23 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 177.349 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.416 HG23 ' CG ' ' A' ' 31' ' ' HIS . 41.6 mm -54.71 -33.02 26.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.479 179.826 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.545 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 0.3 OUTLIER -68.23 -31.26 70.63 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.569 -0.707 . . . . 0.0 110.399 -177.579 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.9 t -82.11 -17.86 45.02 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.505 -0.747 . . . . 0.0 111.195 -179.853 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -114.72 -15.94 11.85 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.179 -0.951 . . . . 0.0 111.362 -179.485 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.542 ' HB3' ' CB ' ' A' ' 34' ' ' LEU . 25.0 m80 -117.26 91.92 38.43 Favored Pre-proline 0 N--CA 1.499 1.977 0 O-C-N 121.27 -0.894 . . . . 0.0 109.634 -179.702 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -77.43 -71.74 0.01 OUTLIER 'Trans proline' 0 N--CA 1.484 0.969 0 O-C-N 123.378 1.199 . . . . 0.0 111.689 -179.199 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -56.26 -21.93 34.89 Favored Glycine 0 N--CA 1.499 2.867 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 -179.752 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.542 ' CB ' ' HB3' ' A' ' 31' ' ' HIS . 7.8 tt -53.41 92.85 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.48 -1.012 . . . . 0.0 110.845 179.506 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 18.8 m -57.7 175.53 0.18 Allowed 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.461 -0.774 . . . . 0.0 110.116 -179.386 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 14.7 mm -56.19 -61.32 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 O-C-N 121.351 -0.843 . . . . 0.0 110.312 -179.897 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.424 ' O ' ' HE2' ' A' ' 41' ' ' LYS . . . -48.59 -38.19 21.15 Favored Glycine 0 N--CA 1.497 2.701 0 N-CA-C 110.319 -1.112 . . . . 0.0 110.319 -179.12 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.4 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 33.4 m-20 -65.39 -36.5 84.15 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.558 -0.966 . . . . 0.0 109.737 178.755 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.95 -36.43 79.36 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.571 -0.705 . . . . 0.0 110.678 179.743 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.98 -49.64 17.12 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.526 -0.734 . . . . 0.0 110.242 -179.713 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.424 ' HE2' ' O ' ' A' ' 37' ' ' GLY . 0.9 OUTLIER -74.71 -13.41 60.61 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.602 -0.686 . . . . 0.0 111.294 -179.621 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.4 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 5.4 tptt -84.63 -59.73 2.28 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 120.933 -1.104 . . . . 0.0 109.836 179.339 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 16.3 mt -49.15 -29.25 5.17 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.541 -0.724 . . . . 0.0 111.043 -179.819 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.27 -38.58 96.69 Favored Glycine 0 N--CA 1.493 2.444 0 N-CA-C 109.425 -1.47 . . . . 0.0 109.425 179.934 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -50.56 -33.89 23.57 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.445 -1.032 . . . . 0.0 111.041 -179.708 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 31.9 mtt -86.69 -41.31 14.29 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.536 -0.728 . . . . 0.0 110.495 -179.793 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 72.3 t-105 -55.55 -21.21 16.05 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.502 -0.749 . . . . 0.0 111.136 -179.421 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.6 t -93.01 -33.46 14.12 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.324 -0.86 . . . . 0.0 110.239 -179.979 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -63.27 -36.32 83.28 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.637 -0.665 . . . . 0.0 110.067 179.891 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -62.56 150.68 39.82 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.587 -0.696 . . . . 0.0 110.201 179.949 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 83.9 p -98.22 -152.08 0.39 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.611 -0.681 . . . . 0.0 109.588 179.677 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -82.58 56.57 3.38 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.305 -0.872 . . . . 0.0 110.053 179.794 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -134.98 -46.03 0.72 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.444 -0.785 . . . . 0.0 110.198 179.932 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -63.72 -31.14 72.22 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.545 -0.722 . . . . 0.0 110.457 -179.708 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 19.8 ttpt -99.09 22.75 9.92 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.46 -0.775 . . . . 0.0 110.824 -179.73 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.436 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 4.9 mt-30 -93.44 -59.79 0.2 Allowed Pre-proline 0 N--CA 1.495 1.807 0 O-C-N 121.146 -0.971 . . . . 0.0 110.787 -179.659 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.436 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.5 Cg_endo -79.28 -27.3 4.44 Favored 'Trans proline' 0 N--CA 1.486 1.071 0 O-C-N 122.953 0.975 . . . . 0.0 111.468 -179.58 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . 0.413 ' CE2' ' HB3' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -84.48 -21.12 30.74 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.354 -0.841 . . . . 0.0 111.914 -178.163 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.61 -27.08 64.77 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.245 -0.909 . . . . 0.0 111.033 -179.287 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -78.14 -20.03 52.87 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.42 -0.8 . . . . 0.0 110.508 179.923 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 58.1 tttt -64.05 -46.38 84.63 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.462 -0.773 . . . . 0.0 109.803 179.717 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.5 -13.14 59.99 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.555 -0.715 . . . . 0.0 110.532 179.578 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -78.21 -3.0 40.49 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.325 -0.86 . . . . 0.0 110.081 178.832 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 26.2 mmtm -105.25 -25.31 12.49 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.108 -0.995 . . . . 0.0 110.068 179.507 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.2 mp -88.8 -16.21 32.66 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.749 -0.595 . . . . 0.0 109.926 178.704 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.5 tptt -74.7 -35.89 62.72 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.46 -0.775 . . . . 0.0 109.482 179.397 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -67.2 -57.48 6.65 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.686 -0.634 . . . . 0.0 109.829 179.776 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -58.28 -26.72 63.32 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.601 -0.687 . . . . 0.0 110.593 -179.955 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.419 ' CE2' ' HD3' ' A' ' 12' ' ' PRO . 37.0 t80 -73.63 -68.25 0.52 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.473 -0.767 . . . . 0.0 109.445 179.503 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -55.34 -21.15 13.95 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.798 -0.564 . . . . 0.0 111.211 -179.772 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -95.46 -19.1 20.14 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.423 -0.798 . . . . 0.0 111.316 -179.485 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -109.73 -31.93 7.27 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.242 -0.911 . . . . 0.0 110.907 -179.537 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.5 tp . . . . . 0 N--CA 1.495 1.823 0 C-N-CA 119.822 -0.751 . . . . 0.0 110.024 -179.733 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo . . . . . 0 N--CA 1.485 1.0 0 N-CA-C 110.517 -0.609 . . . . 0.0 110.517 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.7 pttt -67.97 -160.17 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.541 -0.725 . . . . 0.0 109.751 179.815 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -60.44 141.03 91.86 Favored Pre-proline 0 N--CA 1.497 1.898 0 O-C-N 121.359 -0.838 . . . . 0.0 109.88 179.769 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.408 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 46.8 Cg_endo -73.77 129.87 14.0 Favored 'Trans proline' 0 C--N 1.317 -1.094 0 O-C-N 123.248 1.131 . . . . 0.0 110.193 -179.897 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -81.26 -179.59 5.13 Favored 'Trans proline' 0 C--N 1.318 -1.051 0 O-C-N 123.271 1.143 . . . . 0.0 110.08 -179.94 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.2 t -170.01 62.51 0.05 OUTLIER 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.505 -0.747 . . . . 0.0 110.828 -179.928 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 70.88 -75.98 0.07 Allowed 'General case' 0 N--CA 1.505 2.308 0 O-C-N 121.043 -1.035 . . . . 0.0 110.504 -179.601 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -50.78 -45.83 59.31 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.23 -0.919 . . . . 0.0 110.952 -179.823 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -61.45 -34.35 75.27 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 120.183 -0.607 . . . . 0.0 109.71 179.622 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 29.8 mt -76.44 -40.16 51.38 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.486 -0.759 . . . . 0.0 110.404 -179.539 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.494 ' CE2' ' CZ ' ' A' ' 23' ' ' TYR . 32.0 t80 -66.45 -51.18 59.61 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.554 -0.716 . . . . 0.0 110.586 -179.43 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 2.2 t -65.7 -28.94 69.44 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.453 -0.78 . . . . 0.0 110.051 179.707 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.9 m -70.06 -15.87 63.06 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.647 -0.658 . . . . 0.0 111.54 -179.273 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -125.65 -25.72 3.64 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.068 -1.02 . . . . 0.0 112.133 -179.116 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.494 ' CZ ' ' CE2' ' A' ' 19' ' ' PHE . 10.6 m-85 -76.95 -38.47 53.25 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.165 -0.959 . . . . 0.0 110.798 -179.448 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.471 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 2.1 mtt180 -48.08 -53.33 33.86 Favored Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 121.359 -0.838 . . . . 0.0 112.415 -179.527 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.471 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 36.2 Cg_endo -59.61 -27.66 85.49 Favored 'Trans proline' 0 N--CA 1.494 1.517 0 O-C-N 123.221 1.116 . . . . 0.0 110.185 -179.624 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.0 tmtm? -70.46 -46.78 63.16 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 177.542 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 46.1 mm -57.71 -21.68 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.632 179.724 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.527 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 4.9 mmmm -81.06 -26.96 35.91 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.141 -0.974 . . . . 0.0 110.426 -177.573 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.8 t -86.28 -3.23 58.94 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.482 -0.761 . . . . 0.0 111.119 179.627 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -132.51 -2.01 3.45 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.062 -1.024 . . . . 0.0 112.018 -179.464 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.533 ' HB3' ' CB ' ' A' ' 34' ' ' LEU . 54.4 m80 -126.33 95.65 38.15 Favored Pre-proline 0 N--CA 1.499 2.015 0 O-C-N 120.915 -1.116 . . . . 0.0 109.779 179.924 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -78.34 -75.41 0.01 OUTLIER 'Trans proline' 0 N--CA 1.485 0.979 0 O-C-N 123.43 1.226 . . . . 0.0 111.708 -179.301 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -51.35 -28.71 20.91 Favored Glycine 0 N--CA 1.503 3.113 0 N-CA-C 110.343 -1.103 . . . . 0.0 110.343 -179.483 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.533 ' CB ' ' HB3' ' A' ' 31' ' ' HIS . 7.8 tt -46.59 96.04 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.792 -0.828 . . . . 0.0 111.455 179.844 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 44.8 m -66.52 178.3 1.3 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.675 -0.64 . . . . 0.0 109.863 -179.77 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 13.8 mm -58.72 -61.44 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.053 0 O-C-N 121.46 -0.775 . . . . 0.0 110.201 179.908 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.435 ' O ' ' HE2' ' A' ' 41' ' ' LYS . . . -46.9 -38.34 10.18 Favored Glycine 0 N--CA 1.498 2.777 0 N-CA-C 110.617 -0.993 . . . . 0.0 110.617 -178.806 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.443 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 1.6 m-20 -68.57 -33.44 74.09 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.585 -0.95 . . . . 0.0 110.055 178.917 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.34 -38.63 85.14 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.333 -0.854 . . . . 0.0 110.776 179.69 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.2 -38.36 78.58 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.65 -0.656 . . . . 0.0 110.121 -179.226 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.435 ' HE2' ' O ' ' A' ' 37' ' ' GLY . 1.2 ptpm? -89.72 -13.8 36.06 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 119.988 -0.685 . . . . 0.0 111.167 -179.69 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.443 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 3.4 tptt -87.66 -9.33 54.5 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.006 -1.058 . . . . 0.0 110.556 179.015 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 22.4 mt -95.11 -32.82 12.91 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.39 -0.819 . . . . 0.0 109.287 179.362 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.91 -35.42 72.36 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 108.605 -1.798 . . . . 0.0 108.605 179.178 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -57.13 -39.26 74.8 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.633 -0.922 . . . . 0.0 110.363 179.881 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 30.5 mtt -77.69 -48.69 16.12 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.54 -0.725 . . . . 0.0 110.355 179.991 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 68.8 t-105 -58.3 -25.46 61.87 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.539 -0.726 . . . . 0.0 110.659 -179.712 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 62.5 p -85.9 -37.26 19.3 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.394 -0.816 . . . . 0.0 110.054 179.963 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -63.92 -31.95 73.31 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.523 -0.736 . . . . 0.0 109.967 179.873 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 89.4 mm-40 -62.28 148.73 44.06 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.58 -0.7 . . . . 0.0 110.134 179.889 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.8 m -101.41 -153.01 0.44 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.58 -0.7 . . . . 0.0 109.621 179.724 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -82.52 56.34 3.27 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.344 -0.847 . . . . 0.0 110.119 179.753 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 17.6 tptt -132.25 -49.29 0.93 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.449 -0.782 . . . . 0.0 110.133 -179.994 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -66.8 -35.7 80.68 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.57 -0.706 . . . . 0.0 110.46 -179.948 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.419 ' O ' ' N ' ' A' ' 59' ' ' GLU . 17.6 tttt -71.59 -37.78 70.96 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.552 -0.718 . . . . 0.0 110.864 -179.669 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.0 mm-40 -43.53 -57.19 5.9 Favored Pre-proline 0 N--CA 1.507 2.406 0 O-C-N 121.318 -0.864 . . . . 0.0 112.751 -178.674 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -77.19 -36.21 1.44 Allowed 'Trans proline' 0 N--CA 1.489 1.255 0 O-C-N 123.071 1.037 . . . . 0.0 111.903 -179.52 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -83.46 -12.28 56.53 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.352 -0.843 . . . . 0.0 112.561 -177.645 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.419 ' N ' ' O ' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -82.72 -27.47 31.13 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.033 -1.042 . . . . 0.0 111.112 -179.165 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -74.01 -20.04 60.45 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.343 -0.848 . . . . 0.0 110.751 -179.987 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 43.5 tttm -65.8 -42.08 91.11 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.286 -0.883 . . . . 0.0 109.962 179.796 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -81.34 -16.79 51.29 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.599 -0.688 . . . . 0.0 110.224 179.385 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.27 -36.86 78.77 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.343 -0.848 . . . . 0.0 110.306 179.89 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -70.82 -62.34 1.43 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.239 -0.913 . . . . 0.0 110.003 179.858 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.7 mp -46.88 -24.15 0.55 Allowed 'General case' 0 N--CA 1.505 2.291 0 O-C-N 121.555 -0.716 . . . . 0.0 112.157 -179.453 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.8 tptm -68.23 -48.14 65.95 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.299 -0.876 . . . . 0.0 109.506 179.189 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -65.0 -55.49 18.7 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.735 -0.603 . . . . 0.0 109.953 179.718 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 60.3 mttm -56.67 -26.89 57.56 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.467 -0.771 . . . . 0.0 110.481 179.888 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.408 ' CE2' ' HD3' ' A' ' 12' ' ' PRO . 50.1 t80 -75.91 -67.99 0.62 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.499 -0.751 . . . . 0.0 109.296 179.385 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -51.36 -24.34 4.66 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.662 -0.648 . . . . 0.0 111.478 -179.548 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 46.8 mttp -92.62 -62.53 1.38 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.439 -0.788 . . . . 0.0 110.917 -179.44 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -58.1 -31.04 66.74 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.609 -0.682 . . . . 0.0 111.135 -179.078 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.6 tp . . . . . 0 N--CA 1.497 1.882 0 O-C-N 121.342 -0.849 . . . . 0.0 110.457 -179.474 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.422 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 53.7 Cg_endo . . . . . 0 N--CA 1.484 0.928 0 CA-C-O 120.756 0.232 . . . . 0.0 112.123 . . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.5 mtpt -43.3 139.91 1.78 Allowed 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.396 -0.815 . . . . 0.0 112.872 -179.065 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.7 tpt180 49.79 99.82 0.04 OUTLIER Pre-proline 0 N--CA 1.497 1.923 0 O-C-N 121.795 -0.566 . . . . 0.0 112.156 178.911 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.421 ' HB3' ' CD2' ' A' ' 69' ' ' TYR . 47.1 Cg_endo -75.79 132.21 14.17 Favored 'Trans proline' 0 C--N 1.318 -1.028 0 O-C-N 123.248 1.131 . . . . 0.0 109.321 178.581 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -80.06 155.88 23.02 Favored 'Trans proline' 0 C--N 1.316 -1.152 0 O-C-N 123.161 1.085 . . . . 0.0 110.196 -179.576 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.6 t -158.73 51.43 0.39 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.515 -0.741 . . . . 0.0 110.961 -179.584 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 71.58 -73.83 0.09 Allowed 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.348 -0.845 . . . . 0.0 110.403 -179.518 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -46.71 -53.72 11.16 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.327 -0.858 . . . . 0.0 111.442 -179.561 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -55.61 -40.93 72.75 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.518 -0.739 . . . . 0.0 109.965 179.512 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.4 mt -62.09 -41.41 98.16 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.719 -0.613 . . . . 0.0 109.834 179.819 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -75.19 -53.89 8.05 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.592 -0.692 . . . . 0.0 110.232 -179.996 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 3.7 m -55.44 -55.96 25.7 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.435 -0.791 . . . . 0.0 110.434 -179.976 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 62.9 p -53.6 -29.92 39.97 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.467 -0.771 . . . . 0.0 110.521 179.994 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -88.56 -32.51 18.1 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.618 -0.677 . . . . 0.0 110.74 -179.781 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -94.63 13.61 23.7 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.451 -0.781 . . . . 0.0 111.513 -179.446 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.486 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 8.5 mtt180 -88.37 -42.92 0.47 Allowed Pre-proline 0 N--CA 1.488 1.434 0 O-C-N 121.192 -0.942 . . . . 0.0 112.367 179.471 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.509 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.1 Cg_endo -67.04 -16.95 50.68 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 O-C-N 122.711 0.848 . . . . 0.0 110.427 -179.203 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.41 -50.78 23.91 Favored 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 177.859 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 39.0 mm -52.93 -32.7 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 CA-C-O 121.49 0.662 . . . . 0.0 110.281 179.641 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.509 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.6 mmmm -72.37 -37.43 68.77 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.252 -177.215 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.0 t -59.91 -24.57 64.43 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.377 -0.827 . . . . 0.0 110.619 -179.699 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -116.37 -21.83 9.08 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.455 -0.778 . . . . 0.0 110.903 -179.609 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 43.7 m80 -121.71 96.32 47.34 Favored Pre-proline 0 N--CA 1.495 1.788 0 O-C-N 121.342 -0.849 . . . . 0.0 109.682 179.93 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -74.98 -33.27 4.74 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.366 1.193 . . . . 0.0 110.361 -179.817 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -79.48 -11.8 84.46 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 110.35 -1.1 . . . . 0.0 110.35 179.805 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.46 81.64 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.287 -1.125 . . . . 0.0 110.753 -179.668 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.1 t -74.89 177.9 5.94 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.425 -0.797 . . . . 0.0 109.721 179.721 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 37.3 mm -51.33 -37.25 18.21 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.207 0 O-C-N 121.234 -0.916 . . . . 0.0 110.586 -179.899 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -55.57 -68.94 1.43 Allowed Glycine 0 N--CA 1.494 2.502 0 N-CA-C 109.328 -1.509 . . . . 0.0 109.328 179.824 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.499 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 1.9 m-20 -66.19 -29.65 69.97 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.786 -0.832 . . . . 0.0 110.724 179.475 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 75.1 m -66.58 -29.26 69.27 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.164 -0.96 . . . . 0.0 110.291 179.648 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.11 -45.05 59.27 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.553 -0.717 . . . . 0.0 109.948 179.848 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -82.92 -17.72 42.66 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.668 -0.645 . . . . 0.0 112.213 -178.897 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.499 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -82.18 3.18 28.25 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 120.762 -1.211 . . . . 0.0 110.818 179.665 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 34.1 mt -105.79 -29.44 10.04 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.268 -0.895 . . . . 0.0 109.632 179.502 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.09 -37.8 82.85 Favored Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -179.79 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -50.16 -36.02 28.46 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.428 -1.043 . . . . 0.0 110.906 -179.644 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 64.2 mtm -87.27 -39.24 15.58 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.518 -0.739 . . . . 0.0 109.946 179.614 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 67.3 t-105 -55.56 -31.07 61.85 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.605 -0.684 . . . . 0.0 110.994 -179.643 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.2 t -87.35 -32.84 19.4 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.276 -0.89 . . . . 0.0 110.229 -179.802 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -63.66 -37.06 85.92 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.509 -0.744 . . . . 0.0 109.915 179.869 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.0 mm-40 -59.7 149.68 29.99 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.628 -0.67 . . . . 0.0 110.336 179.919 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 85.6 p -92.83 -152.15 0.31 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.688 -0.633 . . . . 0.0 109.613 179.679 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -83.67 55.55 3.27 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.313 -0.867 . . . . 0.0 110.151 179.82 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -135.95 -43.61 0.65 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.453 -0.779 . . . . 0.0 110.255 -179.936 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -62.49 -33.85 75.7 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.457 -0.777 . . . . 0.0 110.336 -179.904 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -96.87 22.35 8.41 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.442 -0.786 . . . . 0.0 111.092 -179.556 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.443 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 2.6 mm100 -92.19 -57.46 0.24 Allowed Pre-proline 0 N--CA 1.496 1.852 0 O-C-N 121.072 -1.017 . . . . 0.0 110.278 179.889 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.443 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 57.5 Cg_endo -82.96 -26.35 2.42 Favored 'Trans proline' 0 N--CA 1.484 0.945 0 O-C-N 122.929 0.963 . . . . 0.0 110.748 179.568 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -83.21 -18.54 38.92 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.456 -0.777 . . . . 0.0 111.955 -178.149 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.2 -26.14 52.48 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.175 -0.953 . . . . 0.0 110.944 -179.288 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -79.45 -21.31 45.64 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.501 -0.75 . . . . 0.0 110.648 179.947 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 62.2 tttt -65.9 -44.33 85.57 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.455 -0.778 . . . . 0.0 109.74 179.643 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -79.99 -15.13 57.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.581 -0.699 . . . . 0.0 110.161 179.174 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.08 -32.97 72.61 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.351 -0.843 . . . . 0.0 109.942 179.592 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -77.59 -63.9 1.27 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.579 -0.701 . . . . 0.0 109.73 179.45 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.0 mp -50.1 -25.68 3.72 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.48 -0.762 . . . . 0.0 111.114 -179.807 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -67.19 -49.95 62.74 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.523 -0.736 . . . . 0.0 109.373 179.307 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -61.98 -49.31 76.61 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.68 -0.637 . . . . 0.0 109.351 179.298 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 37.1 mttp -60.33 -27.37 67.3 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.719 -0.613 . . . . 0.0 110.067 179.444 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.422 ' CD2' ' HB2' ' A' ' 9' ' ' PRO . 19.8 t80 -74.2 -65.11 0.89 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.378 -0.826 . . . . 0.0 109.13 179.024 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -58.1 -25.5 61.42 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.784 -0.572 . . . . 0.0 111.115 -179.495 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.2 mmmt -91.83 -14.25 30.06 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.354 -0.841 . . . . 0.0 111.89 -179.102 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -111.84 -30.13 7.41 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.057 -1.027 . . . . 0.0 110.902 -179.624 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.5 tp . . . . . 0 N--CA 1.495 1.806 0 O-C-N 121.529 -0.732 . . . . 0.0 110.115 -179.787 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo . . . . . 0 N--CA 1.483 0.875 0 N-CA-C 110.499 -0.616 . . . . 0.0 110.499 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.3 pttt -70.82 -154.84 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.529 -0.732 . . . . 0.0 109.73 179.651 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.26 141.65 87.0 Favored Pre-proline 0 N--CA 1.498 1.956 0 O-C-N 121.374 -0.829 . . . . 0.0 109.806 179.661 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -74.1 133.39 17.97 Favored 'Trans proline' 0 C--N 1.318 -1.076 0 O-C-N 123.305 1.16 . . . . 0.0 110.321 -179.811 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -80.94 173.7 11.71 Favored 'Trans proline' 0 C--N 1.319 -1.004 0 O-C-N 123.299 1.157 . . . . 0.0 109.903 179.909 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 37.2 t -170.53 62.9 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.44 -0.787 . . . . 0.0 110.868 -179.899 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 69.7 -76.31 0.06 Allowed 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.041 -1.037 . . . . 0.0 110.452 -179.62 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -47.67 -50.22 25.36 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.267 -0.896 . . . . 0.0 111.267 -179.463 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -58.73 -35.78 73.25 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.67 -0.643 . . . . 0.0 110.108 179.785 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 24.1 mt -74.4 -35.01 63.43 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.501 -0.749 . . . . 0.0 110.228 -179.581 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . 0.502 ' CE2' ' CZ ' ' A' ' 23' ' ' TYR . 54.9 t80 -74.28 -54.2 8.17 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.599 -0.688 . . . . 0.0 110.626 -179.373 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.8 t -59.54 -48.77 80.36 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.583 -0.698 . . . . 0.0 110.489 -179.744 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.7 t -58.63 -26.05 63.32 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.509 -0.744 . . . . 0.0 110.671 -179.694 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -99.13 -22.03 15.87 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.519 -0.738 . . . . 0.0 111.212 -179.316 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.502 ' CZ ' ' CE2' ' A' ' 19' ' ' PHE . 7.1 m-85 -92.68 -36.38 12.98 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.389 -0.819 . . . . 0.0 110.829 -179.466 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.47 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 9.6 mtt180 -47.59 -53.56 29.34 Favored Pre-proline 0 N--CA 1.499 1.986 0 O-C-N 121.38 -0.825 . . . . 0.0 112.215 -179.55 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.47 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 36.8 Cg_endo -60.64 -26.93 83.93 Favored 'Trans proline' 0 N--CA 1.494 1.544 0 O-C-N 123.198 1.104 . . . . 0.0 110.021 179.997 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.06 -47.13 63.25 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 177.726 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.426 ' O ' ' HB2' ' A' ' 31' ' ' HIS . 46.5 mm -55.97 -22.7 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.328 179.551 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.535 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 16.1 mmmt -82.74 -29.64 29.6 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.327 -0.858 . . . . 0.0 111.34 -176.717 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.9 t -72.91 -34.73 66.81 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.177 -0.952 . . . . 0.0 110.18 -179.627 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -97.67 -4.43 37.36 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.72 -0.612 . . . . 0.0 111.226 -179.258 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.441 ' CB ' ' HB2' ' A' ' 34' ' ' LEU . 27.8 m80 -140.08 96.46 8.14 Favored Pre-proline 0 N--CA 1.493 1.703 0 O-C-N 121.26 -0.9 . . . . 0.0 108.698 179.016 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -75.03 -47.36 0.2 Allowed 'Trans proline' 0 C--N 1.315 -1.205 0 O-C-N 123.481 1.253 . . . . 0.0 110.662 -179.306 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.59 -20.59 63.92 Favored Glycine 0 N--CA 1.494 2.513 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 179.03 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.441 ' HB2' ' CB ' ' A' ' 31' ' ' HIS . 0.2 OUTLIER -48.01 92.22 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.471 -1.017 . . . . 0.0 111.705 -179.769 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.8 m -66.89 -179.3 0.88 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.497 -0.752 . . . . 0.0 109.461 179.3 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 17.8 mm -60.78 -56.39 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.382 -0.824 . . . . 0.0 109.843 179.946 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.414 ' O ' ' HE2' ' A' ' 41' ' ' LYS . . . -49.89 -43.41 39.48 Favored Glycine 0 N--CA 1.497 2.754 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 -179.018 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.453 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 40.5 m-20 -61.5 -36.17 79.73 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.636 -0.92 . . . . 0.0 109.993 178.949 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 10.9 m -60.08 -36.9 78.4 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.28 -0.887 . . . . 0.0 110.785 179.573 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.54 -54.02 6.91 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.624 -0.673 . . . . 0.0 110.357 -179.695 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.414 ' HE2' ' O ' ' A' ' 37' ' ' GLY . 1.8 ptpm? -67.39 -28.34 67.84 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.63 -0.669 . . . . 0.0 111.458 -179.23 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.453 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -81.5 -2.01 48.18 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.911 -1.118 . . . . 0.0 110.916 179.697 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 26.2 mt -106.6 -34.12 7.44 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.203 -0.935 . . . . 0.0 110.174 -179.904 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.5 -40.93 96.45 Favored Glycine 0 N--CA 1.494 2.504 0 N-CA-C 109.885 -1.286 . . . . 0.0 109.885 -179.653 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -55.88 -34.12 65.22 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.544 -0.974 . . . . 0.0 110.732 -179.628 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 47.1 mmm -80.65 -46.88 14.91 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.542 -0.724 . . . . 0.0 110.358 -179.876 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 74.2 t-105 -56.76 -22.11 33.3 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.53 -0.731 . . . . 0.0 110.989 -179.621 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 16.5 t -91.83 -35.52 14.04 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.269 -0.894 . . . . 0.0 110.231 179.976 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -65.02 -34.66 78.97 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.551 -0.718 . . . . 0.0 110.041 179.89 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 63.2 mm-40 -59.01 150.58 24.27 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.556 -0.715 . . . . 0.0 110.417 179.999 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 10.5 t -89.91 -151.53 0.24 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.637 -0.665 . . . . 0.0 109.545 179.744 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -85.74 53.6 2.83 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.258 -0.901 . . . . 0.0 110.192 179.849 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 67.4 mttt -132.17 -43.16 0.96 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.438 -0.789 . . . . 0.0 110.208 179.97 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -59.61 -31.42 69.47 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.488 -0.757 . . . . 0.0 110.626 -179.673 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 69.8 tttt -101.0 25.54 7.96 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.467 -0.771 . . . . 0.0 110.964 -179.503 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.425 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 1.7 mm-40 -97.64 -53.43 0.21 Allowed Pre-proline 0 N--CA 1.496 1.842 0 O-C-N 121.213 -0.929 . . . . 0.0 110.786 -179.836 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.425 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.6 Cg_endo -85.11 -31.86 0.35 Allowed 'Trans proline' 0 C--N 1.321 -0.908 0 O-C-N 122.92 0.958 . . . . 0.0 111.33 -179.634 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.34 -11.63 57.46 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.417 -0.802 . . . . 0.0 111.775 -178.579 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -79.22 -26.71 42.49 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.075 -1.016 . . . . 0.0 110.856 -179.421 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -76.12 -20.06 57.97 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.487 -0.758 . . . . 0.0 110.871 -179.9 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 36.7 tttt -65.02 -44.23 89.83 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.387 -0.821 . . . . 0.0 110.109 179.977 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -82.44 -15.51 52.33 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.51 -0.744 . . . . 0.0 110.11 179.283 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.36 -28.17 67.98 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.29 -0.881 . . . . 0.0 109.362 178.923 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -81.5 -64.99 1.07 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.61 -0.681 . . . . 0.0 109.472 179.175 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.404 ' O ' ' CD1' ' A' ' 69' ' ' TYR . 3.8 mp -50.65 -24.23 3.17 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.573 -0.704 . . . . 0.0 111.318 -179.732 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.3 tttt -63.18 -53.07 59.0 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.443 -0.785 . . . . 0.0 109.663 179.292 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -62.51 -48.78 78.07 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.682 -0.636 . . . . 0.0 110.25 -179.996 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 24.2 mmtp -60.32 -27.18 67.13 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.543 -0.723 . . . . 0.0 110.466 -179.674 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.404 ' CD1' ' O ' ' A' ' 65' ' ' LEU . 3.7 m-85 -80.72 -64.69 1.13 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.518 -0.739 . . . . 0.0 109.894 179.845 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -50.56 -35.2 28.69 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.5 -0.75 . . . . 0.0 111.163 -179.697 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 41.5 mmtt -76.11 -50.82 13.62 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.546 -0.721 . . . . 0.0 110.778 -179.754 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -74.52 -23.91 58.89 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.45 -0.781 . . . . 0.0 111.302 -179.103 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 9.1 tp . . . . . 0 N--CA 1.493 1.718 0 O-C-N 121.266 -0.896 . . . . 0.0 109.904 -179.983 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.421 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 48.6 Cg_endo . . . . . 0 N--CA 1.485 1.001 0 N-CA-C 110.725 -0.529 . . . . 0.0 110.725 . . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -108.2 26.27 10.62 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.585 -0.697 . . . . 0.0 110.784 179.815 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -163.27 95.62 1.08 Allowed Pre-proline 0 N--CA 1.494 1.767 0 O-C-N 121.702 -0.624 . . . . 0.0 110.16 -179.906 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.414 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 47.3 Cg_endo -75.56 114.77 4.04 Favored 'Trans proline' 0 C--N 1.316 -1.14 0 O-C-N 123.352 1.185 . . . . 0.0 110.66 -179.843 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -81.23 157.57 19.93 Favored 'Trans proline' 0 C--N 1.319 -1.013 0 O-C-N 123.303 1.159 . . . . 0.0 110.026 179.779 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.6 t -151.82 55.78 0.84 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.467 -0.771 . . . . 0.0 110.91 -179.625 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 67.87 -74.94 0.07 Allowed 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.194 -0.942 . . . . 0.0 110.152 -179.65 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -47.77 -51.26 23.06 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.416 -0.802 . . . . 0.0 111.402 -179.605 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -57.82 -41.67 82.73 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.455 -0.778 . . . . 0.0 109.743 179.548 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 61.9 mt -59.73 -46.65 88.46 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.576 -0.703 . . . . 0.0 109.947 179.9 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -69.67 -51.33 35.64 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.679 -0.638 . . . . 0.0 110.284 -179.729 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.5 m -56.24 -54.33 46.56 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.54 -0.725 . . . . 0.0 110.787 -179.658 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 34.7 t -57.94 -30.75 66.22 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.358 -0.839 . . . . 0.0 110.539 -179.807 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 -86.66 -29.42 22.51 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.534 -0.729 . . . . 0.0 110.721 -179.651 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -99.62 9.76 42.57 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.35 -0.844 . . . . 0.0 111.519 -179.401 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.481 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 3.6 mtt180 -79.75 -50.12 1.27 Allowed Pre-proline 0 N--CA 1.49 1.567 0 O-C-N 121.222 -0.924 . . . . 0.0 111.522 179.453 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 37.5 Cg_endo -63.74 -15.61 49.88 Favored 'Trans proline' 0 N--CA 1.491 1.362 0 O-C-N 122.918 0.957 . . . . 0.0 110.609 -179.631 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 9.1 tmtt? -72.69 -49.84 28.79 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 177.93 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 16.2 mm -55.65 -38.11 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 CA-C-O 121.51 0.671 . . . . 0.0 110.204 179.804 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.524 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 4.2 mmmm -68.15 -40.93 82.27 Favored 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.183 -177.101 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.4 t -58.04 -24.08 56.93 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.398 -0.814 . . . . 0.0 110.88 -179.527 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -114.32 -23.6 9.32 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.478 -0.764 . . . . 0.0 110.686 -179.679 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 53.8 m80 -119.67 96.79 49.79 Favored Pre-proline 0 N--CA 1.494 1.75 0 O-C-N 121.483 -0.761 . . . . 0.0 109.519 -179.783 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -75.08 -27.94 9.45 Favored 'Trans proline' 0 C--N 1.314 -1.28 0 O-C-N 123.525 1.276 . . . . 0.0 110.542 -179.855 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -85.72 -11.34 74.37 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 110.449 -1.06 . . . . 0.0 110.449 179.951 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.18 81.72 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.282 -1.128 . . . . 0.0 110.747 -179.608 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.5 m -70.98 171.0 11.58 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.407 -0.808 . . . . 0.0 109.904 -179.977 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 38.6 mm -51.76 -29.55 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.175 0 O-C-N 121.262 -0.899 . . . . 0.0 110.315 179.976 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.35 -69.06 1.39 Allowed Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.31 -1.516 . . . . 0.0 109.31 179.802 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -67.26 -28.5 68.09 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.591 -0.946 . . . . 0.0 110.698 179.723 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 85.3 m -65.26 -27.8 68.9 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.344 -0.848 . . . . 0.0 110.131 179.775 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.59 -47.27 19.83 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.44 -0.788 . . . . 0.0 109.948 179.76 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -82.57 -12.37 57.77 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.602 -0.686 . . . . 0.0 111.578 -179.603 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.85 -60.5 2.35 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.985 -1.072 . . . . 0.0 109.641 179.55 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 52.7 mt -50.96 -25.17 4.32 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.428 -0.795 . . . . 0.0 111.07 -179.873 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.47 -40.43 91.18 Favored Glycine 0 N--CA 1.493 2.435 0 N-CA-C 109.173 -1.571 . . . . 0.0 109.173 179.553 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -54.98 -37.34 66.41 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.507 -0.996 . . . . 0.0 110.676 -179.875 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 10.9 mmt -70.4 -53.09 17.94 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.531 -0.73 . . . . 0.0 109.988 179.872 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 63.9 t-105 -49.47 -54.58 16.95 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.475 -0.765 . . . . 0.0 111.115 -179.677 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 26.6 t -57.44 -36.56 71.54 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.376 -0.828 . . . . 0.0 110.304 179.993 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -63.82 -41.41 97.86 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.544 -0.722 . . . . 0.0 109.743 179.69 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -60.14 156.76 14.45 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.583 -0.698 . . . . 0.0 110.268 179.814 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.0 m -100.52 -151.93 0.41 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.681 -0.637 . . . . 0.0 109.395 179.485 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.42 51.15 2.15 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.329 -0.857 . . . . 0.0 109.993 179.613 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 42.1 mtmt -130.46 -49.92 1.08 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.431 -0.793 . . . . 0.0 110.523 -179.84 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -70.83 -16.37 62.72 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.553 -0.717 . . . . 0.0 111.481 -179.102 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 32.2 pttt -107.07 -37.31 6.34 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.152 -0.967 . . . . 0.0 111.116 -179.592 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.403 ' CB ' ' CD ' ' A' ' 57' ' ' PRO . 5.9 mm100 -42.87 -56.52 6.02 Favored Pre-proline 0 N--CA 1.508 2.444 0 O-C-N 121.402 -0.811 . . . . 0.0 112.438 -178.847 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.403 ' CD ' ' CB ' ' A' ' 56' ' ' GLN . 48.6 Cg_endo -72.52 -34.15 7.74 Favored 'Trans proline' 0 C--N 1.316 -1.172 0 O-C-N 123.061 1.032 . . . . 0.0 109.891 179.624 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -75.66 -8.16 56.11 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.647 -0.658 . . . . 0.0 110.667 179.818 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -77.49 -58.39 3.3 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.18 -0.95 . . . . 0.0 109.96 179.776 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -47.75 -28.2 2.38 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.697 -0.627 . . . . 0.0 111.535 -179.413 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 70.1 tttt -60.35 -50.35 73.97 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.319 -0.863 . . . . 0.0 109.886 179.648 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.64 -8.25 54.35 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.654 -0.654 . . . . 0.0 110.575 179.426 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.58 0.3 52.93 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.175 -0.953 . . . . 0.0 110.215 178.895 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 48.8 mmtt -105.28 -29.34 10.36 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.105 -0.997 . . . . 0.0 109.695 179.398 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.5 mp -88.47 -9.72 51.53 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.78 -0.575 . . . . 0.0 110.157 178.758 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.3 tptm -81.53 -31.17 32.88 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.3 -0.875 . . . . 0.0 109.204 179.154 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -67.89 -61.34 1.92 Allowed 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 120.114 -0.634 . . . . 0.0 109.359 179.411 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.9 mtpp -57.59 -23.9 53.35 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.573 -0.705 . . . . 0.0 110.72 179.887 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.421 ' CD2' ' HB2' ' A' ' 9' ' ' PRO . 23.9 t80 -74.22 -60.28 2.34 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.263 -0.898 . . . . 0.0 109.857 179.662 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -80.2 -17.81 51.32 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.698 -0.627 . . . . 0.0 112.046 -178.723 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.0 ttmm -98.93 -23.76 15.2 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.102 -0.999 . . . . 0.0 112.052 -178.621 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -102.25 -31.98 10.28 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.151 -0.968 . . . . 0.0 111.457 -179.149 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.9 tp . . . . . 0 N--CA 1.502 2.13 0 O-C-N 121.242 -0.911 . . . . 0.0 110.666 -179.492 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.4 ttt . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.145 0.498 . . . . 0.0 110.231 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.5 mttm -167.57 -40.01 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.628 -0.67 . . . . 0.0 110.489 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 10.1 tttt -167.69 84.81 0.21 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.455 -0.778 . . . . 0.0 110.272 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 42.3 mttm -60.93 -56.5 20.45 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.575 -0.703 . . . . 0.0 110.344 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -162.73 159.7 19.61 Favored Pre-proline 0 N--CA 1.494 1.75 0 O-C-N 121.605 -0.684 . . . . 0.0 110.237 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -73.28 -46.64 0.35 Allowed 'Trans proline' 0 C--N 1.318 -1.069 0 O-C-N 123.333 1.175 . . . . 0.0 110.627 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -79.4 -21.61 45.4 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.565 -0.709 . . . . 0.0 110.837 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -74.95 144.85 80.27 Favored Pre-proline 0 N--CA 1.496 1.846 0 O-C-N 121.358 -0.839 . . . . 0.0 109.81 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -73.09 88.52 0.95 Allowed 'Trans proline' 0 C--N 1.317 -1.093 0 O-C-N 123.292 1.153 . . . . 0.0 110.568 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.8 mtpt -56.07 -171.57 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.662 -0.649 . . . . 0.0 110.711 -179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.2 mtt85 -56.64 139.46 75.94 Favored Pre-proline 0 N--CA 1.498 1.933 0 O-C-N 121.412 -0.805 . . . . 0.0 110.456 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.418 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 50.0 Cg_endo -77.03 133.27 13.48 Favored 'Trans proline' 0 C--N 1.318 -1.039 0 O-C-N 123.382 1.201 . . . . 0.0 110.252 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -82.42 -162.5 0.18 Allowed 'Trans proline' 0 C--N 1.319 -0.993 0 O-C-N 123.236 1.124 . . . . 0.0 109.903 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 31.0 t -165.82 63.52 0.11 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.445 -0.784 . . . . 0.0 110.458 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 67.63 -75.54 0.06 Allowed 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.21 -0.931 . . . . 0.0 109.958 -179.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -47.19 -50.48 20.71 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.424 -0.798 . . . . 0.0 111.386 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -59.18 -39.53 82.82 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.614 -0.679 . . . . 0.0 109.746 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 45.0 mt -65.94 -37.19 85.39 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.594 -0.691 . . . . 0.0 109.891 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.492 ' CE2' ' CZ ' ' A' ' 23' ' ' TYR . 28.0 t80 -77.37 -54.06 6.91 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.634 -0.666 . . . . 0.0 110.654 -179.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 14.6 t -56.91 -53.07 62.14 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.459 -0.776 . . . . 0.0 110.707 -179.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 82.7 p -57.77 -25.4 60.44 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.577 -0.702 . . . . 0.0 110.859 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -96.55 -26.44 15.26 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.378 -0.826 . . . . 0.0 111.143 -179.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.492 ' CZ ' ' CE2' ' A' ' 19' ' ' PHE . 6.2 m-85 -88.5 -34.66 17.35 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.322 -0.861 . . . . 0.0 110.96 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.497 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 25.5 mtt180 -48.18 -52.83 38.61 Favored Pre-proline 0 N--CA 1.498 1.947 0 O-C-N 121.338 -0.851 . . . . 0.0 112.12 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 36.3 Cg_endo -59.64 -27.62 85.4 Favored 'Trans proline' 0 N--CA 1.494 1.541 0 O-C-N 123.184 1.097 . . . . 0.0 110.233 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.9 tmtt? -69.76 -45.9 67.02 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.1 mm -57.77 -31.59 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.246 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.528 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 4.8 mmmm -71.26 -36.23 71.67 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 120.004 -0.678 . . . . 0.0 110.427 -177.283 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 39.7 t -63.09 -23.38 67.42 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.393 -0.817 . . . . 0.0 110.8 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -117.14 -18.87 9.9 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.447 -0.783 . . . . 0.0 111.122 -179.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 52.0 m80 -123.25 96.1 44.74 Favored Pre-proline 0 N--CA 1.496 1.85 0 O-C-N 121.374 -0.829 . . . . 0.0 109.676 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -74.87 -36.73 2.49 Favored 'Trans proline' 0 C--N 1.316 -1.171 0 O-C-N 123.461 1.242 . . . . 0.0 110.303 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.403 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -74.37 -16.89 79.73 Favored Glycine 0 N--CA 1.49 2.261 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.74 80.17 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.529 -0.983 . . . . 0.0 111.335 -179.354 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.403 ' N ' ' O ' ' A' ' 33' ' ' GLY . 75.8 p -74.57 173.0 11.01 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.311 -0.868 . . . . 0.0 109.521 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 40.4 mm -52.13 -30.39 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.173 0 O-C-N 121.322 -0.862 . . . . 0.0 110.399 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.22 -68.81 1.5 Allowed Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.338 -1.505 . . . . 0.0 109.338 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.403 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 0.4 OUTLIER -67.82 -28.59 67.7 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.686 -0.891 . . . . 0.0 110.655 179.745 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 78.4 m -66.45 -29.75 69.95 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.297 -0.877 . . . . 0.0 110.014 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.53 -46.09 34.21 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.592 -0.692 . . . . 0.0 109.87 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.86 -13.01 54.69 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.621 -0.674 . . . . 0.0 111.774 -179.446 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 3.7 tppt? -77.46 -59.58 2.72 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 120.986 -1.071 . . . . 0.0 109.825 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.2 mp -53.33 -28.88 30.88 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.419 -0.801 . . . . 0.0 110.578 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -71.24 -44.57 52.57 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.114 -1.595 . . . . 0.0 109.114 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -55.31 -33.63 63.47 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.605 -0.938 . . . . 0.0 110.532 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 65.5 mmm -76.81 -49.62 15.4 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.634 -0.666 . . . . 0.0 109.564 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 70.1 t-105 -50.37 -53.02 32.24 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.563 -0.711 . . . . 0.0 110.964 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.4 t -62.74 -34.6 77.55 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.46 -0.775 . . . . 0.0 110.129 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -63.9 -39.72 94.83 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.558 -0.714 . . . . 0.0 110.141 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -57.54 157.52 6.84 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.602 -0.686 . . . . 0.0 110.594 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 17.5 t -88.51 -148.91 0.17 Allowed 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -89.31 47.58 1.5 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.154 -0.967 . . . . 0.0 110.257 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 40.7 mttp -126.94 -42.51 1.74 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.464 -0.772 . . . . 0.0 110.095 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -54.9 -26.64 37.17 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.42 -0.8 . . . . 0.0 110.926 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 40.9 tttm -107.29 26.85 9.68 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.43 -0.794 . . . . 0.0 110.963 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.421 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 3.9 mm-40 -99.91 -55.24 0.16 Allowed Pre-proline 0 N--CA 1.497 1.897 0 O-C-N 121.338 -0.851 . . . . 0.0 110.966 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.421 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.1 Cg_endo -83.37 -37.2 0.18 Allowed 'Trans proline' 0 C--N 1.322 -0.851 0 O-C-N 122.935 0.966 . . . . 0.0 110.692 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -80.51 4.9 16.79 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.523 -0.735 . . . . 0.0 111.579 -179.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.07 -19.98 18.33 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.178 -0.951 . . . . 0.0 110.567 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -77.48 -24.63 50.11 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.46 -0.775 . . . . 0.0 110.267 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 35.1 tttt -60.76 -41.52 95.64 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.482 -0.761 . . . . 0.0 109.863 179.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.1 -10.41 59.74 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.564 -0.71 . . . . 0.0 110.939 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -98.01 4.3 49.34 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.246 -0.908 . . . . 0.0 110.83 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.66 -40.7 5.67 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.126 -0.984 . . . . 0.0 109.787 179.569 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.4 pp -78.88 -0.16 29.64 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.831 -0.543 . . . . 0.0 110.737 179.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.0 ttpt -92.55 -21.06 20.32 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.243 -0.911 . . . . 0.0 109.871 179.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -83.29 -12.42 56.7 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.46 -0.775 . . . . 0.0 110.196 178.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -105.31 -30.39 9.67 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.327 -0.858 . . . . 0.0 109.347 178.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.418 ' CE2' ' HD3' ' A' ' 12' ' ' PRO . 4.4 t80 -74.8 -53.59 8.88 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.716 -0.615 . . . . 0.0 109.577 179.435 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -56.44 -19.43 15.08 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.614 -0.679 . . . . 0.0 111.405 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.8 mttt -105.95 -29.0 10.24 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.262 -0.899 . . . . 0.0 110.802 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -86.7 -39.57 15.9 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.466 -0.771 . . . . 0.0 111.099 -179.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.4 ' HB ' ' CD1' ' A' ' 69' ' ' TYR . 6.6 tp -61.47 -21.01 24.17 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.378 -0.826 . . . . 0.0 110.919 -179.384 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.02 -37.0 83.26 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.345 -0.847 . . . . 0.0 109.988 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -94.04 -26.06 16.94 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.677 -0.64 . . . . 0.0 110.282 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -63.5 -29.3 70.59 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.45 -0.781 . . . . 0.0 110.157 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 38.7 mtt-85 -78.95 -75.88 0.22 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.573 -0.705 . . . . 0.0 110.133 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 53.97 46.84 24.73 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.356 -0.84 . . . . 0.0 110.74 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.6 ptmt . . . . . 0 N--CA 1.495 1.78 0 CA-C-O 118.0 -1.0 . . . . 0.0 110.355 179.991 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.9 ttt . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.006 0.432 . . . . 0.0 110.187 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 57.2 -84.38 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.692 -0.63 . . . . 0.0 110.954 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 39.8 tttt 54.08 40.88 32.08 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.033 -1.042 . . . . 0.0 110.61 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.5 mttp -166.26 -167.4 1.03 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.645 -0.66 . . . . 0.0 109.997 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -123.36 164.85 25.52 Favored Pre-proline 0 N--CA 1.493 1.717 0 O-C-N 121.503 -0.748 . . . . 0.0 110.375 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.37 -19.21 25.6 Favored 'Trans proline' 0 C--N 1.317 -1.124 0 O-C-N 123.538 1.283 . . . . 0.0 110.949 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 67.1 m-80 -79.85 -30.09 40.23 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.294 -0.879 . . . . 0.0 110.268 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -92.74 136.5 24.94 Favored Pre-proline 0 N--CA 1.493 1.716 0 O-C-N 121.572 -0.705 . . . . 0.0 110.052 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.418 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 50.0 Cg_endo -74.17 94.91 0.9 Allowed 'Trans proline' 0 C--N 1.319 -1.015 0 O-C-N 123.19 1.1 . . . . 0.0 110.578 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.02 -168.25 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.494 -0.754 . . . . 0.0 110.016 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -60.15 137.21 91.32 Favored Pre-proline 0 N--CA 1.498 1.936 0 O-C-N 121.447 -0.783 . . . . 0.0 110.208 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -76.5 136.21 17.21 Favored 'Trans proline' 0 C--N 1.318 -1.063 0 O-C-N 123.36 1.19 . . . . 0.0 109.808 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -79.94 -169.84 0.88 Allowed 'Trans proline' 0 C--N 1.317 -1.107 0 O-C-N 123.28 1.147 . . . . 0.0 110.213 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -163.22 61.33 0.18 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.491 -0.756 . . . . 0.0 110.773 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 65.77 -78.88 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.166 -0.959 . . . . 0.0 110.64 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -46.02 -52.26 12.15 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.237 -0.915 . . . . 0.0 111.729 -179.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -57.42 -33.75 68.22 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.499 -0.75 . . . . 0.0 110.131 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 47.8 mt -70.48 -38.3 74.37 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.613 -0.679 . . . . 0.0 110.204 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.497 ' CE2' ' CE1' ' A' ' 23' ' ' TYR . 52.7 t80 -77.21 -54.91 5.91 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.688 -0.632 . . . . 0.0 110.478 -179.537 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -56.81 -53.06 62.13 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.572 -0.705 . . . . 0.0 110.505 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.7 t -59.49 -17.99 36.23 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.578 -0.702 . . . . 0.0 111.131 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -107.89 -11.73 15.3 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.25 -0.906 . . . . 0.0 111.663 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.497 ' CE1' ' CE2' ' A' ' 19' ' ' PHE . 2.5 m-85 -100.35 -33.9 10.2 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.065 -1.022 . . . . 0.0 110.869 -179.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.494 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 27.7 mtt180 -47.8 -51.7 44.44 Favored Pre-proline 0 N--CA 1.498 1.943 0 O-C-N 121.31 -0.869 . . . . 0.0 112.3 -179.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 36.3 Cg_endo -60.43 -26.23 82.26 Favored 'Trans proline' 0 N--CA 1.494 1.539 0 O-C-N 123.252 1.133 . . . . 0.0 110.343 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.2 tmtt? -70.31 -45.38 66.35 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 178.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 47.8 mm -58.83 -28.79 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 CA-C-O 121.173 0.511 . . . . 0.0 110.309 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.502 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 5.7 mmmm -73.27 -33.65 65.36 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.593 -0.692 . . . . 0.0 110.547 -177.247 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 13.1 t -67.69 -23.53 65.31 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.397 -0.814 . . . . 0.0 110.636 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -116.09 -14.42 11.18 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.414 -0.804 . . . . 0.0 111.247 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 44.4 m80 -130.62 94.7 28.54 Favored Pre-proline 0 N--CA 1.496 1.834 0 O-C-N 121.301 -0.874 . . . . 0.0 109.376 179.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -74.95 -38.72 1.49 Allowed 'Trans proline' 0 C--N 1.315 -1.192 0 O-C-N 123.465 1.245 . . . . 0.0 110.401 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.416 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -71.99 -22.57 78.74 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 109.864 -1.294 . . . . 0.0 109.864 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -52.07 86.79 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.627 -0.925 . . . . 0.0 111.775 -179.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.416 ' N ' ' O ' ' A' ' 33' ' ' GLY . 17.2 m -76.27 172.06 13.5 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.513 -0.742 . . . . 0.0 109.653 179.545 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 44.9 mm -56.87 -27.49 26.45 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.975 0 O-C-N 121.407 -0.808 . . . . 0.0 110.095 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.32 -63.78 4.72 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -74.07 -32.35 63.24 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.574 -0.956 . . . . 0.0 110.61 179.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 89.8 m -66.34 -33.86 76.68 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.304 -0.872 . . . . 0.0 110.162 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.1 -31.65 68.06 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.629 -0.669 . . . . 0.0 109.956 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -102.2 -8.05 21.65 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.604 -0.685 . . . . 0.0 111.543 -179.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.38 3.64 46.19 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.001 -1.062 . . . . 0.0 110.203 179.062 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.8 mt -102.21 -33.87 9.47 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.023 -1.048 . . . . 0.0 109.493 179.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -68.48 -31.0 73.3 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.427 -1.469 . . . . 0.0 109.427 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -56.93 -45.8 82.49 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.501 -0.999 . . . . 0.0 110.241 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 25.8 mtt -77.25 -49.6 14.71 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.642 -0.661 . . . . 0.0 109.646 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 73.3 t-105 -54.93 -22.14 14.02 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.613 -0.679 . . . . 0.0 110.879 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.0 p -88.87 -35.26 16.65 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.322 -0.861 . . . . 0.0 109.885 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.13 -34.98 77.39 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.629 -0.669 . . . . 0.0 109.821 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 87.3 mm-40 -63.08 157.6 21.77 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.59 -0.694 . . . . 0.0 109.809 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.2 m -147.33 103.65 3.58 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.514 -0.741 . . . . 0.0 110.339 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 52.95 51.95 14.84 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.472 -0.768 . . . . 0.0 110.994 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.6 tppt? -150.77 -69.77 0.18 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.498 -0.751 . . . . 0.0 109.939 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -64.39 -36.31 83.74 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.353 -0.842 . . . . 0.0 110.437 -179.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -93.28 19.44 8.16 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.436 -0.79 . . . . 0.0 111.358 -179.317 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -92.23 -52.13 0.28 Allowed Pre-proline 0 N--CA 1.496 1.831 0 O-C-N 121.398 -0.814 . . . . 0.0 110.415 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -83.23 -28.53 1.47 Allowed 'Trans proline' 0 C--N 1.319 -0.975 0 O-C-N 123.074 1.039 . . . . 0.0 110.275 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -84.28 1.83 42.98 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.543 -0.723 . . . . 0.0 111.649 -179.051 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.07 -24.65 16.23 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.082 -1.012 . . . . 0.0 110.704 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -75.87 -21.42 57.21 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.413 -0.804 . . . . 0.0 110.217 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 20.0 tttp -59.93 -44.66 94.22 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.46 -0.775 . . . . 0.0 109.932 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.68 -10.41 59.33 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.532 -0.73 . . . . 0.0 110.511 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.09 5.38 37.97 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.235 -0.916 . . . . 0.0 110.383 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 19.9 mmmt -105.48 -33.13 8.23 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.246 -0.909 . . . . 0.0 109.334 179.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.7 mp -80.03 2.87 22.11 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.881 -0.512 . . . . 0.0 111.052 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -95.92 -26.0 15.76 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.081 -1.012 . . . . 0.0 110.009 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -84.88 -15.13 45.68 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.545 -0.722 . . . . 0.0 110.588 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -103.19 -28.83 11.68 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.38 -0.825 . . . . 0.0 109.715 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.418 ' CD2' ' HB2' ' A' ' 9' ' ' PRO . 20.6 t80 -74.61 -53.47 9.3 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.752 -0.593 . . . . 0.0 109.868 179.653 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -68.78 -9.63 51.99 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.737 -0.602 . . . . 0.0 111.587 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 38.5 mttm -104.29 -31.81 9.39 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.143 -0.973 . . . . 0.0 110.779 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -93.99 -28.68 15.64 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.494 -0.754 . . . . 0.0 111.136 -179.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.5 tp -69.42 -22.13 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 O-C-N 121.426 -0.796 . . . . 0.0 110.917 -179.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.28 -49.96 67.56 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.42 -0.8 . . . . 0.0 110.13 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -83.15 -19.54 36.45 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.599 -0.688 . . . . 0.0 110.591 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -67.87 -26.53 66.07 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.412 -0.805 . . . . 0.0 110.487 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -87.26 -80.23 0.26 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.471 -0.768 . . . . 0.0 110.377 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -172.26 48.36 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.324 -0.86 . . . . 0.0 110.126 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.0 mmtm . . . . . 0 N--CA 1.494 1.74 0 CA-C-O 117.969 -1.015 . . . . 0.0 110.311 -179.917 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.669 0 CA-C-O 121.175 0.512 . . . . 0.0 110.124 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.98 122.19 32.77 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.521 -0.737 . . . . 0.0 110.188 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 23.3 ttpt -170.69 155.77 4.97 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.526 -0.734 . . . . 0.0 110.143 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -169.41 -157.72 0.18 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.511 -0.743 . . . . 0.0 109.863 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.03 145.04 90.04 Favored Pre-proline 0 N--CA 1.495 1.811 0 O-C-N 121.598 -0.689 . . . . 0.0 110.274 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -74.7 -33.82 4.71 Favored 'Trans proline' 0 C--N 1.318 -1.056 0 O-C-N 123.353 1.186 . . . . 0.0 110.485 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 31.1 t30 -79.29 -20.23 48.54 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.644 -0.66 . . . . 0.0 110.797 -179.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -88.69 136.56 30.93 Favored Pre-proline 0 N--CA 1.494 1.749 0 O-C-N 121.332 -0.855 . . . . 0.0 109.751 179.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -73.1 99.74 1.14 Allowed 'Trans proline' 0 C--N 1.319 -0.984 0 O-C-N 123.111 1.058 . . . . 0.0 110.412 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.3 pttt -59.93 -163.65 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.615 -0.678 . . . . 0.0 110.363 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -64.3 141.05 98.09 Favored Pre-proline 0 N--CA 1.496 1.837 0 O-C-N 121.543 -0.723 . . . . 0.0 110.236 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -75.66 132.11 14.24 Favored 'Trans proline' 0 C--N 1.318 -1.063 0 O-C-N 123.26 1.137 . . . . 0.0 109.852 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -81.23 -171.2 1.17 Allowed 'Trans proline' 0 C--N 1.317 -1.116 0 O-C-N 123.237 1.125 . . . . 0.0 110.352 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.1 t -166.32 63.02 0.1 Allowed 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.524 -0.735 . . . . 0.0 110.582 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 65.75 -79.0 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.173 -0.954 . . . . 0.0 110.329 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.5 ' CE2' ' CD1' ' A' ' 47' ' ' TRP . 2.8 t80 -47.56 -49.07 27.39 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.217 -0.927 . . . . 0.0 111.403 -179.421 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -58.01 -30.25 65.95 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.658 -0.651 . . . . 0.0 110.074 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.0 mt -79.04 -31.76 44.7 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.48 -0.763 . . . . 0.0 110.489 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.5 ' CE1' ' CZ ' ' A' ' 23' ' ' TYR . 59.4 t80 -79.2 -55.04 5.39 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.518 -0.739 . . . . 0.0 110.669 -179.349 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 5.7 t -56.7 -54.63 43.98 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.406 -0.809 . . . . 0.0 110.581 -179.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 84.2 p -55.88 -21.52 20.54 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.444 -0.785 . . . . 0.0 110.967 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.5 mm-40 -101.23 -24.87 14.17 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.398 -0.814 . . . . 0.0 110.828 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.5 ' CZ ' ' CE1' ' A' ' 19' ' ' PHE . 8.0 m-85 -95.58 11.83 31.79 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.43 -0.794 . . . . 0.0 111.456 -179.293 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.485 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 4.5 mtt180 -87.1 -45.13 0.53 Allowed Pre-proline 0 N--CA 1.488 1.454 0 O-C-N 121.173 -0.955 . . . . 0.0 112.263 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.51 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.0 Cg_endo -66.76 -16.93 51.67 Favored 'Trans proline' 0 N--CA 1.49 1.275 0 O-C-N 122.899 0.947 . . . . 0.0 110.449 -179.203 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.8 tmtt? -71.69 -48.74 45.37 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 178.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 26.9 mm -56.67 -33.38 40.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 CA-C-O 121.376 0.608 . . . . 0.0 110.315 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.51 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 4.6 mmmm -72.1 -38.42 69.35 Favored 'General case' 0 N--CA 1.497 1.92 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.337 -177.072 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.7 t -57.81 -26.29 61.77 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.401 -0.812 . . . . 0.0 110.693 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -114.92 -22.68 9.48 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.53 -0.731 . . . . 0.0 110.721 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 36.5 m80 -122.1 95.7 47.17 Favored Pre-proline 0 N--CA 1.496 1.86 0 O-C-N 121.393 -0.817 . . . . 0.0 109.649 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -75.29 -36.2 2.51 Favored 'Trans proline' 0 C--N 1.316 -1.155 0 O-C-N 123.418 1.22 . . . . 0.0 110.346 -179.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.403 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -75.5 -17.87 80.02 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 110.203 -1.159 . . . . 0.0 110.203 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.79 86.99 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.253 0 O-C-N 121.563 -0.963 . . . . 0.0 111.191 -179.469 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.403 ' N ' ' O ' ' A' ' 33' ' ' GLY . 40.6 t -72.44 171.57 12.04 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.581 -0.7 . . . . 0.0 110.011 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.7 mm -55.84 -28.99 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.072 0 O-C-N 121.411 -0.806 . . . . 0.0 110.125 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.91 -64.15 4.45 Favored Glycine 0 N--CA 1.493 2.471 0 N-CA-C 109.178 -1.569 . . . . 0.0 109.178 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -72.19 -34.01 68.09 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.546 -0.973 . . . . 0.0 110.438 179.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 96.4 m -64.21 -33.15 75.15 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.338 -0.851 . . . . 0.0 110.151 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.01 -36.97 69.88 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.638 -0.664 . . . . 0.0 110.062 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -96.24 -9.56 30.09 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.581 -0.699 . . . . 0.0 111.888 -179.332 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.8 7.33 34.63 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 120.986 -1.072 . . . . 0.0 110.258 179.158 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 16.2 mt -105.6 -30.18 9.66 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.053 -1.029 . . . . 0.0 109.584 179.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.65 -28.83 73.53 Favored Glycine 0 N--CA 1.493 2.44 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -55.02 -44.16 74.33 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.437 -1.037 . . . . 0.0 110.556 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 34.5 mtm -82.31 -46.74 13.23 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.541 -0.725 . . . . 0.0 109.912 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . 0.5 ' CD1' ' CE2' ' A' ' 16' ' ' PHE . 74.6 t-105 -54.68 -22.03 12.53 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.628 -0.67 . . . . 0.0 111.06 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 11.1 t -97.5 -33.16 11.47 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.359 -0.838 . . . . 0.0 110.216 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -62.73 -36.35 82.73 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.566 -0.709 . . . . 0.0 110.032 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 13.4 mm-40 -58.9 156.98 10.5 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.521 -0.737 . . . . 0.0 110.504 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.8 t -86.6 -148.43 0.13 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.671 -0.643 . . . . 0.0 109.369 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.67 49.26 1.77 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.201 -0.937 . . . . 0.0 110.335 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 17.3 mtmm -126.64 -40.19 1.94 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.523 -0.735 . . . . 0.0 110.29 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -55.79 -32.66 63.7 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.366 -0.834 . . . . 0.0 110.845 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.5 tttm -103.24 26.28 8.5 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.41 -0.806 . . . . 0.0 110.931 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.429 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 3.9 mt-30 -99.0 -55.0 0.18 Allowed Pre-proline 0 N--CA 1.495 1.823 0 O-C-N 121.288 -0.882 . . . . 0.0 110.655 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.429 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.0 Cg_endo -83.94 -35.15 0.23 Allowed 'Trans proline' 0 C--N 1.321 -0.912 0 O-C-N 122.918 0.957 . . . . 0.0 110.779 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -81.54 4.33 21.72 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.411 -0.806 . . . . 0.0 111.446 -179.302 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -96.71 -23.0 16.65 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.976 -1.077 . . . . 0.0 110.731 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -75.61 -22.65 56.69 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.458 -0.777 . . . . 0.0 110.239 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 66.0 tttt -60.93 -41.67 96.64 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.426 -0.796 . . . . 0.0 109.93 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.78 -11.34 60.76 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.586 -0.696 . . . . 0.0 110.58 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.68 6.13 36.29 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.327 -0.858 . . . . 0.0 110.503 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 24.7 mmtp -106.12 -33.85 7.73 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.216 -0.928 . . . . 0.0 109.281 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.1 mp -79.42 0.64 28.5 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.881 -0.512 . . . . 0.0 111.004 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 31.7 tttm -91.53 -26.03 18.96 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.171 -0.956 . . . . 0.0 109.839 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -85.06 -14.44 47.24 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.5 -0.75 . . . . 0.0 110.656 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 20.4 mtpt -102.92 -29.92 11.13 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.327 -0.858 . . . . 0.0 109.854 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -75.1 -53.24 9.22 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.631 -0.668 . . . . 0.0 109.684 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -69.28 -9.02 51.3 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.639 -0.663 . . . . 0.0 111.47 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 43.8 mttm -109.02 -33.71 6.82 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.085 -1.009 . . . . 0.0 110.697 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -87.02 -33.95 19.39 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.418 -0.801 . . . . 0.0 111.003 -179.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.2 tp -63.34 -19.95 25.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 O-C-N 121.433 -0.792 . . . . 0.0 110.909 -179.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.04 -48.16 66.41 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.311 -0.868 . . . . 0.0 109.838 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.3 -27.28 26.07 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.695 -0.628 . . . . 0.0 109.981 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -62.54 -29.43 70.56 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.608 -0.682 . . . . 0.0 110.102 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 46.3 mtp85 -73.93 -74.16 0.2 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.63 -0.669 . . . . 0.0 110.039 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 57.85 104.82 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.478 -0.764 . . . . 0.0 110.4 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.773 0 CA-C-O 118.052 -0.975 . . . . 0.0 110.246 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 32.6 ttm . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 121.089 0.471 . . . . 0.0 110.172 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.11 95.52 8.62 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.598 -0.689 . . . . 0.0 110.209 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 11.5 ttmt -170.04 -159.67 0.21 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.542 -0.724 . . . . 0.0 110.133 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -147.13 -155.26 0.61 Allowed 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.583 -0.698 . . . . 0.0 109.854 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.38 148.69 98.66 Favored Pre-proline 0 N--CA 1.496 1.848 0 O-C-N 121.371 -0.831 . . . . 0.0 110.084 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -73.01 -40.83 1.57 Allowed 'Trans proline' 0 C--N 1.317 -1.093 0 O-C-N 123.402 1.211 . . . . 0.0 110.468 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -79.65 0.85 28.5 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.548 -0.72 . . . . 0.0 111.282 -179.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -93.36 130.31 36.03 Favored Pre-proline 0 N--CA 1.494 1.758 0 O-C-N 121.114 -0.991 . . . . 0.0 109.879 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -74.06 89.26 1.04 Allowed 'Trans proline' 0 C--N 1.319 -0.986 0 O-C-N 123.137 1.072 . . . . 0.0 110.406 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -103.86 33.28 3.49 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.513 -0.742 . . . . 0.0 110.399 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -169.63 100.75 0.47 Allowed Pre-proline 0 N--CA 1.495 1.797 0 O-C-N 121.795 -0.566 . . . . 0.0 110.584 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.42 ' HB3' ' CD2' ' A' ' 69' ' ' TYR . 46.6 Cg_endo -75.26 116.46 4.55 Favored 'Trans proline' 0 C--N 1.319 -1.018 0 O-C-N 123.305 1.161 . . . . 0.0 110.168 179.616 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -81.5 163.82 19.06 Favored 'Trans proline' 0 C--N 1.317 -1.087 0 O-C-N 123.255 1.134 . . . . 0.0 110.38 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.7 t -164.98 62.44 0.13 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.582 -0.699 . . . . 0.0 110.518 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 65.48 -78.1 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.167 -0.958 . . . . 0.0 110.048 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -47.66 -50.11 25.62 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.347 -0.845 . . . . 0.0 111.435 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -58.42 -37.23 74.94 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.538 -0.726 . . . . 0.0 109.924 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 43.7 mt -67.95 -39.71 83.38 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.642 -0.661 . . . . 0.0 110.104 -179.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.497 ' CE2' ' CE1' ' A' ' 23' ' ' TYR . 37.9 t80 -72.69 -52.88 13.4 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.667 -0.645 . . . . 0.0 110.868 -179.324 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 23.3 t -57.57 -50.51 72.86 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.527 -0.733 . . . . 0.0 110.716 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 94.4 p -60.19 -26.97 66.76 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.525 -0.734 . . . . 0.0 110.844 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -95.36 -23.84 17.0 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.407 -0.808 . . . . 0.0 111.372 -179.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.497 ' CE1' ' CE2' ' A' ' 19' ' ' PHE . 7.0 m-85 -91.53 -33.64 15.08 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.278 -0.889 . . . . 0.0 111.003 -179.308 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.502 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 17.9 mtt180 -48.5 -52.72 41.57 Favored Pre-proline 0 N--CA 1.498 1.938 0 O-C-N 121.313 -0.867 . . . . 0.0 112.138 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.502 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 36.2 Cg_endo -59.65 -28.36 87.18 Favored 'Trans proline' 0 N--CA 1.495 1.597 0 O-C-N 123.265 1.14 . . . . 0.0 110.134 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.67 -44.42 74.1 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 178.109 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.3 mm -59.63 -31.09 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.112 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.511 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 5.4 mmmm -72.78 -38.24 67.35 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 120.032 -0.667 . . . . 0.0 110.575 -177.043 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.9 t -57.7 -26.43 61.72 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.384 -0.822 . . . . 0.0 110.756 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -115.25 -22.85 9.21 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.519 -0.738 . . . . 0.0 110.822 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 33.7 m80 -122.18 95.57 47.16 Favored Pre-proline 0 N--CA 1.496 1.87 0 O-C-N 121.452 -0.78 . . . . 0.0 109.635 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -75.13 -40.49 0.85 Allowed 'Trans proline' 0 C--N 1.315 -1.193 0 O-C-N 123.464 1.244 . . . . 0.0 110.189 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.405 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -70.21 -19.33 75.69 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.63 85.3 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.527 -0.984 . . . . 0.0 111.11 -179.509 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.405 ' N ' ' O ' ' A' ' 33' ' ' GLY . 66.3 m -73.4 174.45 8.14 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.432 -0.792 . . . . 0.0 109.836 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 41.3 mm -54.57 -33.22 26.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 O-C-N 121.393 -0.817 . . . . 0.0 110.238 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.05 -64.89 3.93 Favored Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.1 -36.06 77.13 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.613 -0.934 . . . . 0.0 110.267 179.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.0 m -62.66 -30.7 71.57 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.356 -0.84 . . . . 0.0 110.209 179.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.22 -44.26 38.47 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.51 -0.743 . . . . 0.0 110.119 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -86.65 -14.15 43.49 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.542 -0.724 . . . . 0.0 111.784 -179.158 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -87.04 6.95 29.88 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.92 -1.113 . . . . 0.0 110.453 179.319 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 14.6 mt -103.89 -29.58 10.89 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.089 -1.007 . . . . 0.0 109.664 179.355 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -66.83 -29.41 74.63 Favored Glycine 0 N--CA 1.492 2.427 0 N-CA-C 109.449 -1.46 . . . . 0.0 109.449 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -52.4 -44.23 65.24 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.474 -1.015 . . . . 0.0 110.731 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 17.4 mtt -86.32 -42.12 13.98 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.631 -0.668 . . . . 0.0 109.873 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 73.8 t-105 -55.21 -23.18 20.81 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.577 -0.702 . . . . 0.0 110.894 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 38.1 t -94.55 -32.89 13.26 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.44 -0.788 . . . . 0.0 110.006 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -62.69 -37.08 85.04 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.589 -0.694 . . . . 0.0 109.677 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -63.22 156.4 25.48 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.669 -0.645 . . . . 0.0 109.903 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.2 m -104.94 -152.3 0.46 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.733 -0.604 . . . . 0.0 109.382 179.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -84.61 54.19 2.94 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.389 -0.819 . . . . 0.0 109.92 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 52.5 mttm -130.04 -51.56 1.12 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.466 -0.771 . . . . 0.0 110.251 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -75.21 -23.46 57.62 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.478 -0.764 . . . . 0.0 111.347 -179.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 3.5 mppt? -89.89 -40.23 12.54 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.239 -0.913 . . . . 0.0 110.911 -179.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -43.72 -56.71 6.8 Favored Pre-proline 0 N--CA 1.508 2.437 0 O-C-N 121.585 -0.697 . . . . 0.0 112.497 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -70.47 -35.77 10.02 Favored 'Trans proline' 0 C--N 1.316 -1.164 0 O-C-N 122.993 0.996 . . . . 0.0 110.194 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -76.04 -9.86 58.96 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.608 -0.682 . . . . 0.0 110.786 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -76.5 -58.47 3.26 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.218 -0.926 . . . . 0.0 110.005 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -48.81 -27.95 3.36 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.6 -0.688 . . . . 0.0 111.491 -179.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 41.5 tttt -58.35 -53.33 59.55 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.395 -0.815 . . . . 0.0 109.984 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.52 -9.92 59.18 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.581 -0.7 . . . . 0.0 110.436 179.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.92 -0.16 47.19 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.355 -0.841 . . . . 0.0 110.081 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 20.2 mmtt -105.49 -28.12 11.0 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.136 -0.977 . . . . 0.0 109.733 179.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.6 mp -88.24 -10.39 49.86 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.837 -0.54 . . . . 0.0 110.18 178.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 5.3 tppt? -80.55 -32.75 36.6 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.388 -0.82 . . . . 0.0 109.202 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -67.94 -60.23 2.66 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 120.071 -0.652 . . . . 0.0 109.401 179.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.0 mmmt -57.37 -24.78 57.41 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.604 -0.685 . . . . 0.0 110.598 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.42 ' CD2' ' HB3' ' A' ' 12' ' ' PRO . 12.8 t80 -73.27 -66.58 0.67 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.388 -0.82 . . . . 0.0 109.48 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -61.43 -16.23 44.8 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.848 -0.533 . . . . 0.0 111.38 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.8 ttmm -97.76 -24.19 15.57 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.176 -0.952 . . . . 0.0 111.231 -179.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -103.83 -30.1 10.58 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.398 -0.814 . . . . 0.0 110.862 -179.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 7.7 tp -63.97 -27.45 42.84 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.839 0 O-C-N 121.368 -0.832 . . . . 0.0 110.313 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.15 -56.45 9.89 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.573 -0.705 . . . . 0.0 109.635 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.21 -24.37 66.6 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.688 -0.633 . . . . 0.0 109.931 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -67.67 -39.82 84.47 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.564 -0.71 . . . . 0.0 109.921 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 15.1 mtt180 -96.35 11.29 35.28 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.665 -0.647 . . . . 0.0 110.979 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 52.18 85.49 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.064 -1.023 . . . . 0.0 110.851 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt . . . . . 0 N--CA 1.494 1.752 0 CA-C-O 118.062 -0.97 . . . . 0.0 110.351 -179.993 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.5 tpt . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.143 0.497 . . . . 0.0 110.18 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 52.54 59.26 4.62 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.463 -0.773 . . . . 0.0 110.752 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 75.0 tttt -170.62 67.97 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.482 -0.762 . . . . 0.0 110.005 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.6 mttm -59.88 -76.93 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.592 -0.693 . . . . 0.0 110.523 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -121.42 157.33 56.53 Favored Pre-proline 0 N--CA 1.494 1.733 0 O-C-N 121.467 -0.771 . . . . 0.0 110.783 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -73.42 -15.79 24.79 Favored 'Trans proline' 0 N--CA 1.487 1.127 0 O-C-N 123.595 1.313 . . . . 0.0 111.269 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -113.54 -22.3 10.38 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.393 -0.817 . . . . 0.0 110.387 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.401 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . . . -89.91 141.94 28.55 Favored Pre-proline 0 N--CA 1.494 1.773 0 O-C-N 121.466 -0.771 . . . . 0.0 110.099 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -74.76 126.19 9.96 Favored 'Trans proline' 0 C--N 1.318 -1.033 0 O-C-N 123.299 1.158 . . . . 0.0 110.419 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.97 -170.0 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.531 -0.731 . . . . 0.0 110.67 -179.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.72 145.61 98.15 Favored Pre-proline 0 N--CA 1.497 1.884 0 O-C-N 121.498 -0.751 . . . . 0.0 110.437 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -76.28 129.65 11.39 Favored 'Trans proline' 0 C--N 1.318 -1.027 0 O-C-N 123.393 1.207 . . . . 0.0 109.883 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -81.8 -173.65 1.86 Allowed 'Trans proline' 0 C--N 1.317 -1.113 0 O-C-N 123.264 1.139 . . . . 0.0 110.428 -179.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 60.6 p -161.7 59.64 0.26 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.567 -0.708 . . . . 0.0 110.516 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 66.82 -76.88 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.083 -1.011 . . . . 0.0 110.169 -179.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.428 ' CE2' ' CD1' ' A' ' 47' ' ' TRP . 5.5 t80 -47.74 -49.88 26.97 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.298 -0.876 . . . . 0.0 111.348 -179.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -57.99 -35.98 71.98 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.643 -0.661 . . . . 0.0 109.982 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 41.6 mt -70.9 -36.85 72.9 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.532 -0.73 . . . . 0.0 110.265 -179.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.503 ' CZ ' ' CE2' ' A' ' 23' ' ' TYR . 50.8 t80 -76.15 -54.23 7.12 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.563 -0.71 . . . . 0.0 110.497 -179.412 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 48.8 t -58.03 -51.78 68.25 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.565 -0.709 . . . . 0.0 110.616 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 72.2 p -57.84 -22.95 50.46 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.536 -0.728 . . . . 0.0 111.036 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.4 mm-40 -102.6 -24.98 13.73 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.354 -0.841 . . . . 0.0 111.446 -179.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.503 ' CE2' ' CZ ' ' A' ' 19' ' ' PHE . 10.4 m-85 -93.09 12.61 23.59 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.308 -0.87 . . . . 0.0 111.595 -179.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.49 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 3.6 mtp180 -85.76 -45.33 0.61 Allowed Pre-proline 0 N--CA 1.489 1.478 0 O-C-N 121.145 -0.972 . . . . 0.0 112.03 179.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.502 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 37.7 Cg_endo -65.83 -15.41 48.94 Favored 'Trans proline' 0 N--CA 1.49 1.318 0 O-C-N 122.883 0.938 . . . . 0.0 110.483 -179.13 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.5 tmtm? -73.4 -51.64 16.6 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 177.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 37.5 mm -52.61 -33.71 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 CA-C-O 121.465 0.65 . . . . 0.0 110.317 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.507 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 5.7 mmmm -72.18 -37.49 69.3 Favored 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.279 -177.243 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.9 t -59.13 -25.48 63.89 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.466 -0.771 . . . . 0.0 110.753 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -116.8 -23.37 8.13 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.421 -0.8 . . . . 0.0 110.873 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 37.4 m80 -120.65 96.33 48.87 Favored Pre-proline 0 N--CA 1.496 1.87 0 O-C-N 121.403 -0.81 . . . . 0.0 109.574 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -75.32 -32.66 4.86 Favored 'Trans proline' 0 C--N 1.316 -1.16 0 O-C-N 123.465 1.245 . . . . 0.0 110.464 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -80.45 -13.44 81.7 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.83 83.19 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.381 -1.07 . . . . 0.0 110.987 -179.5 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 78.2 p -74.72 170.64 15.44 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.541 -0.724 . . . . 0.0 109.78 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.2 mm -52.6 -27.7 11.79 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.155 0 O-C-N 121.218 -0.926 . . . . 0.0 110.369 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -61.56 -71.67 0.77 Allowed Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.118 -1.593 . . . . 0.0 109.118 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.417 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 7.1 t70 -67.33 -25.01 65.8 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.642 -0.917 . . . . 0.0 110.623 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 64.5 m -71.64 -46.98 57.37 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.549 -0.719 . . . . 0.0 109.962 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -52.55 -41.79 63.85 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.545 -0.722 . . . . 0.0 110.069 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -86.03 -10.15 55.52 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.72 -0.613 . . . . 0.0 111.231 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.417 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -74.21 -59.48 2.71 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.004 -1.06 . . . . 0.0 109.449 179.236 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 14.5 mt -53.51 -27.74 27.31 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.806 -0.559 . . . . 0.0 110.899 -179.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -60.34 -45.44 96.15 Favored Glycine 0 N--CA 1.496 2.669 0 N-CA-C 109.614 -1.394 . . . . 0.0 109.614 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -62.32 -48.89 77.84 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.567 -0.96 . . . . 0.0 109.878 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 17.5 mmt -60.13 -24.5 64.75 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.588 -0.695 . . . . 0.0 110.551 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . 0.428 ' CD1' ' CE2' ' A' ' 16' ' ' PHE . 72.4 t-105 -79.71 -48.93 12.84 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.537 -0.727 . . . . 0.0 109.473 179.539 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.1 t -67.66 -26.96 66.46 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.64 -0.663 . . . . 0.0 110.007 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -68.22 -44.72 75.13 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.557 -0.714 . . . . 0.0 109.596 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 19.7 mm-40 -57.17 153.3 12.06 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.618 -0.676 . . . . 0.0 110.372 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.4 t -98.34 -152.47 0.4 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.649 -0.657 . . . . 0.0 109.533 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -88.01 49.55 1.82 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.38 -0.825 . . . . 0.0 110.082 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -127.48 -49.14 1.41 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.512 -0.743 . . . . 0.0 110.289 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -67.2 -27.4 67.23 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.461 -0.774 . . . . 0.0 110.74 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.3 tttt -81.43 -36.53 29.34 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.414 -0.804 . . . . 0.0 110.713 -179.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -43.83 -52.95 13.73 Favored Pre-proline 0 N--CA 1.507 2.386 0 O-C-N 121.507 -0.745 . . . . 0.0 112.324 -178.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -78.53 -37.19 0.73 Allowed 'Trans proline' 0 C--N 1.315 -1.206 0 O-C-N 123.172 1.09 . . . . 0.0 111.073 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.59 1.42 46.1 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.433 -0.792 . . . . 0.0 112.102 -178.362 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.69 -23.86 15.76 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.023 -1.048 . . . . 0.0 110.601 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -77.85 -22.56 49.72 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.442 -0.786 . . . . 0.0 110.29 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 65.4 tttt -61.32 -43.14 99.37 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.411 -0.806 . . . . 0.0 109.944 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -74.2 -10.84 60.01 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.619 -0.676 . . . . 0.0 110.658 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -86.08 3.06 44.17 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.299 -0.875 . . . . 0.0 110.451 179.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 36.7 mmtm -105.64 -31.61 8.84 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.181 -0.949 . . . . 0.0 109.741 179.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.5 mp -82.38 1.73 35.83 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.802 -0.561 . . . . 0.0 110.624 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 65.7 tttt -91.49 -28.46 17.59 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.205 -0.934 . . . . 0.0 109.629 179.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -87.07 -10.89 51.81 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.61 -0.681 . . . . 0.0 110.613 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 34.3 mmtt -103.73 -34.19 8.67 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.336 -0.853 . . . . 0.0 109.551 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -73.78 -53.83 9.41 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.74 -0.6 . . . . 0.0 109.685 179.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -68.41 -12.31 60.96 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.7 -0.625 . . . . 0.0 111.219 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.83 -31.73 8.7 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.288 -0.882 . . . . 0.0 110.972 -179.471 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -91.22 -35.64 14.39 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.403 -0.811 . . . . 0.0 111.096 -179.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.5 tp -53.66 -38.88 35.94 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 O-C-N 121.308 -0.87 . . . . 0.0 110.95 -179.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.59 -53.41 57.92 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.497 -0.752 . . . . 0.0 110.392 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.62 -32.44 73.92 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.594 -0.691 . . . . 0.0 109.646 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.401 ' CZ ' ' HB3' ' A' ' 8' ' ' ALA . 79.7 t80 -62.23 -41.99 98.91 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.698 -0.627 . . . . 0.0 110.1 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 11.1 mtp180 -82.78 -80.68 0.17 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.57 -0.706 . . . . 0.0 110.092 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -168.53 44.11 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.306 -0.871 . . . . 0.0 110.199 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 22.6 mtmt . . . . . 0 N--CA 1.493 1.701 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.276 -179.944 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.7 ttt . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 121.119 0.485 . . . . 0.0 110.2 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -98.3 84.46 3.24 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.52 -0.737 . . . . 0.0 110.253 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.8 ttpt -60.01 -48.79 80.24 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.558 -0.714 . . . . 0.0 110.289 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 35.2 mttp -60.01 -74.75 0.07 Allowed 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.597 -0.689 . . . . 0.0 110.4 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -167.35 158.76 10.24 Favored Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.457 -0.777 . . . . 0.0 110.353 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.98 -39.71 2.14 Favored 'Trans proline' 0 C--N 1.318 -1.048 0 O-C-N 123.359 1.189 . . . . 0.0 110.296 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 11.0 p30 -78.94 -7.58 58.14 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.61 -0.681 . . . . 0.0 111.108 -179.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -95.16 135.47 23.4 Favored Pre-proline 0 N--CA 1.494 1.725 0 O-C-N 121.23 -0.918 . . . . 0.0 109.44 179.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -72.3 102.41 1.37 Allowed 'Trans proline' 0 C--N 1.318 -1.05 0 O-C-N 123.189 1.1 . . . . 0.0 110.688 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.61 -161.03 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.638 -0.663 . . . . 0.0 109.974 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.33 140.96 93.13 Favored Pre-proline 0 N--CA 1.497 1.921 0 O-C-N 121.236 -0.915 . . . . 0.0 110.099 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -75.24 135.52 18.75 Favored 'Trans proline' 0 C--N 1.318 -1.077 0 O-C-N 123.314 1.165 . . . . 0.0 109.767 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -80.04 -177.32 3.73 Favored 'Trans proline' 0 C--N 1.317 -1.092 0 O-C-N 123.285 1.15 . . . . 0.0 110.262 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.2 t -159.36 59.5 0.4 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.418 -0.801 . . . . 0.0 110.47 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 67.6 -75.53 0.06 Allowed 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.196 -0.94 . . . . 0.0 110.172 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -48.49 -48.73 37.82 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.333 -0.855 . . . . 0.0 111.271 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -59.66 -41.41 90.53 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.511 -0.743 . . . . 0.0 109.189 179.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.1 mt -62.05 -46.3 89.75 Favored 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.993 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -64.31 -50.37 68.09 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.603 -0.686 . . . . 0.0 110.006 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.6 t -68.64 -19.01 64.4 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.59 -0.693 . . . . 0.0 110.28 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.7 t -76.95 -17.69 58.74 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.286 -0.884 . . . . 0.0 111.725 -178.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -128.58 -14.45 4.65 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.02 -1.05 . . . . 0.0 112.776 -178.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -87.92 13.85 10.06 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 120.944 -1.097 . . . . 0.0 111.671 -179.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.479 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 11.2 mtp180 -87.53 -45.97 0.5 Allowed Pre-proline 0 N--CA 1.49 1.556 0 O-C-N 121.162 -0.961 . . . . 0.0 112.386 179.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.498 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.1 Cg_endo -65.92 -15.97 50.9 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 O-C-N 122.981 0.99 . . . . 0.0 110.663 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.9 tmtt? -73.28 -52.34 14.31 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 177.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 42.1 mm -52.53 -30.98 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 CA-C-O 121.36 0.6 . . . . 0.0 110.439 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.498 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 6.2 mmmm -73.11 -36.78 66.82 Favored 'General case' 0 N--CA 1.498 1.945 0 C-N-CA 120.111 -0.636 . . . . 0.0 110.334 -177.246 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.2 t -58.7 -25.26 62.69 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.429 -0.795 . . . . 0.0 110.679 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -118.26 -22.84 7.52 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.515 -0.741 . . . . 0.0 110.949 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 34.4 m80 -121.11 96.54 48.34 Favored Pre-proline 0 N--CA 1.496 1.863 0 O-C-N 121.281 -0.887 . . . . 0.0 109.669 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -75.23 -35.58 2.91 Favored 'Trans proline' 0 C--N 1.315 -1.192 0 O-C-N 123.426 1.224 . . . . 0.0 110.513 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.78 -11.27 85.59 Favored Glycine 0 N--CA 1.492 2.409 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.44 80.91 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.209 -1.171 . . . . 0.0 110.55 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.4 t -75.03 173.69 10.38 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.522 -0.737 . . . . 0.0 109.485 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 39.0 mm -51.08 -32.02 11.59 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.213 0 O-C-N 121.187 -0.946 . . . . 0.0 110.503 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.6 -74.4 0.37 Allowed Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.223 -1.551 . . . . 0.0 109.223 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.97 -23.24 67.33 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.657 -0.908 . . . . 0.0 110.85 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 38.9 m -72.24 -46.22 56.93 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.366 -0.834 . . . . 0.0 109.904 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -53.34 -49.48 67.01 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.416 -0.803 . . . . 0.0 110.073 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.97 -12.37 60.33 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.763 -0.586 . . . . 0.0 111.152 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.57 -57.93 3.66 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.154 -0.966 . . . . 0.0 109.631 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 22.2 mt -54.5 -34.6 61.94 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.725 -0.609 . . . . 0.0 111.064 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -61.02 -49.68 75.86 Favored Glycine 0 N--CA 1.494 2.558 0 N-CA-C 109.974 -1.25 . . . . 0.0 109.974 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -53.69 -35.59 61.27 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.401 -1.058 . . . . 0.0 110.833 -179.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 20.2 mmt -69.1 -50.95 43.55 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.621 -0.674 . . . . 0.0 109.488 179.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 31.2 t-105 -51.37 -58.31 6.59 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.708 -0.62 . . . . 0.0 110.818 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 12.6 t -60.97 -34.57 74.97 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.517 -0.739 . . . . 0.0 110.382 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -58.48 -41.6 85.65 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.576 -0.702 . . . . 0.0 110.432 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 41.7 mm-40 -67.17 167.79 11.47 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.46 -0.775 . . . . 0.0 110.029 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.1 m -141.06 96.09 2.94 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.53 -0.731 . . . . 0.0 110.506 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 51.84 46.4 26.63 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.409 -0.807 . . . . 0.0 111.133 179.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 11.3 tmtt? -141.48 -63.03 0.46 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.538 -0.726 . . . . 0.0 110.254 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -61.89 -17.45 56.64 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.581 -0.699 . . . . 0.0 110.904 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 53.1 tttm -99.29 -32.38 11.22 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.238 -0.913 . . . . 0.0 110.765 -179.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.412 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 7.4 mt-30 -43.51 -56.72 6.54 Favored Pre-proline 0 N--CA 1.508 2.461 0 O-C-N 121.469 -0.769 . . . . 0.0 112.273 -178.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.412 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.4 Cg_endo -78.75 -35.14 1.11 Allowed 'Trans proline' 0 C--N 1.316 -1.18 0 O-C-N 123.059 1.031 . . . . 0.0 110.658 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -83.85 5.8 23.85 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.445 -0.784 . . . . 0.0 112.186 -178.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -101.35 -21.36 14.86 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 120.965 -1.084 . . . . 0.0 110.625 179.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -78.88 -23.55 44.77 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.422 -0.798 . . . . 0.0 110.277 179.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 48.3 tttm -62.91 -41.35 99.43 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.479 -0.763 . . . . 0.0 109.985 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.12 -9.21 57.67 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.596 -0.69 . . . . 0.0 110.896 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -89.07 4.57 47.94 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.232 -0.917 . . . . 0.0 110.646 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -105.89 -32.61 8.27 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.128 -0.982 . . . . 0.0 109.611 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.9 mp -79.3 1.18 25.88 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.826 -0.546 . . . . 0.0 111.034 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 72.7 tttt -93.2 -23.37 18.57 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.161 -0.962 . . . . 0.0 109.957 179.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -85.24 -12.66 52.0 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.377 -0.827 . . . . 0.0 110.654 179.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -102.8 -31.24 10.4 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.327 -0.858 . . . . 0.0 109.52 179.474 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 22.2 t80 -74.65 -55.08 6.27 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.799 -0.563 . . . . 0.0 109.671 179.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -66.3 -12.31 55.74 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.756 -0.59 . . . . 0.0 111.437 -179.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -103.68 -31.13 10.03 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.187 -0.945 . . . . 0.0 110.612 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -92.38 -31.12 15.45 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.445 -0.785 . . . . 0.0 110.955 -179.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.6 tp -66.61 -20.21 26.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 121.361 -0.837 . . . . 0.0 110.839 -179.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.72 -47.66 71.63 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.293 -0.879 . . . . 0.0 109.847 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -82.78 -22.24 34.34 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.679 -0.638 . . . . 0.0 110.421 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -63.3 -36.6 84.22 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.447 -0.783 . . . . 0.0 110.097 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 36.3 mtt180 -95.73 17.43 15.05 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.528 -0.733 . . . . 0.0 110.778 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -93.47 46.3 1.19 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.254 -0.904 . . . . 0.0 110.189 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.8 ptmt . . . . . 0 N--CA 1.495 1.821 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.29 -179.988 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.4 tpp . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.053 0.454 . . . . 0.0 110.22 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.9 mttm -86.34 171.9 10.84 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.52 -0.738 . . . . 0.0 110.284 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -174.31 -36.1 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.496 -0.752 . . . . 0.0 110.57 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 20.8 mmtt -49.69 -71.62 0.06 Allowed 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.315 -0.865 . . . . 0.0 111.362 -179.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -172.29 154.95 3.36 Favored Pre-proline 0 N--CA 1.498 1.949 0 O-C-N 121.391 -0.818 . . . . 0.0 110.159 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -73.31 -31.91 8.76 Favored 'Trans proline' 0 C--N 1.318 -1.044 0 O-C-N 123.449 1.236 . . . . 0.0 110.28 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -79.11 -18.57 53.03 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.552 -0.718 . . . . 0.0 110.741 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -100.28 103.52 23.81 Favored Pre-proline 0 N--CA 1.495 1.776 0 O-C-N 121.394 -0.817 . . . . 0.0 109.658 179.486 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.415 ' O ' ' CD1' ' A' ' 69' ' ' TYR . 55.6 Cg_endo -76.83 53.43 4.11 Favored 'Trans proline' 0 N--CA 1.488 1.174 0 O-C-N 123.167 1.088 . . . . 0.0 111.515 -179.456 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.5 tptt -71.97 164.22 26.48 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.021 -1.05 . . . . 0.0 110.228 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 49.17 94.83 0.04 OUTLIER Pre-proline 0 N--CA 1.5 2.056 0 O-C-N 121.579 -0.701 . . . . 0.0 111.604 179.705 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -73.52 136.51 23.83 Favored 'Trans proline' 0 C--N 1.316 -1.176 0 O-C-N 123.431 1.227 . . . . 0.0 109.769 179.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -79.96 167.89 19.63 Favored 'Trans proline' 0 C--N 1.316 -1.134 0 O-C-N 123.273 1.144 . . . . 0.0 110.362 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 57.5 p -161.37 66.38 0.28 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.569 -0.707 . . . . 0.0 110.456 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 65.79 -77.5 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.166 -0.958 . . . . 0.0 110.015 -179.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -51.13 -42.63 60.86 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.246 -0.908 . . . . 0.0 110.924 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -63.99 -25.04 67.95 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.617 -0.677 . . . . 0.0 109.966 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 41.7 mt -84.6 -39.06 19.16 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.508 -0.745 . . . . 0.0 110.363 -179.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.501 ' CE2' ' CZ ' ' A' ' 23' ' ' TYR . 44.5 t80 -69.32 -50.44 46.52 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.578 -0.701 . . . . 0.0 110.464 -179.5 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 35.5 t -65.95 -33.46 75.86 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.541 -0.724 . . . . 0.0 110.083 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 29.4 t -82.16 1.17 37.51 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.513 -0.742 . . . . 0.0 111.599 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -133.96 1.9 3.33 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.975 -1.078 . . . . 0.0 111.881 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.501 ' CZ ' ' CE2' ' A' ' 19' ' ' PHE . 8.6 m-85 -110.88 -27.02 9.01 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 120.969 -1.082 . . . . 0.0 110.878 -179.646 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.503 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 18.5 mtp180 -49.14 -52.03 51.41 Favored Pre-proline 0 N--CA 1.497 1.916 0 O-C-N 121.326 -0.859 . . . . 0.0 112.252 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 35.7 Cg_endo -59.37 -29.11 89.34 Favored 'Trans proline' 0 N--CA 1.495 1.576 0 O-C-N 123.171 1.09 . . . . 0.0 110.28 -179.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.8 tmtm? -68.26 -43.75 77.13 Favored 'General case' 0 N--CA 1.493 1.675 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 178.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.1 mm -60.99 -30.27 47.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.177 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.515 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 5.1 mmmm -73.14 -38.2 66.35 Favored 'General case' 0 N--CA 1.497 1.881 0 C-N-CA 119.937 -0.705 . . . . 0.0 110.633 -177.113 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 13.8 t -56.94 -26.83 60.32 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.324 -0.86 . . . . 0.0 110.707 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -114.86 -24.65 8.56 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.567 -0.708 . . . . 0.0 110.738 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 30.5 m80 -120.63 95.69 48.96 Favored Pre-proline 0 N--CA 1.497 1.897 0 O-C-N 121.464 -0.773 . . . . 0.0 109.649 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -75.06 -41.49 0.64 Allowed 'Trans proline' 0 C--N 1.315 -1.193 0 O-C-N 123.409 1.215 . . . . 0.0 110.19 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.416 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -69.07 -19.93 74.31 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 110.077 -1.209 . . . . 0.0 110.077 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.42 84.98 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.528 -0.983 . . . . 0.0 111.175 -179.397 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.416 ' N ' ' O ' ' A' ' 33' ' ' GLY . 71.9 p -73.27 175.81 6.52 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.452 -0.78 . . . . 0.0 109.657 179.732 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 43.5 mm -56.31 -32.64 35.8 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 O-C-N 121.395 -0.816 . . . . 0.0 110.128 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.7 -65.18 3.67 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.26 -1.536 . . . . 0.0 109.26 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -68.37 -36.55 79.36 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.56 -0.965 . . . . 0.0 110.299 179.573 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 93.8 m -63.29 -29.93 71.16 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.448 -0.782 . . . . 0.0 110.063 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.75 -44.89 39.44 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.559 -0.713 . . . . 0.0 109.795 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -86.71 -11.78 50.19 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.606 -0.684 . . . . 0.0 111.892 -179.22 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.5 tptt -87.83 6.75 33.81 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 120.813 -1.18 . . . . 0.0 110.495 179.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.9 mt -101.08 -27.76 13.08 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.193 -0.942 . . . . 0.0 109.515 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -68.96 -28.25 73.19 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.168 -1.573 . . . . 0.0 109.168 179.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -57.5 -54.9 41.62 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.445 -1.032 . . . . 0.0 109.875 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 33.6 mtt -68.48 -52.33 33.53 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 120.125 -0.63 . . . . 0.0 109.398 179.203 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . 0.413 ' CH2' ' HG2' ' A' ' 55' ' ' LYS . 54.6 t-105 -50.77 -58.02 6.96 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.49 -0.756 . . . . 0.0 110.936 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 26.6 t -59.19 -34.2 71.85 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.435 -0.791 . . . . 0.0 110.39 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -61.73 -40.88 96.64 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.596 -0.69 . . . . 0.0 109.973 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -60.0 155.52 16.63 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.635 -0.666 . . . . 0.0 110.307 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.6 m -106.49 -152.12 0.47 Allowed 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.01 58.72 3.01 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.332 -0.855 . . . . 0.0 109.953 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 8.8 tttp -139.93 -52.6 0.52 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.401 -0.812 . . . . 0.0 110.211 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -62.45 -25.56 68.04 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.511 -0.743 . . . . 0.0 110.586 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.413 ' HG2' ' CH2' ' A' ' 47' ' ' TRP . 14.7 mtpt -81.57 -34.47 31.02 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.404 -0.81 . . . . 0.0 110.607 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -44.64 -52.53 17.68 Favored Pre-proline 0 N--CA 1.507 2.387 0 O-C-N 121.572 -0.705 . . . . 0.0 111.986 -179.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -78.71 -38.22 0.53 Allowed 'Trans proline' 0 C--N 1.315 -1.227 0 O-C-N 123.263 1.138 . . . . 0.0 110.85 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.1 5.0 23.97 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.51 -0.744 . . . . 0.0 112.055 -178.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.44 -23.07 15.25 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.053 -1.029 . . . . 0.0 110.363 179.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -77.48 -26.22 51.11 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.474 -0.766 . . . . 0.0 110.214 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 72.8 tttt -59.57 -42.26 92.04 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.538 -0.726 . . . . 0.0 110.115 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.48 -11.09 60.54 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.573 -0.705 . . . . 0.0 110.63 179.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.66 4.94 34.17 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.195 -0.941 . . . . 0.0 110.537 179.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 40.4 mmtt -105.82 -34.79 7.55 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.198 -0.939 . . . . 0.0 109.309 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.6 mp -82.36 -2.34 52.62 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.828 -0.545 . . . . 0.0 110.362 178.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 30.0 tptt -83.3 -33.94 25.83 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.27 -0.894 . . . . 0.0 109.112 179.166 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -67.7 -61.73 1.75 Allowed 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.168 179.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -58.87 -18.54 33.75 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.736 -0.602 . . . . 0.0 111.067 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.415 ' CD1' ' O ' ' A' ' 9' ' ' PRO . 9.5 t80 -78.49 -60.38 2.4 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.229 -0.919 . . . . 0.0 109.494 179.465 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -76.71 -1.04 25.89 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.599 -0.688 . . . . 0.0 111.561 -179.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.7 ttmt -113.0 -37.61 4.75 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.995 -1.066 . . . . 0.0 111.228 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -86.93 -31.19 20.82 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.417 -0.802 . . . . 0.0 111.284 -179.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.0 tp -65.25 -17.33 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.434 -0.791 . . . . 0.0 111.129 -179.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.58 -48.28 64.61 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.344 -0.847 . . . . 0.0 109.87 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -88.21 -24.75 23.19 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.668 -0.645 . . . . 0.0 110.144 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 48.6 t80 -61.87 -31.39 71.66 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.504 -0.747 . . . . 0.0 110.275 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 29.7 mtt180 -71.26 -73.82 0.17 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.543 -0.723 . . . . 0.0 110.123 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 57.23 103.87 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.435 -0.791 . . . . 0.0 110.505 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 20.1 mttt . . . . . 0 N--CA 1.493 1.678 0 CA-C-O 118.067 -0.968 . . . . 0.0 110.212 179.939 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.9 ttp . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.086 0.469 . . . . 0.0 110.191 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.11 145.19 30.87 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.608 -0.683 . . . . 0.0 110.181 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -169.93 -65.31 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.528 -0.733 . . . . 0.0 110.125 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 16.6 mmmt -68.0 -74.97 0.11 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.556 -0.715 . . . . 0.0 110.18 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -156.15 126.97 3.51 Favored Pre-proline 0 N--CA 1.493 1.711 0 O-C-N 121.552 -0.718 . . . . 0.0 109.986 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -72.43 -37.53 4.22 Favored 'Trans proline' 0 N--CA 1.486 1.06 0 O-C-N 123.127 1.067 . . . . 0.0 110.388 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -80.03 -6.47 57.66 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.618 -0.676 . . . . 0.0 111.172 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -103.51 136.05 19.28 Favored Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.106 -0.996 . . . . 0.0 110.205 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.404 ' O ' ' CD1' ' A' ' 69' ' ' TYR . 49.2 Cg_endo -77.07 89.1 1.34 Allowed 'Trans proline' 0 C--N 1.319 -0.986 0 O-C-N 123.191 1.101 . . . . 0.0 110.268 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.1 pttp -99.66 30.59 3.56 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.479 -0.763 . . . . 0.0 110.853 -179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.53 100.57 0.43 Allowed Pre-proline 0 N--CA 1.497 1.896 0 O-C-N 121.7 -0.625 . . . . 0.0 110.811 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -76.26 118.69 5.03 Favored 'Trans proline' 0 C--N 1.319 -1.02 0 O-C-N 123.263 1.138 . . . . 0.0 110.1 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -81.93 166.41 16.95 Favored 'Trans proline' 0 C--N 1.318 -1.077 0 O-C-N 123.236 1.124 . . . . 0.0 110.446 -179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.4 t -156.69 54.78 0.54 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.466 -0.771 . . . . 0.0 110.582 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 67.99 -76.23 0.06 Allowed 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.256 -0.902 . . . . 0.0 109.965 -179.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -48.81 -49.91 36.84 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.357 -0.839 . . . . 0.0 111.378 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.03 -40.73 81.62 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.541 -0.724 . . . . 0.0 109.629 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 59.9 mt -60.52 -48.07 83.37 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.695 -0.628 . . . . 0.0 110.159 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.409 ' CZ ' ' CE1' ' A' ' 23' ' ' TYR . 60.6 t80 -66.88 -50.19 63.27 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.674 -0.641 . . . . 0.0 110.443 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.5 m -64.07 -31.93 73.3 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.507 -0.746 . . . . 0.0 109.966 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.0 m -65.48 -22.9 66.79 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.636 -0.665 . . . . 0.0 110.768 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -107.2 -25.71 11.4 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.405 -0.809 . . . . 0.0 111.55 -179.148 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.409 ' CE1' ' CZ ' ' A' ' 19' ' ' PHE . 0.6 OUTLIER -83.21 -34.75 25.83 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.13 -0.981 . . . . 0.0 110.928 -179.133 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.492 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 35.5 mtt180 -48.43 -53.18 37.25 Favored Pre-proline 0 N--CA 1.498 1.925 0 O-C-N 121.275 -0.89 . . . . 0.0 112.022 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.492 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 36.4 Cg_endo -59.93 -27.09 84.16 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 O-C-N 123.169 1.089 . . . . 0.0 110.182 179.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.4 tmtt? -69.55 -44.83 70.12 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.1 mm -59.08 -35.0 54.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 CA-C-O 121.084 0.468 . . . . 0.0 110.094 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.536 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 4.8 mmmm -70.15 -39.92 75.08 Favored 'General case' 0 N--CA 1.497 1.908 0 C-N-CA 120.09 -0.644 . . . . 0.0 110.43 -177.173 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.9 t -57.67 -25.64 60.54 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.348 -0.845 . . . . 0.0 110.891 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -114.0 -23.62 9.47 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.508 -0.745 . . . . 0.0 110.654 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 43.6 m80 -120.7 96.06 48.87 Favored Pre-proline 0 N--CA 1.495 1.784 0 O-C-N 121.414 -0.804 . . . . 0.0 109.482 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -74.96 -36.25 2.7 Favored 'Trans proline' 0 C--N 1.316 -1.161 0 O-C-N 123.462 1.243 . . . . 0.0 110.351 -179.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.4 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -75.3 -16.73 80.44 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 110.174 -1.17 . . . . 0.0 110.174 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.86 83.88 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.486 -1.008 . . . . 0.0 111.255 -179.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 33' ' ' GLY . 19.9 m -75.71 172.89 11.86 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.502 -0.749 . . . . 0.0 109.758 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.5 mm -54.6 -28.36 19.17 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.113 0 O-C-N 121.34 -0.85 . . . . 0.0 110.228 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.18 -70.67 0.94 Allowed Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.146 -1.582 . . . . 0.0 109.146 179.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -67.49 -31.99 72.5 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.672 -0.899 . . . . 0.0 110.388 179.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 78.2 m -65.78 -29.93 70.5 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.457 -0.777 . . . . 0.0 109.913 179.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.16 -44.32 60.19 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.638 -0.664 . . . . 0.0 109.566 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -86.92 -13.39 44.89 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.646 -0.659 . . . . 0.0 111.78 -179.36 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.0 tptt -86.23 6.54 29.05 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 120.941 -1.1 . . . . 0.0 110.696 179.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.8 mt -102.1 -28.58 12.25 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.107 -0.996 . . . . 0.0 109.495 179.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -70.4 -29.7 69.8 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.092 -1.603 . . . . 0.0 109.092 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -55.41 -49.83 71.36 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.475 -1.014 . . . . 0.0 110.22 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 31.3 mmt -73.75 -49.72 24.13 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.663 -0.648 . . . . 0.0 109.643 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 62.2 t-105 -51.71 -59.27 4.49 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.479 -0.763 . . . . 0.0 110.847 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.0 t -61.52 -33.39 73.72 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.479 -0.763 . . . . 0.0 110.274 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -59.58 -39.74 85.11 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.54 -0.725 . . . . 0.0 110.284 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -63.48 162.37 12.76 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.579 -0.701 . . . . 0.0 110.297 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 81.1 p -96.18 -147.37 0.29 Allowed 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -85.72 51.85 2.31 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.152 -0.968 . . . . 0.0 110.095 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 9.8 tptp -125.23 -42.82 1.97 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.42 -0.8 . . . . 0.0 110.121 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -62.34 -37.07 84.23 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.563 -0.71 . . . . 0.0 110.728 -179.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 22.0 tttp -91.03 19.9 5.33 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.375 -0.828 . . . . 0.0 111.348 -179.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.444 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 0.7 OUTLIER -94.25 -57.21 0.22 Allowed Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.012 -1.055 . . . . 0.0 110.341 179.888 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.444 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 57.0 Cg_endo -83.28 -31.26 0.68 Allowed 'Trans proline' 0 N--CA 1.484 0.95 0 O-C-N 122.998 0.999 . . . . 0.0 110.577 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -82.33 2.02 34.2 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.49 -0.757 . . . . 0.0 112.004 -178.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -96.72 -21.92 17.29 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.035 -1.041 . . . . 0.0 110.736 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -82.36 -24.64 34.39 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.425 -0.797 . . . . 0.0 110.201 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 71.0 tttt -62.89 -45.0 94.6 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.514 -0.741 . . . . 0.0 109.846 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -74.27 -10.24 59.4 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.623 -0.673 . . . . 0.0 110.835 179.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.87 0.65 52.53 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.256 -0.902 . . . . 0.0 110.372 179.163 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.79 -30.43 9.41 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.225 -0.922 . . . . 0.0 109.92 179.494 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 6.5 mp -83.22 -7.16 59.65 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.89 -0.506 . . . . 0.0 110.401 179.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.7 ttpt -81.34 -27.33 34.98 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.272 -0.892 . . . . 0.0 109.457 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -85.22 -6.29 59.28 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.674 -0.641 . . . . 0.0 110.363 179.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 36.6 mmtm -105.38 -35.24 7.57 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.367 -0.833 . . . . 0.0 108.888 178.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.404 ' CD1' ' O ' ' A' ' 9' ' ' PRO . 35.8 t80 -75.5 -57.2 4.03 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 179.392 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -57.69 -19.73 29.08 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.665 -0.647 . . . . 0.0 111.218 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 33.2 mmtm -102.75 -24.62 13.71 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.32 -0.863 . . . . 0.0 111.287 -179.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -98.79 -36.53 9.78 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.33 -0.856 . . . . 0.0 111.314 -179.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.7 tp -70.53 -26.61 28.99 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.304 -0.873 . . . . 0.0 110.616 -179.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.19 -45.07 96.09 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.455 -0.778 . . . . 0.0 109.992 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.98 -16.98 36.61 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.709 -0.62 . . . . 0.0 110.615 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -81.44 -32.04 32.83 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.318 -0.864 . . . . 0.0 110.196 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 29.5 mtt180 -100.73 1.38 40.35 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.624 -0.672 . . . . 0.0 111.176 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -71.27 77.17 0.73 Allowed 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.162 -0.961 . . . . 0.0 110.161 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.8 mptt . . . . . 0 N--CA 1.496 1.85 0 CA-C-O 117.955 -1.021 . . . . 0.0 110.165 179.977 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 34.8 ttm . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 121.086 0.469 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.9 mttm -103.36 170.77 7.75 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.565 -0.71 . . . . 0.0 110.307 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -170.05 64.03 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.592 -0.692 . . . . 0.0 110.083 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 16.3 pttm -85.71 -168.01 2.06 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.541 -0.724 . . . . 0.0 110.128 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -48.54 149.56 2.84 Favored Pre-proline 0 N--CA 1.501 2.116 0 O-C-N 121.622 -0.674 . . . . 0.0 111.259 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -75.92 -30.25 6.08 Favored 'Trans proline' 0 C--N 1.319 -1.017 0 O-C-N 123.465 1.245 . . . . 0.0 111.139 -179.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -114.85 24.71 11.53 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.281 -0.887 . . . . 0.0 111.057 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -105.7 90.8 4.5 Favored Pre-proline 0 N--CA 1.496 1.833 0 O-C-N 121.427 -0.796 . . . . 0.0 110.095 179.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -72.03 81.67 1.38 Allowed 'Trans proline' 0 C--N 1.316 -1.148 0 O-C-N 123.205 1.108 . . . . 0.0 110.543 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.1 tptt -60.93 -157.39 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.651 -0.656 . . . . 0.0 110.143 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -49.47 140.22 13.94 Favored Pre-proline 0 N--CA 1.502 2.169 0 O-C-N 121.269 -0.895 . . . . 0.0 111.227 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.417 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.0 Cg_endo -76.83 128.69 10.23 Favored 'Trans proline' 0 C--N 1.318 -1.032 0 O-C-N 123.276 1.145 . . . . 0.0 110.263 -179.803 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -82.18 179.46 5.51 Favored 'Trans proline' 0 C--N 1.319 -1.022 0 O-C-N 123.212 1.111 . . . . 0.0 110.23 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -163.17 65.3 0.18 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.554 -0.716 . . . . 0.0 110.257 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 67.02 -76.63 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.185 0 O-C-N 121.183 -0.948 . . . . 0.0 109.938 -179.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.415 ' CD2' ' CD1' ' A' ' 47' ' ' TRP . 6.6 t80 -51.78 -43.22 62.93 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.249 -0.907 . . . . 0.0 111.022 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -63.77 -30.25 71.37 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.612 -0.68 . . . . 0.0 109.386 179.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 58.2 mt -75.28 -43.97 48.3 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.589 -0.695 . . . . 0.0 110.037 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -65.56 -48.28 72.96 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.627 -0.671 . . . . 0.0 110.077 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 12.0 t -65.93 -29.5 69.93 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.564 -0.71 . . . . 0.0 109.771 179.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.5 t -90.52 7.12 40.6 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.578 -0.701 . . . . 0.0 111.653 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -138.79 0.75 2.03 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 120.973 -1.08 . . . . 0.0 112.11 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -123.58 22.08 9.2 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 120.872 -1.142 . . . . 0.0 110.905 -179.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.473 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 8.6 mtt180 -85.47 -45.98 0.63 Allowed Pre-proline 0 N--CA 1.488 1.439 0 O-C-N 121.447 -0.783 . . . . 0.0 112.064 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.489 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.3 Cg_endo -66.57 -15.44 47.67 Favored 'Trans proline' 0 N--CA 1.491 1.341 0 O-C-N 122.853 0.922 . . . . 0.0 110.613 -179.286 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? -73.39 -50.84 19.75 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 178.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 30.1 mm -54.51 -33.52 26.86 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.942 0 CA-C-O 121.298 0.57 . . . . 0.0 110.263 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.508 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 5.2 mmmm -71.27 -37.12 71.92 Favored 'General case' 0 N--CA 1.498 1.953 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.147 -177.26 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 24.8 t -58.6 -25.61 62.79 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.422 -0.799 . . . . 0.0 110.637 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -115.29 -24.22 8.55 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.55 -0.719 . . . . 0.0 110.618 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 41.2 m80 -119.63 96.56 49.72 Favored Pre-proline 0 N--CA 1.496 1.864 0 O-C-N 121.45 -0.781 . . . . 0.0 109.568 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -75.37 -28.42 8.6 Favored 'Trans proline' 0 C--N 1.315 -1.233 0 O-C-N 123.4 1.211 . . . . 0.0 110.502 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -84.44 -13.55 73.15 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.39 82.36 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.356 -1.085 . . . . 0.0 111.019 -179.441 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.1 t -69.74 170.19 11.43 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.487 -0.758 . . . . 0.0 109.977 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 38.6 mm -52.7 -30.08 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.262 -0.899 . . . . 0.0 110.264 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.0 -65.88 3.1 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.33 -1.508 . . . . 0.0 109.33 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -69.55 -30.49 68.3 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.617 -0.931 . . . . 0.0 110.591 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.2 m -63.76 -29.32 70.54 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.331 -0.856 . . . . 0.0 110.249 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.41 -44.8 27.9 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.576 -0.702 . . . . 0.0 110.169 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -86.02 -13.28 47.95 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.554 -0.716 . . . . 0.0 111.669 -179.398 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.9 tptt -76.88 -59.69 2.67 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.055 -1.028 . . . . 0.0 109.718 179.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 45.1 mt -48.67 -25.12 1.62 Allowed 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.474 -0.766 . . . . 0.0 111.458 -179.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -71.08 -36.98 64.14 Favored Glycine 0 N--CA 1.492 2.403 0 N-CA-C 109.051 -1.62 . . . . 0.0 109.051 179.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -53.86 -38.18 64.42 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.577 -0.955 . . . . 0.0 110.746 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 28.3 mtp -76.41 -49.69 16.09 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.599 -0.688 . . . . 0.0 109.861 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . 0.415 ' CD1' ' CD2' ' A' ' 16' ' ' PHE . 57.6 t-105 -49.99 -53.39 26.86 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.527 -0.733 . . . . 0.0 111.067 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.3 t -59.34 -36.14 75.14 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.447 -0.783 . . . . 0.0 110.459 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -62.29 -39.29 92.46 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.612 -0.68 . . . . 0.0 110.046 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -57.52 154.21 11.56 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.546 -0.721 . . . . 0.0 110.539 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.1 m -102.01 -151.55 0.42 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.694 -0.629 . . . . 0.0 109.457 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.06 52.48 2.53 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.306 -0.871 . . . . 0.0 110.124 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -132.54 -51.75 0.93 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.408 -0.808 . . . . 0.0 110.034 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -64.95 -25.0 67.69 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.687 -0.633 . . . . 0.0 110.47 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 37.7 tttp -81.09 -35.33 31.8 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.524 -0.735 . . . . 0.0 110.534 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -44.23 -52.75 15.57 Favored Pre-proline 0 N--CA 1.507 2.391 0 O-C-N 121.498 -0.751 . . . . 0.0 112.048 -179.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -78.41 -37.42 0.72 Allowed 'Trans proline' 0 C--N 1.315 -1.189 0 O-C-N 123.232 1.122 . . . . 0.0 111.045 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -84.85 4.67 32.11 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.344 -0.847 . . . . 0.0 112.146 -178.433 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -101.02 -24.15 14.38 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.002 -1.061 . . . . 0.0 110.552 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -75.28 -23.32 57.4 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.446 -0.784 . . . . 0.0 110.284 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 66.7 tttt -60.42 -41.66 94.39 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.561 -0.712 . . . . 0.0 110.145 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.41 -11.51 60.49 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.494 -0.754 . . . . 0.0 110.569 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -83.69 2.62 36.83 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.222 -0.923 . . . . 0.0 110.383 179.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 26.6 mmtm -105.33 -32.12 8.74 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.196 -0.94 . . . . 0.0 109.742 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 6.2 mp -83.57 1.73 40.67 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.832 -0.543 . . . . 0.0 110.685 179.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 74.4 tttt -92.28 -32.02 15.18 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.232 -0.918 . . . . 0.0 109.508 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -83.53 -12.8 55.75 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.658 -0.651 . . . . 0.0 110.56 179.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -105.07 -28.19 11.18 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.318 -0.864 . . . . 0.0 109.464 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.417 ' CE2' ' HD3' ' A' ' 12' ' ' PRO . 17.5 t80 -76.74 -54.54 6.5 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.775 -0.578 . . . . 0.0 109.6 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -64.04 -14.2 52.65 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.578 -0.702 . . . . 0.0 111.348 -179.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt -106.79 -29.96 9.21 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.26 -0.9 . . . . 0.0 111.125 -179.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -96.02 -34.34 11.8 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.289 -0.882 . . . . 0.0 111.555 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 5.0 tp -63.15 -23.11 32.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.187 -0.946 . . . . 0.0 110.731 -179.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.02 -45.84 80.06 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.519 -0.738 . . . . 0.0 109.891 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -84.05 -27.76 28.09 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.631 -0.668 . . . . 0.0 110.028 179.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -65.64 -42.07 91.86 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.554 -0.716 . . . . 0.0 110.051 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 33.9 mtt85 -64.56 -74.9 0.09 Allowed 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.589 -0.694 . . . . 0.0 110.119 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 53.76 49.19 19.77 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.29 -0.881 . . . . 0.0 110.567 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 31.6 mttm . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.301 -179.987 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.079 0.466 . . . . 0.0 110.261 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.18 -57.51 3.15 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.555 -0.715 . . . . 0.0 110.079 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 75.0 tttt -59.94 106.66 0.52 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.536 -0.727 . . . . 0.0 110.36 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 43.2 mttp -60.58 -73.67 0.09 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.617 -0.677 . . . . 0.0 110.384 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -158.78 168.25 12.8 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.498 -0.751 . . . . 0.0 110.293 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.9 -49.11 0.26 Allowed 'Trans proline' 0 N--CA 1.486 1.058 0 O-C-N 123.396 1.208 . . . . 0.0 110.373 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -78.64 -8.09 58.3 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.614 -0.679 . . . . 0.0 111.167 -179.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -84.88 143.21 39.92 Favored Pre-proline 0 N--CA 1.493 1.71 0 O-C-N 121.143 -0.973 . . . . 0.0 109.309 179.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.436 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 44.4 Cg_endo -70.51 94.2 0.59 Allowed 'Trans proline' 0 C--N 1.316 -1.138 0 O-C-N 123.278 1.147 . . . . 0.0 110.656 -179.585 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.7 mtpt -67.14 -172.37 0.2 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.694 -0.628 . . . . 0.0 109.956 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.0 mtt85 -52.37 136.34 41.37 Favored Pre-proline 0 N--CA 1.5 2.071 0 O-C-N 121.309 -0.87 . . . . 0.0 110.665 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -74.51 128.85 12.23 Favored 'Trans proline' 0 C--N 1.319 -1.004 0 O-C-N 123.257 1.135 . . . . 0.0 110.262 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -82.25 174.47 9.92 Favored 'Trans proline' 0 C--N 1.317 -1.094 0 O-C-N 123.25 1.132 . . . . 0.0 110.223 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.2 t -157.14 67.44 0.53 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.427 -0.796 . . . . 0.0 110.599 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 65.61 -76.44 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.107 -0.996 . . . . 0.0 110.531 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -48.48 -43.86 35.28 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.262 -0.899 . . . . 0.0 111.229 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -63.86 -26.77 68.76 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 120.126 -0.63 . . . . 0.0 109.949 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 20.7 mt -89.23 -28.35 20.01 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.377 -0.827 . . . . 0.0 110.379 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.495 ' CZ ' ' CE2' ' A' ' 23' ' ' TYR . 36.9 t80 -76.92 -54.62 6.35 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.551 -0.718 . . . . 0.0 110.716 -179.267 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 10.7 t -63.04 -35.66 80.96 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.608 -0.682 . . . . 0.0 110.224 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 46.6 t -69.81 -19.73 63.47 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.564 -0.71 . . . . 0.0 111.063 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -111.6 -17.59 13.0 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.261 -0.899 . . . . 0.0 111.555 -179.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.495 ' CE2' ' CZ ' ' A' ' 19' ' ' PHE . 6.2 m-85 -89.0 -32.24 17.71 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.274 -0.891 . . . . 0.0 110.91 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.507 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 5.3 mtp180 -49.11 -52.23 49.55 Favored Pre-proline 0 N--CA 1.497 1.91 0 O-C-N 121.307 -0.871 . . . . 0.0 111.811 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.507 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 36.2 Cg_endo -59.55 -28.08 86.55 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 O-C-N 123.133 1.07 . . . . 0.0 110.054 179.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.8 tmtt? -69.9 -46.44 65.44 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 108.107 -1.072 . . . . 0.0 108.107 177.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 41.7 mm -56.94 -34.64 44.9 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.051 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.546 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 3.4 mmmm -70.16 -38.85 75.54 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.629 -0.67 . . . . 0.0 110.543 -177.518 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.0 t -58.29 -25.67 62.09 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.482 -0.761 . . . . 0.0 110.941 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -115.86 -24.28 8.24 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.455 -0.778 . . . . 0.0 110.853 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 40.3 m80 -119.96 96.25 49.35 Favored Pre-proline 0 N--CA 1.495 1.802 0 O-C-N 121.522 -0.736 . . . . 0.0 109.456 -179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -75.21 -29.59 7.75 Favored 'Trans proline' 0 C--N 1.315 -1.203 0 O-C-N 123.434 1.228 . . . . 0.0 110.543 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.401 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -82.72 -15.96 71.8 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.52 82.54 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.501 -1.0 . . . . 0.0 111.28 -179.333 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.401 ' N ' ' O ' ' A' ' 33' ' ' GLY . 66.4 m -69.94 -179.15 1.77 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.39 -0.818 . . . . 0.0 109.66 179.672 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 43.8 mm -56.93 -37.76 56.06 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 O-C-N 121.378 -0.826 . . . . 0.0 110.141 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -57.75 -59.39 10.91 Favored Glycine 0 N--CA 1.494 2.506 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.429 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 45.2 m-20 -67.8 -41.01 83.8 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.613 -0.933 . . . . 0.0 109.998 179.135 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 96.3 m -59.77 -26.93 66.11 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.217 -0.927 . . . . 0.0 110.271 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -83.81 -49.18 9.31 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.545 -0.722 . . . . 0.0 110.416 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -81.2 -12.33 59.19 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.548 -0.72 . . . . 0.0 111.975 -179.068 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.429 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -83.94 -61.56 1.79 Allowed 'General case' 0 N--CA 1.5 2.04 0 O-C-N 120.998 -1.064 . . . . 0.0 109.704 179.542 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 61.8 mt -52.18 -24.51 7.25 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.457 -0.777 . . . . 0.0 111.182 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.1 -39.75 83.61 Favored Glycine 0 N--CA 1.493 2.434 0 N-CA-C 109.728 -1.349 . . . . 0.0 109.728 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -56.71 -33.85 66.88 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.467 -1.019 . . . . 0.0 110.584 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 9.6 mtt -75.82 -51.26 12.96 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.601 -0.687 . . . . 0.0 110.18 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -47.69 -38.97 16.19 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.593 -0.692 . . . . 0.0 111.602 -179.233 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.0 t -81.83 -27.13 33.76 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.33 -0.856 . . . . 0.0 110.341 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -63.61 -41.95 98.27 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.544 -0.722 . . . . 0.0 110.312 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.2 169.33 7.24 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.515 -0.74 . . . . 0.0 109.941 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.6 m -155.52 107.16 2.59 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.493 -0.754 . . . . 0.0 110.529 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 51.92 42.05 29.94 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.475 -0.765 . . . . 0.0 110.915 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.9 mttm -139.3 -76.37 0.35 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.548 -0.72 . . . . 0.0 110.348 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -61.98 -25.98 67.94 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.508 -0.745 . . . . 0.0 110.701 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.4 ttpm? -82.89 -33.71 26.88 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.427 -0.795 . . . . 0.0 110.603 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -44.52 -52.17 18.36 Favored Pre-proline 0 N--CA 1.506 2.35 0 O-C-N 121.526 -0.734 . . . . 0.0 111.907 -179.168 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -79.83 -37.53 0.45 Allowed 'Trans proline' 0 C--N 1.315 -1.186 0 O-C-N 123.262 1.138 . . . . 0.0 110.804 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -84.62 8.76 15.71 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.571 -0.706 . . . . 0.0 112.034 -178.452 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.03 -24.28 13.23 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 120.955 -1.091 . . . . 0.0 110.19 179.511 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -74.87 -26.6 59.79 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.494 -0.754 . . . . 0.0 110.137 179.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 42.1 tttt -57.21 -43.3 82.67 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.569 -0.707 . . . . 0.0 110.5 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.63 -11.18 60.34 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.452 -0.78 . . . . 0.0 110.774 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.92 -3.52 57.1 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.249 -0.907 . . . . 0.0 110.515 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 64.8 mmtt -97.55 -33.16 11.46 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.254 -0.904 . . . . 0.0 109.655 179.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.9 mp -84.11 5.44 26.11 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.842 -0.536 . . . . 0.0 110.964 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -98.99 -32.79 11.11 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.333 -0.855 . . . . 0.0 109.331 179.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -63.27 -46.67 85.76 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 120.237 -0.585 . . . . 0.0 110.079 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 22.0 tptt -71.29 -63.84 1.03 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.469 -0.769 . . . . 0.0 109.6 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.436 ' CD2' ' HB2' ' A' ' 9' ' ' PRO . 24.4 t80 -36.06 -49.27 0.64 Allowed 'General case' 0 N--CA 1.509 2.486 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -179.296 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -67.16 -32.18 73.1 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.464 -0.773 . . . . 0.0 111.377 -179.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.7 ttmt -95.73 -23.79 16.81 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.323 -0.861 . . . . 0.0 111.703 -178.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -92.14 -24.9 18.95 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.291 -0.881 . . . . 0.0 111.334 -178.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.5 tp -77.29 -20.2 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 121.433 -0.792 . . . . 0.0 110.93 -179.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.61 -34.2 77.67 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.398 -0.814 . . . . 0.0 109.868 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -102.66 -14.36 16.73 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.654 -0.654 . . . . 0.0 110.635 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -63.98 -35.23 80.02 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.272 -0.892 . . . . 0.0 110.175 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 65.8 mtt180 -103.19 17.81 23.2 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.589 -0.694 . . . . 0.0 110.78 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 52.24 79.67 0.1 Allowed 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.173 -0.955 . . . . 0.0 110.892 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.781 0 CA-C-O 117.993 -1.004 . . . . 0.0 110.211 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 32.9 ttm . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 121.139 0.495 . . . . 0.0 110.274 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 52.81 -177.2 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.185 0 O-C-N 121.48 -0.763 . . . . 0.0 110.803 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 32.9 ttmt 52.87 75.41 0.24 Allowed 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.426 -0.796 . . . . 0.0 110.692 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.9 mtpm? -61.75 -77.14 0.05 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.61 -0.681 . . . . 0.0 110.463 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -104.11 159.68 28.53 Favored Pre-proline 0 N--CA 1.494 1.762 0 O-C-N 121.55 -0.719 . . . . 0.0 110.57 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -76.87 -16.22 16.32 Favored 'Trans proline' 0 N--CA 1.486 1.057 0 O-C-N 123.492 1.259 . . . . 0.0 111.863 -179.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.1 p30 -135.74 18.19 3.3 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.281 -0.887 . . . . 0.0 111.257 -179.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -105.22 125.94 32.27 Favored Pre-proline 0 N--CA 1.494 1.767 0 O-C-N 121.399 -0.813 . . . . 0.0 110.167 179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -72.36 117.72 5.27 Favored 'Trans proline' 0 N--CA 1.485 0.996 0 O-C-N 123.128 1.067 . . . . 0.0 110.229 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -128.82 31.43 4.94 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.553 -0.717 . . . . 0.0 110.514 -179.816 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.1 mtt85 -161.97 85.5 1.6 Allowed Pre-proline 0 N--CA 1.494 1.775 0 O-C-N 121.815 -0.553 . . . . 0.0 110.042 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.417 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.2 Cg_endo -82.24 118.14 2.92 Favored 'Trans proline' 0 C--N 1.317 -1.097 0 O-C-N 123.411 1.216 . . . . 0.0 110.339 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -80.45 173.56 12.23 Favored 'Trans proline' 0 C--N 1.318 -1.04 0 O-C-N 123.278 1.146 . . . . 0.0 110.099 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 41.0 t -166.84 61.29 0.09 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.5 -0.75 . . . . 0.0 110.501 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 68.27 -77.47 0.05 OUTLIER 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.127 -0.983 . . . . 0.0 110.041 -179.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -50.66 -45.28 57.87 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.194 -0.941 . . . . 0.0 110.893 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -60.84 -29.7 69.66 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 120.201 -0.599 . . . . 0.0 109.801 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.4 mt -80.68 -36.54 32.2 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.542 -0.724 . . . . 0.0 110.219 -179.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.499 ' CE2' ' CE2' ' A' ' 23' ' ' TYR . 18.1 t80 -69.41 -52.3 28.25 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.592 -0.692 . . . . 0.0 110.35 -179.588 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 4.4 t -64.43 -29.81 70.85 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.521 -0.737 . . . . 0.0 109.909 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.3 m -70.01 -15.32 63.0 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.6 -0.688 . . . . 0.0 111.536 -179.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.2 -17.64 4.25 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.034 -1.041 . . . . 0.0 112.466 -179.02 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.499 ' CE2' ' CE2' ' A' ' 19' ' ' PHE . 12.9 m-85 -91.27 15.11 12.63 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 120.949 -1.094 . . . . 0.0 111.551 -179.378 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.471 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 17.4 mtt180 -91.92 -42.36 0.37 Allowed Pre-proline 0 N--CA 1.489 1.485 0 O-C-N 121.278 -0.889 . . . . 0.0 112.476 179.429 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.494 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.2 Cg_endo -68.08 -16.19 44.37 Favored 'Trans proline' 0 N--CA 1.49 1.298 0 O-C-N 122.759 0.873 . . . . 0.0 110.386 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -73.16 -51.78 16.59 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 177.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 40.3 mm -52.54 -29.07 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 CA-C-O 121.304 0.573 . . . . 0.0 110.495 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.494 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 6.4 mmmm -75.19 -32.68 61.28 Favored 'General case' 0 N--CA 1.496 1.845 0 C-N-CA 120.091 -0.643 . . . . 0.0 110.214 -177.359 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.9 t -62.59 -25.82 68.28 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.576 -0.702 . . . . 0.0 110.422 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -118.2 -19.39 9.02 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.539 -0.726 . . . . 0.0 111.14 -179.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 34.1 m80 -124.4 95.71 42.78 Favored Pre-proline 0 N--CA 1.498 1.97 0 O-C-N 121.294 -0.878 . . . . 0.0 109.706 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -75.57 -33.95 3.7 Favored 'Trans proline' 0 C--N 1.316 -1.163 0 O-C-N 123.472 1.249 . . . . 0.0 110.248 -179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.411 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -77.03 -18.36 78.75 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.21 83.78 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.491 -1.005 . . . . 0.0 111.297 -179.287 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.411 ' N ' ' O ' ' A' ' 33' ' ' GLY . 63.9 m -75.14 171.01 14.9 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.487 -0.758 . . . . 0.0 109.848 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.0 mm -53.1 -27.57 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 121.343 -0.848 . . . . 0.0 110.303 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -61.22 -67.07 2.29 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.207 -1.557 . . . . 0.0 109.207 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -71.87 -28.55 63.61 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.529 -0.983 . . . . 0.0 110.679 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 86.8 m -65.89 -33.79 76.65 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.36 -0.838 . . . . 0.0 110.159 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.63 -39.35 67.28 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.56 -0.712 . . . . 0.0 110.276 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -91.51 -12.11 35.48 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.6 -0.687 . . . . 0.0 111.597 -179.577 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.0 tptt -77.61 -59.29 2.84 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.042 -1.036 . . . . 0.0 109.731 179.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 34.5 mt -47.28 -28.32 1.91 Allowed 'General case' 0 N--CA 1.504 2.242 0 O-C-N 121.554 -0.716 . . . . 0.0 111.416 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -64.28 -35.07 91.5 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.2 -1.56 . . . . 0.0 109.2 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -50.83 -36.08 35.66 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.535 -0.979 . . . . 0.0 111.037 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 34.0 mtt -86.62 -40.98 14.63 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.522 -0.736 . . . . 0.0 110.237 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . 0.418 ' CH2' ' HG2' ' A' ' 55' ' ' LYS . 73.1 t-105 -55.34 -22.52 19.55 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.551 -0.718 . . . . 0.0 111.028 -179.566 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 66.6 p -93.55 -33.3 13.8 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.286 -0.884 . . . . 0.0 110.166 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -63.42 -36.72 84.68 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.561 -0.712 . . . . 0.0 110.015 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -63.04 152.66 36.34 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.583 -0.698 . . . . 0.0 110.194 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 9.3 t -101.26 -152.61 0.43 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.685 -0.634 . . . . 0.0 109.423 179.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -83.51 55.44 3.2 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.397 -0.814 . . . . 0.0 110.023 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 39.6 mttt -132.24 -48.92 0.92 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.415 -0.803 . . . . 0.0 110.324 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -67.86 -28.1 67.25 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.532 -0.73 . . . . 0.0 110.774 -179.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.418 ' HG2' ' CH2' ' A' ' 47' ' ' TRP . 18.7 mtmt -79.79 -36.74 36.58 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.372 -0.83 . . . . 0.0 110.572 -179.639 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -44.22 -53.37 14.01 Favored Pre-proline 0 N--CA 1.507 2.385 0 O-C-N 121.505 -0.747 . . . . 0.0 112.33 -178.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -77.2 -37.33 1.07 Allowed 'Trans proline' 0 C--N 1.315 -1.226 0 O-C-N 123.129 1.068 . . . . 0.0 111.258 -179.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.48 -5.27 58.6 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.454 -0.779 . . . . 0.0 112.026 -178.462 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.96 -24.1 21.37 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.992 -1.068 . . . . 0.0 111.072 -179.328 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -78.47 -22.09 48.07 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.325 -0.859 . . . . 0.0 110.626 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 73.8 tttt -64.7 -42.35 95.35 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.365 -0.834 . . . . 0.0 109.803 179.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -80.86 -15.14 57.14 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.558 -0.714 . . . . 0.0 110.068 179.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.34 -35.38 75.52 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.379 -0.826 . . . . 0.0 110.029 179.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -72.62 -62.81 1.31 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.454 -0.779 . . . . 0.0 109.783 179.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.0 mp -51.22 -24.05 3.97 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.443 -0.786 . . . . 0.0 111.25 -179.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 10.9 tttt -70.36 -52.54 21.84 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.395 -0.816 . . . . 0.0 109.506 179.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -62.19 -50.33 72.25 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.609 -0.682 . . . . 0.0 109.543 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -58.45 -20.62 46.47 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.557 -0.715 . . . . 0.0 110.548 179.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.417 ' CE2' ' HD3' ' A' ' 12' ' ' PRO . 23.4 t80 -86.82 -58.31 2.65 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.449 -0.782 . . . . 0.0 110.026 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -69.37 -32.67 71.86 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.629 -0.669 . . . . 0.0 111.868 -178.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.0 mmtm -85.47 -14.34 46.4 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.267 -0.895 . . . . 0.0 111.823 -178.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -107.31 -20.69 13.2 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.143 -0.973 . . . . 0.0 111.34 -179.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.7 tp -82.14 -22.31 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.3 -0.875 . . . . 0.0 110.825 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.32 -41.16 96.95 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.384 -0.822 . . . . 0.0 109.869 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -93.17 -4.02 52.89 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.631 -0.668 . . . . 0.0 110.954 179.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -87.78 -24.68 23.7 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.117 -0.989 . . . . 0.0 110.659 -179.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 4.8 mtp85 -72.0 -79.86 0.07 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.447 -0.783 . . . . 0.0 110.343 -179.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -129.44 -144.8 0.28 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.31 -0.869 . . . . 0.0 109.729 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 11.9 mtmt . . . . . 0 N--CA 1.503 2.176 0 O-C-N 121.046 -1.034 . . . . 0.0 110.8 179.876 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.5 tpt . . . . . 0 N--CA 1.493 1.678 0 CA-C-O 121.01 0.433 . . . . 0.0 110.157 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.1 mttm -95.68 -168.16 1.73 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.549 -0.719 . . . . 0.0 110.378 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -177.09 -33.64 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.466 -0.771 . . . . 0.0 110.64 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -56.46 -168.72 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.466 -0.771 . . . . 0.0 111.207 -179.272 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.4 ' CB ' ' HD2' ' A' ' 6' ' ' PRO . 0.1 OUTLIER -147.4 -180.0 1.06 Allowed Pre-proline 0 N--CA 1.495 1.788 0 O-C-N 121.67 -0.643 . . . . 0.0 109.914 -179.518 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.4 ' HD2' ' CB ' ' A' ' 5' ' ' ASP . 43.3 Cg_endo -69.99 -35.5 11.86 Favored 'Trans proline' 0 N--CA 1.486 1.082 0 O-C-N 123.255 1.134 . . . . 0.0 110.314 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -77.92 -22.11 50.13 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.606 -0.684 . . . . 0.0 110.28 -179.362 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -105.12 134.71 19.51 Favored Pre-proline 0 N--CA 1.493 1.712 0 O-C-N 121.432 -0.793 . . . . 0.0 108.885 178.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.17 119.31 6.2 Favored 'Trans proline' 0 C--N 1.318 -1.071 0 O-C-N 123.054 1.028 . . . . 0.0 110.425 -179.463 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.48 -166.91 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.586 -0.696 . . . . 0.0 109.917 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -60.94 146.19 87.82 Favored Pre-proline 0 N--CA 1.496 1.872 0 O-C-N 121.509 -0.744 . . . . 0.0 110.085 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.418 ' HD3' ' CZ ' ' A' ' 69' ' ' TYR . 47.0 Cg_endo -74.21 124.41 8.99 Favored 'Trans proline' 0 C--N 1.317 -1.13 0 O-C-N 123.299 1.157 . . . . 0.0 110.159 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -81.43 -179.93 5.33 Favored 'Trans proline' 0 C--N 1.318 -1.055 0 O-C-N 123.286 1.15 . . . . 0.0 110.079 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 38.1 t -168.93 62.16 0.06 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.461 -0.775 . . . . 0.0 110.811 -179.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 69.6 -77.65 0.05 Allowed 'General case' 0 N--CA 1.503 2.203 0 O-C-N 120.945 -1.097 . . . . 0.0 110.533 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.443 ' CE2' ' CD1' ' A' ' 47' ' ' TRP . 3.3 t80 -49.49 -46.93 48.83 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.12 -0.987 . . . . 0.0 111.114 -179.578 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -60.31 -28.29 68.0 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.551 -0.718 . . . . 0.0 110.281 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 23.7 mt -83.99 -35.63 23.77 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.352 -0.843 . . . . 0.0 110.532 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.485 ' CE1' ' CE1' ' A' ' 23' ' ' TYR . 59.0 t80 -71.93 -52.68 16.01 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.531 -0.731 . . . . 0.0 110.718 -179.214 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 36.4 t -56.78 -55.16 37.88 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.395 -0.816 . . . . 0.0 110.658 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 9.2 t -55.35 -23.99 27.01 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.502 -0.749 . . . . 0.0 110.989 -179.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -98.97 -21.19 16.38 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.4 -0.812 . . . . 0.0 111.288 -179.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.485 ' CE1' ' CE1' ' A' ' 19' ' ' PHE . 5.6 m-85 -100.11 15.93 25.75 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.349 -0.845 . . . . 0.0 111.352 -179.364 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.461 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 0.5 OUTLIER -92.25 -42.92 0.36 Allowed Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.314 -0.867 . . . . 0.0 112.744 179.663 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.517 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.2 Cg_endo -67.36 -17.94 49.64 Favored 'Trans proline' 0 N--CA 1.491 1.344 0 O-C-N 122.798 0.893 . . . . 0.0 110.493 -178.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? -71.78 -49.34 39.72 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 178.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 26.4 mm -56.06 -30.13 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 CA-C-O 121.257 0.551 . . . . 0.0 110.628 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.517 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 6.0 mmmm -73.84 -34.98 64.75 Favored 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 120.058 -0.657 . . . . 0.0 110.259 -177.236 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.9 t -62.76 -24.19 67.58 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.472 -0.767 . . . . 0.0 110.647 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -118.33 -16.57 9.62 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.415 -0.803 . . . . 0.0 111.194 -179.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 41.6 m80 -127.33 95.24 36.5 Favored Pre-proline 0 N--CA 1.498 1.949 0 O-C-N 121.351 -0.843 . . . . 0.0 109.578 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -74.95 -35.91 2.91 Favored 'Trans proline' 0 C--N 1.315 -1.231 0 O-C-N 123.492 1.259 . . . . 0.0 110.342 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.408 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -74.9 -19.07 80.1 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 110.099 -1.2 . . . . 0.0 110.099 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.2 83.81 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.584 -0.951 . . . . 0.0 111.312 -179.374 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.408 ' N ' ' O ' ' A' ' 33' ' ' GLY . 46.7 t -72.71 175.99 5.95 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.422 -0.799 . . . . 0.0 109.542 179.701 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 43.0 mm -56.48 -29.82 29.81 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 O-C-N 121.362 -0.836 . . . . 0.0 110.122 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.31 -64.91 3.83 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.408 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 0.6 OUTLIER -71.65 -31.81 67.24 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.66 -0.906 . . . . 0.0 110.564 179.803 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.5 m -67.09 -32.2 73.19 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.387 -0.821 . . . . 0.0 109.901 179.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.09 -35.34 69.2 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.621 -0.674 . . . . 0.0 109.914 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -97.92 -12.68 21.79 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.602 -0.686 . . . . 0.0 111.764 -179.422 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 6.1 tptt -85.16 5.18 31.07 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.044 -1.035 . . . . 0.0 110.528 179.377 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 18.3 mt -101.8 -33.51 9.79 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.029 -1.044 . . . . 0.0 109.316 179.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -66.25 -30.31 76.52 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.391 -1.484 . . . . 0.0 109.391 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.53 -41.39 63.44 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.38 -1.071 . . . . 0.0 110.679 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 11.6 mmt -87.03 -42.78 12.82 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.59 -0.694 . . . . 0.0 109.999 179.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . 0.443 ' CD1' ' CE2' ' A' ' 16' ' ' PHE . 72.9 t-105 -55.74 -23.76 31.13 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.505 -0.747 . . . . 0.0 110.723 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.4 t -85.79 -35.68 20.56 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.366 -0.834 . . . . 0.0 109.997 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -63.45 -33.67 76.08 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.66 -0.65 . . . . 0.0 109.839 179.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 89.8 mm-40 -63.32 151.26 41.23 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.676 -0.64 . . . . 0.0 110.094 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 88.6 p -103.06 -153.02 0.46 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.733 -0.605 . . . . 0.0 109.578 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -82.7 56.4 3.36 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.342 -0.849 . . . . 0.0 110.05 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 15.3 tttt -133.74 -51.18 0.85 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.448 -0.783 . . . . 0.0 110.204 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -67.78 -26.19 65.98 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.542 -0.724 . . . . 0.0 110.616 -179.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.423 ' O ' ' N ' ' A' ' 59' ' ' GLU . 10.9 ttmt -82.7 -36.88 25.49 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.563 -0.711 . . . . 0.0 110.668 -179.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -43.42 -52.53 13.08 Favored Pre-proline 0 N--CA 1.508 2.466 0 O-C-N 121.455 -0.778 . . . . 0.0 112.47 -178.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -78.34 -37.45 0.74 Allowed 'Trans proline' 0 C--N 1.315 -1.218 0 O-C-N 123.129 1.068 . . . . 0.0 111.848 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -84.66 -10.38 57.37 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.345 -0.847 . . . . 0.0 112.409 -177.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.423 ' N ' ' O ' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -85.46 -26.9 26.05 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.064 -1.022 . . . . 0.0 110.933 -179.036 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -75.4 -18.26 59.98 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.435 -0.791 . . . . 0.0 110.947 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 59.2 tttt -65.02 -43.67 91.68 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.278 -0.888 . . . . 0.0 110.204 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -76.38 -12.84 60.12 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.494 -0.754 . . . . 0.0 110.328 179.393 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.96 -40.83 94.85 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.31 -0.869 . . . . 0.0 110.42 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -69.87 -62.39 1.4 Allowed 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.237 -0.914 . . . . 0.0 109.705 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.6 mp -46.29 -24.27 0.45 Allowed 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.606 -0.684 . . . . 0.0 112.142 -179.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.5 tptt -71.33 -45.39 63.07 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.295 -0.878 . . . . 0.0 109.517 179.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -66.1 -57.39 7.78 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.71 -0.619 . . . . 0.0 109.873 179.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 59.1 mttt -54.83 -25.47 28.65 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.56 -0.713 . . . . 0.0 110.71 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.418 ' CZ ' ' HD3' ' A' ' 12' ' ' PRO . 46.0 t80 -78.12 -66.19 0.88 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.517 -0.74 . . . . 0.0 109.611 179.514 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -58.58 -22.56 56.3 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.728 -0.608 . . . . 0.0 111.288 -179.267 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 39.2 mttt -93.79 -18.84 21.61 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.288 -0.883 . . . . 0.0 111.574 -179.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -110.04 -27.06 9.38 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.249 -0.907 . . . . 0.0 111.02 -179.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.7 tp -66.98 -33.93 66.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 O-C-N 121.389 -0.819 . . . . 0.0 110.459 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.1 -54.52 44.93 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.596 -0.69 . . . . 0.0 110.135 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.19 -19.21 61.78 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.634 -0.666 . . . . 0.0 110.483 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -70.65 -39.96 73.32 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.37 -0.832 . . . . 0.0 110.26 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 13.3 mtt-85 -75.67 -83.55 0.06 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.602 -0.686 . . . . 0.0 110.246 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -172.07 38.92 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.139 -0.975 . . . . 0.0 110.091 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 30.0 mmtt . . . . . 0 N--CA 1.494 1.728 0 CA-C-O 117.973 -1.013 . . . . 0.0 110.376 -179.961 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.1 ttt . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.107 0.48 . . . . 0.0 110.247 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -109.62 88.08 2.66 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.635 -0.666 . . . . 0.0 110.114 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 8.6 tttt -169.69 -154.24 0.11 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.517 -0.739 . . . . 0.0 110.116 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.3 tttp -166.31 -151.08 0.12 Allowed 'General case' 0 N--CA 1.485 1.317 0 O-C-N 121.378 -0.826 . . . . 0.0 109.818 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -109.37 168.45 7.68 Favored Pre-proline 0 N--CA 1.494 1.768 0 O-C-N 121.403 -0.811 . . . . 0.0 110.269 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -72.19 -29.77 13.98 Favored 'Trans proline' 0 C--N 1.316 -1.139 0 O-C-N 123.47 1.248 . . . . 0.0 110.339 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -79.25 -15.16 58.43 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.591 -0.693 . . . . 0.0 110.795 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -102.54 128.65 27.65 Favored Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.273 -0.892 . . . . 0.0 109.632 179.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -70.94 102.8 1.27 Allowed 'Trans proline' 0 N--CA 1.485 1.011 0 O-C-N 123.154 1.081 . . . . 0.0 110.727 -179.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.26 -165.14 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.593 -0.692 . . . . 0.0 110.432 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 7.5 mpt_? -56.83 148.56 47.67 Favored Pre-proline 0 N--CA 1.498 1.953 0 O-C-N 121.455 -0.778 . . . . 0.0 110.732 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.427 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.5 Cg_endo -79.26 126.65 7.05 Favored 'Trans proline' 0 C--N 1.317 -1.1 0 O-C-N 123.387 1.204 . . . . 0.0 110.069 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -81.68 178.45 6.56 Favored 'Trans proline' 0 C--N 1.318 -1.067 0 O-C-N 123.266 1.14 . . . . 0.0 110.379 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.7 t -160.23 63.33 0.33 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.502 -0.748 . . . . 0.0 110.526 -179.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 67.19 -76.42 0.05 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.092 -1.005 . . . . 0.0 109.914 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.419 ' CD1' ' CD1' ' A' ' 47' ' ' TRP . 18.6 t80 -51.58 -42.54 61.97 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.326 -0.858 . . . . 0.0 110.814 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -62.62 -29.16 70.4 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.696 -0.627 . . . . 0.0 109.357 179.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 45.0 mt -81.36 -40.35 23.66 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.67 -0.644 . . . . 0.0 110.276 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -63.4 -49.74 72.58 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.485 -0.759 . . . . 0.0 109.865 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 9.0 t -60.85 -27.52 68.16 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.621 -0.674 . . . . 0.0 109.743 179.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 10.6 t -102.9 20.81 16.75 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.587 -0.696 . . . . 0.0 110.875 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -142.26 -12.01 0.83 Allowed 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.19 -0.944 . . . . 0.0 112.099 179.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -119.23 24.38 10.78 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.854 -1.154 . . . . 0.0 110.862 -179.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.469 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 8.0 mtt180 -85.45 -45.93 0.63 Allowed Pre-proline 0 N--CA 1.489 1.485 0 O-C-N 121.512 -0.742 . . . . 0.0 112.126 179.699 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.484 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.7 Cg_endo -66.91 -14.76 44.94 Favored 'Trans proline' 0 N--CA 1.49 1.281 0 O-C-N 122.925 0.961 . . . . 0.0 110.675 -179.11 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.84 -53.07 11.04 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 177.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 27.1 mm -52.03 -31.73 14.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 CA-C-O 121.417 0.627 . . . . 0.0 110.48 179.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.491 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 5.4 mmmm -72.71 -37.28 67.85 Favored 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.225 -177.39 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 26.4 t -58.64 -25.09 62.37 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.495 -0.753 . . . . 0.0 110.764 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -117.52 -21.58 8.53 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.531 -0.73 . . . . 0.0 110.96 -179.59 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 41.0 m80 -121.7 96.59 47.2 Favored Pre-proline 0 N--CA 1.496 1.857 0 O-C-N 121.247 -0.908 . . . . 0.0 109.783 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -75.23 -37.9 1.73 Allowed 'Trans proline' 0 C--N 1.315 -1.195 0 O-C-N 123.446 1.235 . . . . 0.0 110.433 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.32 -9.41 85.78 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 110.452 -1.059 . . . . 0.0 110.452 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.52 82.34 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.163 -1.198 . . . . 0.0 110.33 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.6 t -76.49 173.06 11.97 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.503 -0.748 . . . . 0.0 109.703 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 40.0 mm -50.94 -29.72 8.03 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.186 0 O-C-N 121.271 -0.893 . . . . 0.0 110.6 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.87 -75.29 0.29 Allowed Glycine 0 N--CA 1.492 2.389 0 N-CA-C 109.069 -1.612 . . . . 0.0 109.069 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.427 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 29.3 t70 -66.2 -18.84 65.6 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.701 -0.882 . . . . 0.0 111.039 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 36.3 m -73.95 -45.58 49.43 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.243 -0.91 . . . . 0.0 109.954 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -52.32 -44.83 65.33 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.442 -0.787 . . . . 0.0 110.15 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.32 -11.19 59.74 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.76 -0.587 . . . . 0.0 111.243 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.427 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -82.0 2.47 30.76 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 120.93 -1.106 . . . . 0.0 110.815 179.111 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.4 mt -106.34 -30.35 9.2 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.204 -0.935 . . . . 0.0 109.599 179.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -78.99 -42.11 12.99 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 108.854 -1.698 . . . . 0.0 108.854 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -55.11 -42.89 73.52 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.533 -0.98 . . . . 0.0 110.401 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 17.6 mmt -74.18 -50.5 18.98 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.571 -0.706 . . . . 0.0 109.535 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . 0.419 ' CD1' ' CD1' ' A' ' 16' ' ' PHE . 69.2 t-105 -49.61 -52.95 26.85 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.642 -0.661 . . . . 0.0 111.047 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 45.0 t -59.92 -35.48 74.99 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.407 -0.808 . . . . 0.0 110.326 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -63.58 -40.27 96.52 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.567 -0.708 . . . . 0.0 109.934 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 89.3 mm-40 -57.52 155.2 9.9 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.576 -0.702 . . . . 0.0 110.556 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 21.7 t -99.87 -150.67 0.38 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.722 -0.612 . . . . 0.0 109.511 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -89.65 47.46 1.47 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.281 -0.887 . . . . 0.0 110.275 179.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 62.0 mttt -126.8 -50.71 1.47 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.551 -0.718 . . . . 0.0 110.069 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -64.16 -24.74 67.79 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.67 -0.644 . . . . 0.0 110.405 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 66.1 tttt -81.96 -35.16 29.3 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.467 -0.771 . . . . 0.0 110.432 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -44.44 -52.22 17.89 Favored Pre-proline 0 N--CA 1.506 2.343 0 O-C-N 121.513 -0.742 . . . . 0.0 112.022 -179.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -78.96 -37.73 0.54 Allowed 'Trans proline' 0 C--N 1.315 -1.204 0 O-C-N 123.188 1.099 . . . . 0.0 110.958 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -84.53 4.29 32.64 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.38 -0.825 . . . . 0.0 112.043 -178.325 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.01 -23.89 14.77 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.072 -1.017 . . . . 0.0 110.446 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -76.36 -23.76 54.16 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.394 -0.816 . . . . 0.0 110.251 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 50.6 tttm -61.44 -39.82 92.19 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.421 -0.799 . . . . 0.0 109.856 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -78.1 -13.06 60.01 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.6 -0.687 . . . . 0.0 110.365 179.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.35 1.75 35.58 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.397 -0.814 . . . . 0.0 110.291 178.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 26.3 mmtm -104.35 -30.36 10.15 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.147 -0.971 . . . . 0.0 109.735 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 7.1 mp -86.48 1.51 51.22 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.894 -0.504 . . . . 0.0 110.592 179.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.5 tptt -94.38 -34.28 12.84 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.156 -0.965 . . . . 0.0 109.428 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -82.93 -11.59 58.05 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.751 -0.593 . . . . 0.0 110.394 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -105.04 -28.78 10.84 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.439 -0.788 . . . . 0.0 109.467 179.111 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.427 ' CE2' ' HD3' ' A' ' 12' ' ' PRO . 19.3 t80 -75.76 -54.41 6.98 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.6 -0.688 . . . . 0.0 109.59 179.575 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -68.08 -14.68 63.16 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.719 -0.613 . . . . 0.0 111.306 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 60.8 mttt -101.33 -30.53 11.44 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.256 -0.903 . . . . 0.0 110.709 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -92.48 -31.31 15.3 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.483 -0.76 . . . . 0.0 110.852 -179.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.7 tp -66.46 -16.05 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 O-C-N 121.398 -0.814 . . . . 0.0 110.953 -179.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.44 -47.47 33.42 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.253 -0.905 . . . . 0.0 109.61 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -82.88 -27.08 30.96 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.687 -0.633 . . . . 0.0 109.723 179.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 66.8 t80 -63.74 -44.38 93.68 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.586 -0.696 . . . . 0.0 109.88 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 35.5 mtt180 -61.54 -73.0 0.11 Allowed 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.572 -0.705 . . . . 0.0 110.09 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 53.08 46.44 26.69 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.429 -0.794 . . . . 0.0 110.674 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 14.8 mttt . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.284 -179.946 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 30.6 ttm . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 121.065 0.46 . . . . 0.0 110.252 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.35 25.93 7.12 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.561 -0.712 . . . . 0.0 110.381 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -69.58 101.02 1.53 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.537 -0.727 . . . . 0.0 110.286 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.4 mttp -158.17 -172.58 3.95 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.522 -0.736 . . . . 0.0 110.317 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -132.25 176.02 3.23 Favored Pre-proline 0 N--CA 1.495 1.791 0 O-C-N 121.558 -0.714 . . . . 0.0 110.119 -179.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.0 -29.48 22.67 Favored 'Trans proline' 0 N--CA 1.487 1.138 0 O-C-N 123.407 1.214 . . . . 0.0 110.296 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -78.29 -19.28 53.92 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.592 -0.693 . . . . 0.0 110.637 -179.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -95.53 134.24 24.56 Favored Pre-proline 0 N--CA 1.494 1.73 0 O-C-N 121.341 -0.85 . . . . 0.0 109.173 179.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.437 ' HB2' ' CG ' ' A' ' 69' ' ' TYR . 45.1 Cg_endo -72.89 108.23 2.53 Favored 'Trans proline' 0 C--N 1.319 -1.025 0 O-C-N 123.139 1.073 . . . . 0.0 110.775 -179.415 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.6 pttt -67.06 -153.92 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.575 -0.703 . . . . 0.0 109.615 179.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -57.75 138.21 82.61 Favored Pre-proline 0 N--CA 1.499 2.01 0 O-C-N 121.269 -0.895 . . . . 0.0 110.145 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -74.56 134.37 18.53 Favored 'Trans proline' 0 C--N 1.318 -1.078 0 O-C-N 123.246 1.129 . . . . 0.0 110.082 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -80.56 179.7 5.88 Favored 'Trans proline' 0 C--N 1.318 -1.07 0 O-C-N 123.208 1.11 . . . . 0.0 110.164 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -170.0 61.65 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.398 -0.814 . . . . 0.0 110.827 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 68.13 -78.71 0.04 OUTLIER 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.072 -1.018 . . . . 0.0 110.473 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.417 ' CE2' ' CD1' ' A' ' 47' ' ' TRP . 3.9 t80 -48.65 -49.36 37.73 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.163 -0.961 . . . . 0.0 111.231 -179.463 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -57.15 -31.07 64.99 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.575 -0.703 . . . . 0.0 110.14 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.2 mt -78.57 -31.63 47.39 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.534 -0.729 . . . . 0.0 110.181 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.502 ' CZ ' ' CZ ' ' A' ' 23' ' ' TYR . 52.1 t80 -76.79 -55.03 5.85 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.607 -0.683 . . . . 0.0 110.731 -179.306 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.8 t -57.7 -52.9 63.56 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.435 -0.791 . . . . 0.0 110.526 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 8.0 t -55.71 -24.19 33.24 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.5 -0.75 . . . . 0.0 110.855 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -98.72 -24.85 14.88 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.426 -0.796 . . . . 0.0 111.001 -179.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.502 ' CZ ' ' CZ ' ' A' ' 19' ' ' PHE . 2.2 m-85 -88.22 -36.4 16.78 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.378 -0.826 . . . . 0.0 110.685 -179.57 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.516 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 6.8 mtt180 -48.43 -51.38 51.74 Favored Pre-proline 0 N--CA 1.496 1.861 0 O-C-N 121.44 -0.788 . . . . 0.0 111.992 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.516 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 36.4 Cg_endo -60.11 -28.69 87.51 Favored 'Trans proline' 0 N--CA 1.495 1.566 0 O-C-N 123.21 1.111 . . . . 0.0 109.977 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.3 tmtt? -67.8 -44.68 76.76 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 178.022 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 46.4 mm -59.54 -23.37 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 CA-C-N 116.152 -0.477 . . . . 0.0 109.877 179.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.52 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 5.9 mmmm -83.56 -38.55 21.54 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.458 -0.777 . . . . 0.0 110.058 -177.693 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.7 t -57.43 -26.62 61.45 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.354 -0.841 . . . . 0.0 110.097 179.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -109.19 -48.05 3.32 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.611 -0.681 . . . . 0.0 109.857 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 14.2 m80 -103.31 103.58 35.93 Favored Pre-proline 0 N--CA 1.497 1.884 0 O-C-N 121.642 -0.661 . . . . 0.0 109.685 -179.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -81.38 -40.99 0.15 Allowed 'Trans proline' 0 C--N 1.314 -1.287 0 O-C-N 123.367 1.193 . . . . 0.0 109.975 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.08 -23.26 69.52 Favored Glycine 0 N--CA 1.488 2.146 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 179.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -51.79 91.76 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.529 -0.983 . . . . 0.0 110.909 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 68.7 m -74.35 175.41 7.69 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.583 -0.698 . . . . 0.0 109.755 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.5 mp -59.65 -31.81 47.85 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.348 -0.845 . . . . 0.0 109.584 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.15 -61.41 7.36 Favored Glycine 0 N--CA 1.495 2.607 0 N-CA-C 109.02 -1.632 . . . . 0.0 109.02 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.452 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 16.5 t0 -71.36 -35.92 71.3 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.694 -0.886 . . . . 0.0 110.091 179.163 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 80.5 m -64.6 -29.9 70.92 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.138 -0.976 . . . . 0.0 109.82 179.157 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.56 -37.9 59.62 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.641 -0.662 . . . . 0.0 110.245 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.3 ptpt -95.87 -13.71 23.75 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.525 -0.734 . . . . 0.0 111.922 -178.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.452 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -86.04 4.49 37.77 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 120.974 -1.079 . . . . 0.0 110.626 179.7 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.4 ' CD1' ' CG ' ' A' ' 24' ' ' ARG . 80.1 mt -106.77 -34.27 7.33 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.262 -0.899 . . . . 0.0 109.488 179.467 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -64.57 -32.7 85.08 Favored Glycine 0 N--CA 1.493 2.476 0 N-CA-C 109.79 -1.324 . . . . 0.0 109.79 -179.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -51.18 -33.95 29.48 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.403 -1.057 . . . . 0.0 110.794 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 39.2 mtt -87.43 -41.05 13.85 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.604 -0.685 . . . . 0.0 109.888 179.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . 0.417 ' CD1' ' CE2' ' A' ' 16' ' ' PHE . 71.7 t-105 -56.19 -23.89 38.23 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.55 -0.718 . . . . 0.0 110.858 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 21.9 t -85.28 -36.08 21.1 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.48 -0.763 . . . . 0.0 110.066 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -63.03 -33.02 74.53 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.633 -0.667 . . . . 0.0 109.828 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 -64.81 149.64 49.0 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.645 -0.659 . . . . 0.0 110.12 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.6 m -104.44 -153.22 0.48 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.669 -0.644 . . . . 0.0 109.526 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.88 58.29 3.33 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.376 -0.827 . . . . 0.0 109.915 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 26.7 tttt -136.24 -50.79 0.7 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.399 -0.813 . . . . 0.0 110.297 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -69.81 -27.95 65.31 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.557 -0.715 . . . . 0.0 110.726 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.419 ' O ' ' N ' ' A' ' 59' ' ' GLU . 32.6 ttpt -80.0 -37.71 33.65 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.444 -0.785 . . . . 0.0 110.695 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -44.14 -53.01 14.56 Favored Pre-proline 0 N--CA 1.508 2.439 0 O-C-N 121.472 -0.768 . . . . 0.0 112.513 -178.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -77.66 -37.43 0.92 Allowed 'Trans proline' 0 C--N 1.315 -1.2 0 O-C-N 123.078 1.041 . . . . 0.0 111.744 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -81.86 -14.86 55.67 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.395 -0.815 . . . . 0.0 112.089 -178.111 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.419 ' N ' ' O ' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -82.84 -24.97 33.04 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.202 -0.936 . . . . 0.0 111.086 -178.934 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -79.83 -20.59 45.7 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.451 -0.781 . . . . 0.0 110.845 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 43.1 tttm -63.04 -48.39 78.9 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.409 -0.807 . . . . 0.0 110.195 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -81.12 -13.36 58.76 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.447 -0.783 . . . . 0.0 110.316 179.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.87 -28.14 69.83 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.321 -0.862 . . . . 0.0 109.154 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -81.75 -66.06 0.94 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.577 -0.702 . . . . 0.0 109.17 178.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.402 ' O ' ' CD1' ' A' ' 69' ' ' TYR . 3.1 mp -48.32 -22.56 0.7 Allowed 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.602 -0.687 . . . . 0.0 112.117 -179.356 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 23.9 tptt -65.49 -45.46 83.54 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.14 -0.975 . . . . 0.0 109.851 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -66.66 -54.51 22.42 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.662 -0.649 . . . . 0.0 110.349 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 68.9 mttt -56.4 -29.93 62.12 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.487 -0.758 . . . . 0.0 110.478 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.437 ' CG ' ' HB2' ' A' ' 9' ' ' PRO . 3.8 m-85 -75.72 -70.07 0.45 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.576 -0.703 . . . . 0.0 109.834 179.652 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -49.53 -29.26 6.56 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.662 -0.649 . . . . 0.0 111.342 -179.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.8 ttmm -84.47 -58.04 2.9 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.529 -0.732 . . . . 0.0 110.47 -179.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -64.11 -30.23 71.31 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.624 -0.673 . . . . 0.0 111.112 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 9.7 tp -71.53 -35.42 56.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.351 -0.843 . . . . 0.0 110.442 -179.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.9 -48.72 80.53 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.47 -0.769 . . . . 0.0 110.111 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.77 -11.32 59.87 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.634 -0.666 . . . . 0.0 110.746 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -83.71 -30.08 27.03 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.312 -0.867 . . . . 0.0 110.242 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 22.6 mtt180 -85.73 6.13 29.18 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.499 -0.751 . . . . 0.0 111.173 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 51.17 88.86 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.119 0 O-C-N 120.986 -1.071 . . . . 0.0 110.98 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.7 tptt . . . . . 0 N--CA 1.494 1.739 0 CA-C-O 117.999 -1.001 . . . . 0.0 110.253 -179.978 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.0 tpp . . . . . 0 N--CA 1.49 1.573 0 CA-C-O 121.184 0.516 . . . . 0.0 110.229 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 52.74 91.94 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.465 -0.772 . . . . 0.0 110.746 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -170.24 100.42 0.27 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.55 -0.719 . . . . 0.0 110.266 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 17.4 mtpp -60.1 -62.96 1.48 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.56 -0.713 . . . . 0.0 110.415 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -162.23 165.21 16.09 Favored Pre-proline 0 N--CA 1.493 1.715 0 O-C-N 121.497 -0.752 . . . . 0.0 110.33 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.65 -40.23 2.17 Favored 'Trans proline' 0 C--N 1.318 -1.043 0 O-C-N 123.436 1.229 . . . . 0.0 110.33 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 35.5 t30 -78.51 -11.33 59.95 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.715 -0.616 . . . . 0.0 111.044 -179.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -105.21 132.62 20.72 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.156 -0.965 . . . . 0.0 109.361 178.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.76 114.76 4.11 Favored 'Trans proline' 0 C--N 1.318 -1.032 0 O-C-N 123.095 1.05 . . . . 0.0 110.458 -179.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.5 pttt -60.12 -162.44 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.664 -0.648 . . . . 0.0 110.337 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.68 144.59 98.8 Favored Pre-proline 0 N--CA 1.495 1.821 0 O-C-N 121.421 -0.799 . . . . 0.0 110.069 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.417 ' HG3' ' CE2' ' A' ' 69' ' ' TYR . 49.3 Cg_endo -75.24 131.0 13.54 Favored 'Trans proline' 0 C--N 1.317 -1.082 0 O-C-N 123.296 1.156 . . . . 0.0 109.802 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -81.26 -176.75 3.27 Favored 'Trans proline' 0 C--N 1.317 -1.115 0 O-C-N 123.197 1.104 . . . . 0.0 110.172 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 76.4 p -165.48 59.21 0.11 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.513 -0.742 . . . . 0.0 110.807 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 68.52 -77.09 0.05 Allowed 'General case' 0 N--CA 1.504 2.258 0 O-C-N 121.12 -0.987 . . . . 0.0 110.662 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -46.99 -51.6 16.74 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.299 -0.876 . . . . 0.0 111.47 -179.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -57.55 -36.95 72.31 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.497 -0.752 . . . . 0.0 109.945 179.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.1 mt -70.08 -38.63 75.75 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.619 -0.676 . . . . 0.0 110.347 -179.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.492 ' CE1' ' CE1' ' A' ' 23' ' ' TYR . 63.1 t80 -71.94 -53.05 14.3 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.517 -0.739 . . . . 0.0 110.621 -179.507 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 34.6 t -56.83 -53.82 53.46 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.368 -0.833 . . . . 0.0 110.657 -179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 11.8 t -56.22 -29.01 60.39 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.534 -0.729 . . . . 0.0 110.822 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -90.82 -27.75 18.65 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.468 -0.77 . . . . 0.0 110.798 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.492 ' CE1' ' CE1' ' A' ' 19' ' ' PHE . 9.1 m-85 -94.74 14.69 20.43 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.511 -0.743 . . . . 0.0 111.287 -179.433 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.484 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 4.2 mtp180 -88.59 -43.82 0.46 Allowed Pre-proline 0 N--CA 1.488 1.446 0 O-C-N 121.253 -0.904 . . . . 0.0 112.53 179.741 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.496 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 37.8 Cg_endo -65.66 -17.41 56.67 Favored 'Trans proline' 0 N--CA 1.491 1.365 0 O-C-N 122.865 0.929 . . . . 0.0 110.563 -178.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.8 tmtt? -72.02 -50.43 28.64 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 177.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 24.5 mm -54.86 -33.79 29.23 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 CA-C-O 121.224 0.535 . . . . 0.0 110.631 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.503 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 6.2 mmmm -71.01 -38.35 72.64 Favored 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 120.121 -0.632 . . . . 0.0 110.321 -177.073 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.6 t -58.65 -24.47 61.22 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.515 -0.741 . . . . 0.0 110.797 -179.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -117.29 -23.04 7.99 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.435 -0.79 . . . . 0.0 110.978 -179.565 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 43.0 m80 -120.56 96.58 48.91 Favored Pre-proline 0 N--CA 1.495 1.82 0 O-C-N 121.342 -0.848 . . . . 0.0 109.709 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -75.59 -29.07 7.68 Favored 'Trans proline' 0 C--N 1.315 -1.226 0 O-C-N 123.416 1.219 . . . . 0.0 110.54 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -85.04 -12.2 74.55 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 110.571 -1.012 . . . . 0.0 110.571 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.56 83.67 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.257 -1.143 . . . . 0.0 110.658 -179.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 71.5 p -72.52 171.1 13.0 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.512 -0.742 . . . . 0.0 109.847 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.7 mp -53.6 -28.6 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.122 0 O-C-N 121.281 -0.887 . . . . 0.0 109.944 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.49 -71.13 0.83 Allowed Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.242 -1.543 . . . . 0.0 109.242 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -66.53 -27.41 67.74 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.698 -0.883 . . . . 0.0 110.456 179.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 33.2 m -67.38 -27.72 67.34 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.494 -0.754 . . . . 0.0 109.893 179.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.38 -47.37 23.52 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.574 -0.704 . . . . 0.0 109.685 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.69 -17.1 52.18 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.605 -0.684 . . . . 0.0 111.377 -179.64 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.0 tptt -76.66 -59.15 2.9 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.111 -0.993 . . . . 0.0 109.885 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 54.7 mt -47.03 -27.42 1.32 Allowed 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.648 -0.657 . . . . 0.0 111.544 -179.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.91 -36.2 91.79 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.182 -1.567 . . . . 0.0 109.182 179.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -51.01 -37.36 44.65 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.508 -0.995 . . . . 0.0 111.074 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 65.0 mtt -82.47 -42.8 18.03 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.598 -0.689 . . . . 0.0 110.318 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 69.9 t-105 -49.37 -32.93 12.43 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.523 -0.736 . . . . 0.0 111.585 -179.199 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.3 t -93.02 -24.06 18.47 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.306 -0.872 . . . . 0.0 110.592 -179.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -64.02 -43.3 96.02 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.413 -0.805 . . . . 0.0 109.993 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 52.2 mm-40 -61.83 157.62 17.74 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.719 -0.613 . . . . 0.0 110.329 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.3 t -87.23 -147.7 0.14 Allowed 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -83.58 54.11 2.75 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.181 -0.949 . . . . 0.0 110.125 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.0 tttt -129.62 -37.08 1.6 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.465 -0.772 . . . . 0.0 110.596 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -58.61 -38.62 78.4 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.304 -0.873 . . . . 0.0 110.791 -179.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -92.92 24.13 3.84 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.35 -0.844 . . . . 0.0 111.458 -179.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.438 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 4.4 mm-40 -98.05 -56.89 0.18 Allowed Pre-proline 0 N--CA 1.498 1.959 0 O-C-N 121.219 -0.926 . . . . 0.0 110.539 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.438 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.7 Cg_endo -83.23 -32.16 0.55 Allowed 'Trans proline' 0 N--CA 1.482 0.84 0 O-C-N 122.817 0.904 . . . . 0.0 110.666 179.76 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -82.09 -0.85 46.47 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.493 -0.754 . . . . 0.0 111.769 -178.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.54 -24.52 18.73 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.084 -1.01 . . . . 0.0 110.814 -179.577 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -79.26 -23.91 43.34 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.443 -0.785 . . . . 0.0 110.332 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -61.66 -44.83 96.21 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.432 -0.792 . . . . 0.0 109.92 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.22 -11.43 60.89 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.598 -0.689 . . . . 0.0 110.482 179.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -88.57 7.45 33.19 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.262 -0.899 . . . . 0.0 110.315 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 58.9 mmtt -107.02 -34.39 7.19 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.222 -0.923 . . . . 0.0 109.111 178.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 6.2 mp -81.04 -4.12 54.14 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.984 -0.448 . . . . 0.0 110.342 178.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.9 tppt? -80.82 -31.53 35.54 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.264 -0.898 . . . . 0.0 109.301 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -69.23 -63.26 1.1 Allowed 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 119.876 -0.73 . . . . 0.0 109.603 179.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -55.2 -24.21 26.04 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.531 -0.731 . . . . 0.0 111.107 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.417 ' CE2' ' HG3' ' A' ' 12' ' ' PRO . 29.5 t80 -79.18 -69.56 0.57 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.306 -0.871 . . . . 0.0 110.29 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -62.9 -14.06 41.93 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.551 -0.718 . . . . 0.0 111.768 -179.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.7 tttt -98.24 -27.02 14.34 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.104 -0.998 . . . . 0.0 110.893 -179.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -104.39 -24.56 13.05 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.434 -0.791 . . . . 0.0 111.079 -179.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.2 tp -68.97 -30.29 46.26 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 O-C-N 121.407 -0.808 . . . . 0.0 110.421 -179.543 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.46 -46.83 86.74 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.648 -0.658 . . . . 0.0 109.861 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -81.99 -20.16 39.04 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.701 -0.624 . . . . 0.0 110.498 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 75.1 t80 -67.08 -35.38 79.7 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.409 -0.807 . . . . 0.0 110.129 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 43.8 mtt180 -101.4 10.1 40.85 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.56 -0.712 . . . . 0.0 110.931 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 52.5 81.26 0.08 Allowed 'General case' 0 N--CA 1.501 2.119 0 O-C-N 120.964 -1.085 . . . . 0.0 110.81 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 15.0 mttm . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 118.009 -0.996 . . . . 0.0 110.207 -179.927 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.4 ttt . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.083 0.468 . . . . 0.0 110.177 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 3.1 mttm 52.56 -169.05 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.514 -0.741 . . . . 0.0 110.888 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.1 mmtt 53.62 -163.89 0.1 Allowed 'General case' 0 N--CA 1.503 2.189 0 O-C-N 121.469 -0.769 . . . . 0.0 110.556 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.5 tttt -169.07 -155.36 0.14 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.596 -0.69 . . . . 0.0 109.873 179.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.88 152.89 85.98 Favored Pre-proline 0 N--CA 1.495 1.792 0 O-C-N 121.589 -0.695 . . . . 0.0 110.431 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -73.66 -45.12 0.42 Allowed 'Trans proline' 0 C--N 1.317 -1.081 0 O-C-N 123.468 1.247 . . . . 0.0 110.422 179.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -78.81 -22.7 45.85 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.606 -0.684 . . . . 0.0 110.738 -179.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -78.13 143.19 65.0 Favored Pre-proline 0 N--CA 1.495 1.777 0 O-C-N 121.225 -0.922 . . . . 0.0 109.428 179.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -71.58 98.9 0.89 Allowed 'Trans proline' 0 C--N 1.318 -1.062 0 O-C-N 123.258 1.136 . . . . 0.0 110.443 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.6 pttm -65.6 -155.49 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.599 -0.688 . . . . 0.0 109.658 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -55.44 145.88 46.06 Favored Pre-proline 0 N--CA 1.499 2.015 0 O-C-N 121.291 -0.881 . . . . 0.0 110.365 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -73.57 126.28 10.75 Favored 'Trans proline' 0 C--N 1.316 -1.162 0 O-C-N 123.378 1.199 . . . . 0.0 110.319 -179.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -81.57 173.44 11.41 Favored 'Trans proline' 0 C--N 1.318 -1.043 0 O-C-N 123.239 1.126 . . . . 0.0 109.799 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.5 t -171.83 64.57 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.429 -0.794 . . . . 0.0 111.001 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 71.32 -74.26 0.09 Allowed 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.124 -0.985 . . . . 0.0 110.876 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -46.67 -52.87 12.83 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.274 -0.891 . . . . 0.0 111.556 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -58.31 -39.24 78.84 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.575 -0.703 . . . . 0.0 109.865 179.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.4 mt -64.59 -42.94 95.26 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.667 -0.646 . . . . 0.0 109.814 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.501 ' CE1' ' CE1' ' A' ' 23' ' ' TYR . 80.9 t80 -68.71 -51.73 38.38 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.647 -0.658 . . . . 0.0 110.268 -179.827 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.3 m -55.7 -56.05 24.97 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.545 -0.722 . . . . 0.0 110.69 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 84.8 p -55.87 -30.78 62.07 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.48 -0.762 . . . . 0.0 110.831 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -87.54 -27.31 22.68 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.464 -0.773 . . . . 0.0 110.909 -179.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.501 ' CE1' ' CE1' ' A' ' 19' ' ' PHE . 9.6 m-85 -98.87 14.85 27.46 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.458 -0.776 . . . . 0.0 111.369 -179.5 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.48 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 14.2 mtp180 -87.91 -45.01 0.49 Allowed Pre-proline 0 N--CA 1.488 1.437 0 O-C-N 121.151 -0.968 . . . . 0.0 112.505 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.483 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.0 Cg_endo -65.47 -17.61 57.88 Favored 'Trans proline' 0 N--CA 1.491 1.353 0 O-C-N 122.802 0.896 . . . . 0.0 110.539 -178.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.1 tmtm? -71.71 -49.8 36.08 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 177.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 23.7 mm -55.49 -34.14 34.1 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 CA-C-O 121.322 0.582 . . . . 0.0 110.566 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.508 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 5.7 mmmm -70.98 -38.6 72.75 Favored 'General case' 0 N--CA 1.497 1.886 0 C-N-CA 120.167 -0.613 . . . . 0.0 110.299 -176.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.9 t -59.91 -23.52 63.57 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.461 -0.775 . . . . 0.0 110.816 -179.564 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -117.52 -21.04 8.78 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.484 -0.76 . . . . 0.0 111.116 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 48.5 m80 -121.96 96.45 46.79 Favored Pre-proline 0 N--CA 1.495 1.824 0 O-C-N 121.348 -0.845 . . . . 0.0 109.784 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -75.38 -28.75 8.29 Favored 'Trans proline' 0 C--N 1.315 -1.185 0 O-C-N 123.416 1.219 . . . . 0.0 110.455 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -84.14 -13.83 73.32 Favored Glycine 0 N--CA 1.488 2.127 0 N-CA-C 110.504 -1.038 . . . . 0.0 110.504 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.08 82.8 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.334 -1.097 . . . . 0.0 110.892 -179.522 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 33.4 t -75.05 171.54 13.93 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.506 -0.746 . . . . 0.0 109.78 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 40.8 mm -52.12 -27.73 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.175 0 O-C-N 121.284 -0.885 . . . . 0.0 110.369 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -61.42 -71.63 0.77 Allowed Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.227 -1.549 . . . . 0.0 109.227 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -67.33 -26.04 66.3 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.628 -0.925 . . . . 0.0 110.765 179.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 56.2 m -68.46 -28.79 67.36 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.458 -0.777 . . . . 0.0 109.926 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.58 -47.13 34.25 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.536 -0.728 . . . . 0.0 109.747 179.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -81.49 -14.71 56.67 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.573 -0.704 . . . . 0.0 111.366 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 6.9 tptt -76.4 -58.82 3.06 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.085 -1.009 . . . . 0.0 109.727 179.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 45.0 mt -48.28 -27.09 2.29 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.493 -0.754 . . . . 0.0 111.287 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.92 -38.73 96.5 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 109.17 -1.572 . . . . 0.0 109.17 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -51.7 -39.34 58.14 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.524 -0.986 . . . . 0.0 110.852 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.0 mmt -72.91 -45.63 57.07 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.617 -0.677 . . . . 0.0 109.516 179.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 51.7 t-105 -52.14 -58.16 7.41 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.671 -0.643 . . . . 0.0 110.771 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 9.0 t -59.35 -32.6 70.26 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.453 -0.779 . . . . 0.0 110.305 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -63.68 -42.33 98.04 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.574 -0.704 . . . . 0.0 109.945 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -64.43 154.93 34.21 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.651 -0.655 . . . . 0.0 110.404 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 76.2 p -99.31 -150.15 0.37 Allowed 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.94 57.41 3.06 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.203 -0.935 . . . . 0.0 110.15 179.656 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 22.5 tttt -134.99 -43.25 0.73 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.352 -0.842 . . . . 0.0 110.212 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -63.41 -32.29 73.69 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.487 -0.758 . . . . 0.0 110.56 -179.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.2 ttpt -91.83 22.97 3.86 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.332 -0.855 . . . . 0.0 111.325 -179.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.438 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 8.0 mm-40 -96.95 -59.98 0.15 Allowed Pre-proline 0 N--CA 1.497 1.881 0 O-C-N 121.103 -0.998 . . . . 0.0 110.843 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.438 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.4 Cg_endo -80.45 -30.29 2.04 Favored 'Trans proline' 0 N--CA 1.486 1.047 0 O-C-N 122.871 0.932 . . . . 0.0 110.897 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -82.49 -8.92 59.6 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.492 -0.755 . . . . 0.0 112.01 -178.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -84.3 -25.37 29.34 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.095 -1.003 . . . . 0.0 111.113 -179.331 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -79.09 -21.94 45.96 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.461 -0.774 . . . . 0.0 110.791 -179.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 44.9 tttt -66.0 -44.05 85.92 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.336 -0.853 . . . . 0.0 109.858 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -79.9 -15.13 57.96 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.534 -0.728 . . . . 0.0 110.134 179.411 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.02 -31.33 69.85 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.269 -0.894 . . . . 0.0 109.42 179.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -74.1 -62.75 1.4 Allowed 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 178.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -43.61 -25.36 0.16 Allowed 'General case' 0 N--CA 1.506 2.336 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -179.297 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -65.02 -44.22 89.89 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.223 -0.923 . . . . 0.0 109.169 178.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -66.24 -57.4 7.65 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.755 -0.59 . . . . 0.0 109.787 179.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.7 mptm? -51.31 -31.31 21.12 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.397 -0.815 . . . . 0.0 110.718 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 34.8 t80 -75.62 -64.37 1.09 Allowed 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 179.095 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -59.67 -17.81 37.03 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.881 -0.512 . . . . 0.0 111.322 -179.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.4 mmmt -99.47 -23.75 15.01 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.169 -0.957 . . . . 0.0 111.45 -179.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -103.95 -28.66 11.43 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.27 -0.894 . . . . 0.0 110.983 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.1 tp -65.74 -36.02 76.56 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 121.427 -0.796 . . . . 0.0 110.186 -179.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.45 -48.48 80.98 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.548 -0.72 . . . . 0.0 109.801 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.52 -22.53 57.05 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.726 -0.609 . . . . 0.0 110.104 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -67.54 -31.39 71.45 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.502 -0.749 . . . . 0.0 109.944 179.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 19.8 mtp85 -107.07 8.4 30.25 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.55 -0.719 . . . . 0.0 110.923 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 55.19 73.83 0.4 Allowed 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.041 -1.037 . . . . 0.0 110.598 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 117.931 -1.033 . . . . 0.0 110.3 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 36.6 ttm . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 121.17 0.51 . . . . 0.0 110.236 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.23 -169.35 2.48 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.52 -0.738 . . . . 0.0 110.149 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.6 tttt 53.99 -168.63 0.06 Allowed 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.424 -0.798 . . . . 0.0 110.611 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.67 174.53 10.56 Favored 'General case' 0 C--N 1.307 -1.258 0 O-C-N 121.571 -0.706 . . . . 0.0 110.129 -179.867 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -99.68 156.67 35.1 Favored Pre-proline 0 N--CA 1.494 1.73 0 O-C-N 121.661 -0.649 . . . . 0.0 110.132 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.99 -21.04 28.29 Favored 'Trans proline' 0 C--N 1.317 -1.098 0 O-C-N 123.392 1.206 . . . . 0.0 110.858 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -96.51 -27.81 14.69 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.465 -0.772 . . . . 0.0 110.132 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -105.88 101.05 31.16 Favored Pre-proline 0 N--CA 1.493 1.713 0 O-C-N 121.501 -0.75 . . . . 0.0 110.156 179.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -71.87 86.63 0.89 Allowed 'Trans proline' 0 C--N 1.317 -1.113 0 O-C-N 123.167 1.088 . . . . 0.0 110.218 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.53 -155.0 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.63 -0.669 . . . . 0.0 110.323 -179.715 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -61.0 133.92 92.67 Favored Pre-proline 0 N--CA 1.497 1.899 0 O-C-N 121.492 -0.755 . . . . 0.0 110.153 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.424 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.8 Cg_endo -76.82 137.72 18.08 Favored 'Trans proline' 0 C--N 1.319 -0.992 0 O-C-N 123.192 1.101 . . . . 0.0 109.847 179.4 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -79.29 -169.41 0.79 Allowed 'Trans proline' 0 C--N 1.316 -1.177 0 O-C-N 123.174 1.092 . . . . 0.0 110.154 -179.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 66.5 p -163.0 63.67 0.19 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.439 -0.788 . . . . 0.0 110.92 -179.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 66.49 -78.06 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.002 -1.061 . . . . 0.0 110.518 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -48.47 -48.19 37.9 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.351 -0.843 . . . . 0.0 111.447 -179.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -59.78 -33.99 72.42 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.583 -0.698 . . . . 0.0 109.737 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 42.4 mt -72.29 -33.03 67.12 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.707 -0.621 . . . . 0.0 109.488 179.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.492 ' CZ ' ' CZ ' ' A' ' 23' ' ' TYR . 22.9 t80 -73.3 -52.48 13.76 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.78 -0.575 . . . . 0.0 110.489 -179.758 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 17.0 p -60.81 -31.79 71.18 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.477 -0.764 . . . . 0.0 110.38 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 91.8 p -71.14 -23.86 62.16 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.781 -0.574 . . . . 0.0 112.111 -178.451 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.9 -24.71 9.39 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.022 -1.049 . . . . 0.0 112.384 -178.611 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.492 ' CZ ' ' CZ ' ' A' ' 19' ' ' PHE . 4.9 m-85 -80.33 -36.93 33.51 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 120.925 -1.109 . . . . 0.0 111.099 -179.207 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.492 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 10.3 mtp180 -48.0 -52.91 36.85 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.319 -0.863 . . . . 0.0 112.198 -179.61 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.492 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 36.2 Cg_endo -59.67 -27.7 85.57 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 O-C-N 123.274 1.144 . . . . 0.0 110.261 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.8 tmtm? -69.63 -45.95 67.33 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 177.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.2 mm -57.77 -29.67 35.72 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.28 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.509 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 5.4 mmmm -73.09 -35.49 66.63 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 119.968 -0.693 . . . . 0.0 110.571 -177.183 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 28.9 t -66.27 -22.6 66.31 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.445 -0.784 . . . . 0.0 110.62 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -116.19 -16.06 11.01 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.528 -0.733 . . . . 0.0 111.142 -179.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 44.6 m80 -129.83 94.75 30.76 Favored Pre-proline 0 N--CA 1.497 1.889 0 O-C-N 121.306 -0.871 . . . . 0.0 109.238 179.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -74.72 -36.09 3.03 Favored 'Trans proline' 0 C--N 1.316 -1.148 0 O-C-N 123.514 1.27 . . . . 0.0 110.479 -179.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -75.34 -19.17 79.71 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 110.051 -1.22 . . . . 0.0 110.051 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.11 86.28 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.522 -0.987 . . . . 0.0 111.378 -179.385 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.404 ' N ' ' O ' ' A' ' 33' ' ' GLY . 42.8 t -80.34 171.24 15.32 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.549 -0.719 . . . . 0.0 109.471 179.552 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 43.3 mm -53.33 -26.2 11.92 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 O-C-N 121.326 -0.859 . . . . 0.0 110.347 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -61.08 -71.77 0.74 Allowed Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.238 -1.545 . . . . 0.0 109.238 179.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.405 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 16.4 t70 -69.32 -28.22 66.06 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.688 -0.889 . . . . 0.0 110.502 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 86.6 m -68.68 -32.27 71.98 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.413 -0.804 . . . . 0.0 109.769 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.89 -39.61 76.14 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 120.073 -0.651 . . . . 0.0 109.484 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -91.51 -15.12 29.24 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.644 -0.66 . . . . 0.0 111.493 -179.399 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 30.7 tptt -83.29 1.14 42.5 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.022 -1.049 . . . . 0.0 110.526 179.378 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 25.7 mt -97.45 -35.1 10.77 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.12 -0.987 . . . . 0.0 108.958 178.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.35 -31.98 71.75 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 108.841 -1.704 . . . . 0.0 108.841 179.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -55.35 -47.63 75.45 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.595 -0.944 . . . . 0.0 110.179 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 16.2 mtp -70.61 -48.98 52.43 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 70.0 t-105 -52.92 -58.42 7.01 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.708 -0.62 . . . . 0.0 110.555 179.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 46.6 t -60.76 -34.34 74.31 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.472 -0.767 . . . . 0.0 110.26 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -58.02 -39.11 77.52 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.603 -0.686 . . . . 0.0 110.26 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 57.5 mm-40 -67.54 164.96 17.83 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.592 -0.692 . . . . 0.0 110.075 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.1 m -150.09 107.2 3.58 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.544 -0.723 . . . . 0.0 110.17 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 53.01 47.1 25.41 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.347 -0.845 . . . . 0.0 110.655 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.9 mtpt -149.26 -64.76 0.23 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.556 -0.715 . . . . 0.0 109.86 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -59.78 -31.28 69.53 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.5 -0.75 . . . . 0.0 110.562 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.4 tttm -96.05 22.36 7.64 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.427 -0.796 . . . . 0.0 111.191 -179.447 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.422 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 1.3 mm-40 -99.1 -55.02 0.18 Allowed Pre-proline 0 N--CA 1.496 1.842 0 O-C-N 121.195 -0.941 . . . . 0.0 110.61 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.422 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.0 Cg_endo -83.73 -36.76 0.18 Allowed 'Trans proline' 0 C--N 1.321 -0.873 0 O-C-N 122.925 0.961 . . . . 0.0 110.825 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -80.6 5.33 15.76 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.539 -0.725 . . . . 0.0 111.787 -179.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.8 -20.35 17.59 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.079 -1.013 . . . . 0.0 110.619 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -77.67 -24.33 49.38 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.441 -0.787 . . . . 0.0 110.364 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 26.4 tttp -58.81 -45.36 90.09 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.409 -0.807 . . . . 0.0 110.027 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.7 -10.08 59.24 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.596 -0.69 . . . . 0.0 110.58 179.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -86.31 2.97 45.35 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.253 -0.905 . . . . 0.0 110.503 179.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 24.4 mmtp -105.12 -32.86 8.49 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.231 -0.918 . . . . 0.0 109.462 179.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.8 mp -80.83 4.25 19.8 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.909 -0.494 . . . . 0.0 111.039 179.553 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -97.29 -26.76 14.79 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.141 -0.974 . . . . 0.0 109.926 179.503 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -84.71 -14.52 48.13 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.521 -0.737 . . . . 0.0 110.62 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.4 mmtt -103.57 -29.19 11.28 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.309 -0.869 . . . . 0.0 109.711 179.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.424 ' CE2' ' HD3' ' A' ' 12' ' ' PRO . 11.6 t80 -75.26 -53.34 8.95 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.63 -0.669 . . . . 0.0 109.628 179.71 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -63.99 -13.34 45.63 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.618 -0.676 . . . . 0.0 111.494 -179.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.4 mmtm -108.1 -32.42 7.53 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.129 -0.982 . . . . 0.0 110.901 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -89.69 -36.39 15.25 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.443 -0.785 . . . . 0.0 111.281 -179.079 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.7 tp -65.59 -18.78 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 O-C-N 121.27 -0.894 . . . . 0.0 110.864 -179.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.73 -45.77 70.63 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.296 -0.877 . . . . 0.0 109.858 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -87.03 -26.03 23.93 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.633 -0.667 . . . . 0.0 110.216 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -61.96 -50.04 73.69 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.546 -0.722 . . . . 0.0 110.05 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 61.8 mtt-85 -106.04 10.32 32.21 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.54 -0.725 . . . . 0.0 111.034 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 56.63 69.82 0.71 Allowed 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.084 -1.01 . . . . 0.0 110.346 -179.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.7 tptt . . . . . 0 N--CA 1.494 1.736 0 CA-C-O 117.936 -1.03 . . . . 0.0 110.244 -179.967 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.0 ttp . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.054 0.454 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.26 160.89 17.84 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.595 -0.691 . . . . 0.0 110.217 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 10.2 tttt -169.97 151.66 4.14 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.545 -0.722 . . . . 0.0 110.186 179.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.5 -71.53 0.13 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.585 -0.697 . . . . 0.0 110.423 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -163.65 156.84 16.06 Favored Pre-proline 0 N--CA 1.493 1.715 0 O-C-N 121.583 -0.698 . . . . 0.0 110.202 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.64 -46.32 0.46 Allowed 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.457 1.241 . . . . 0.0 110.415 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -81.31 2.7 27.02 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.573 -0.704 . . . . 0.0 111.166 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -93.92 142.34 24.9 Favored Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.144 -0.973 . . . . 0.0 110.037 179.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.423 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 53.3 Cg_endo -78.91 87.45 1.55 Allowed 'Trans proline' 0 C--N 1.318 -1.041 0 O-C-N 123.22 1.116 . . . . 0.0 110.282 -179.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -110.0 26.34 10.77 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.465 -0.772 . . . . 0.0 110.98 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.5 ttm180 -159.19 94.61 1.77 Allowed Pre-proline 0 N--CA 1.493 1.681 0 O-C-N 121.734 -0.604 . . . . 0.0 110.488 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -76.98 114.05 3.74 Favored 'Trans proline' 0 C--N 1.317 -1.127 0 O-C-N 123.491 1.259 . . . . 0.0 110.491 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -81.04 164.65 19.8 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 O-C-N 123.282 1.149 . . . . 0.0 110.251 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 94.6 p -157.06 53.9 0.51 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.43 -0.794 . . . . 0.0 110.806 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 68.12 -76.57 0.05 Allowed 'General case' 0 N--CA 1.503 2.221 0 O-C-N 121.135 -0.978 . . . . 0.0 109.993 -179.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -48.16 -50.62 28.21 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.315 -0.866 . . . . 0.0 111.227 -179.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -57.52 -40.09 77.97 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.596 -0.69 . . . . 0.0 109.528 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.3 mt -64.43 -44.26 91.74 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.757 -0.589 . . . . 0.0 110.242 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -66.3 -51.81 53.59 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.573 -0.705 . . . . 0.0 110.359 -179.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 48.1 t -66.77 -21.39 66.06 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.579 -0.7 . . . . 0.0 110.299 179.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.9 m -73.57 -20.63 60.57 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.383 -0.823 . . . . 0.0 111.728 -179.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -127.15 -14.28 5.48 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.017 -1.052 . . . . 0.0 112.972 -178.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -88.69 16.02 7.33 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 120.774 -1.204 . . . . 0.0 111.73 -178.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.456 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 33.2 mtp180 -92.16 -44.27 0.35 Allowed Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.197 -0.939 . . . . 0.0 112.543 179.615 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.492 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.1 Cg_endo -66.82 -15.15 46.4 Favored 'Trans proline' 0 N--CA 1.49 1.307 0 O-C-N 122.917 0.956 . . . . 0.0 110.382 -179.299 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.76 -54.28 8.42 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 177.531 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 38.2 mm -51.2 -26.02 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.985 0 O-C-N 121.89 -0.507 . . . . 0.0 110.738 179.381 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.492 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 6.8 mmmm -78.22 -31.71 49.46 Favored 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 119.84 -0.744 . . . . 0.0 110.014 -177.853 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 15.1 t -67.09 -21.96 65.84 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.563 -0.711 . . . . 0.0 110.525 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -119.54 -13.67 9.18 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.384 -0.822 . . . . 0.0 111.282 -179.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -130.63 94.75 28.38 Favored Pre-proline 0 N--CA 1.497 1.899 0 O-C-N 121.19 -0.944 . . . . 0.0 109.502 179.453 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -75.25 -35.45 2.96 Favored 'Trans proline' 0 C--N 1.316 -1.173 0 O-C-N 123.575 1.303 . . . . 0.0 110.061 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.15 -15.33 81.5 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 179.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.62 87.78 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.327 -1.102 . . . . 0.0 110.887 -179.611 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 80.1 p -79.91 169.19 18.25 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.594 -0.691 . . . . 0.0 109.56 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 36.9 mm -50.01 -27.02 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.237 0 O-C-N 121.449 -0.782 . . . . 0.0 110.379 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.435 ' O ' ' HD3' ' A' ' 41' ' ' LYS . . . -58.95 -68.78 1.52 Allowed Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.135 -1.586 . . . . 0.0 109.135 179.554 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -78.09 -15.97 58.41 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.719 -0.871 . . . . 0.0 111.876 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 51.2 m -61.49 -40.88 96.18 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.023 -1.048 . . . . 0.0 109.277 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.58 -37.69 87.4 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.32 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.435 ' HD3' ' O ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -70.15 -31.72 69.35 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.789 -0.57 . . . . 0.0 110.133 -179.481 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.51 -11.75 60.55 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.26 -0.9 . . . . 0.0 110.515 179.683 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 77.2 mt -97.04 -27.87 14.41 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.301 -0.874 . . . . 0.0 110.172 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -89.63 -46.34 4.32 Favored Glycine 0 N--CA 1.493 2.472 0 N-CA-C 109.629 -1.389 . . . . 0.0 109.629 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -51.43 -31.9 24.62 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.388 -1.066 . . . . 0.0 110.825 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 75.7 mtp -87.77 -41.47 13.27 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.563 -0.711 . . . . 0.0 109.817 179.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -57.2 -22.2 38.99 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.609 -0.682 . . . . 0.0 110.804 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -94.04 -35.67 12.48 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.381 -0.825 . . . . 0.0 110.131 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -61.38 -34.23 74.98 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.524 -0.735 . . . . 0.0 109.968 179.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -58.04 150.2 21.52 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.572 -0.705 . . . . 0.0 110.507 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 17.1 t -89.43 -151.63 0.23 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.616 -0.678 . . . . 0.0 109.588 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -84.01 54.66 3.0 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.249 -0.907 . . . . 0.0 110.181 179.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.4 mttp -136.87 -41.59 0.6 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.473 -0.767 . . . . 0.0 110.435 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -62.31 -37.45 85.63 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.522 -0.736 . . . . 0.0 110.388 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -96.28 20.41 10.45 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.371 -0.83 . . . . 0.0 110.918 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.453 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 3.7 mt-30 -88.33 -59.03 0.26 Allowed Pre-proline 0 N--CA 1.496 1.867 0 O-C-N 121.165 -0.959 . . . . 0.0 109.759 179.571 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.453 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 57.3 Cg_endo -81.58 -23.89 4.63 Favored 'Trans proline' 0 C--N 1.32 -0.971 0 O-C-N 122.99 0.995 . . . . 0.0 110.353 179.013 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -81.56 -20.31 40.19 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.59 -0.694 . . . . 0.0 111.827 -178.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -82.37 -22.06 35.63 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.145 -0.972 . . . . 0.0 110.79 -179.564 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -84.02 -24.09 30.65 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.379 -0.825 . . . . 0.0 110.422 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -62.39 -47.29 84.78 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.44 -0.787 . . . . 0.0 109.778 179.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -74.53 -9.44 58.58 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.595 -0.691 . . . . 0.0 110.916 179.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.64 -0.61 55.58 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.3 -0.875 . . . . 0.0 110.283 179.015 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 47.7 mmtt -105.48 -29.18 10.37 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.21 -0.931 . . . . 0.0 109.943 179.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.2 mp -86.85 -14.23 42.66 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.963 -0.461 . . . . 0.0 110.031 178.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.8 tptt -76.3 -30.35 57.7 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.284 -0.885 . . . . 0.0 109.469 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -67.42 -59.72 3.16 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.651 -0.655 . . . . 0.0 109.484 179.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.9 mmpt? -60.25 -25.71 65.88 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.641 -0.662 . . . . 0.0 110.511 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.423 ' CD2' ' HB2' ' A' ' 9' ' ' PRO . 21.4 t80 -71.5 -65.14 0.79 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.37 -0.831 . . . . 0.0 109.255 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -61.29 -17.5 53.86 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.836 -0.54 . . . . 0.0 111.082 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -98.62 -20.83 16.78 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.283 -0.885 . . . . 0.0 111.568 -179.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -106.36 -32.69 8.03 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.23 -0.919 . . . . 0.0 111.064 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 8.4 tp -65.72 -30.58 50.54 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 O-C-N 121.419 -0.801 . . . . 0.0 110.372 -179.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.9 -58.24 8.69 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.611 -0.681 . . . . 0.0 109.964 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.37 -19.84 65.91 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.572 -0.705 . . . . 0.0 110.399 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -74.51 -38.78 62.73 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.372 -0.83 . . . . 0.0 110.125 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 8.9 mtt180 -71.42 -81.05 0.05 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.559 -0.713 . . . . 0.0 110.036 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -168.92 38.17 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.285 -0.884 . . . . 0.0 110.066 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.6 mtmm . . . . . 0 N--CA 1.494 1.772 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.196 -179.921 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 37.8 ttm . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 121.099 0.476 . . . . 0.0 110.187 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.9 mttm -133.11 26.61 4.22 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.578 -0.701 . . . . 0.0 110.397 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.4 tttt -65.02 -162.0 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.58 -0.7 . . . . 0.0 110.223 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.2 mtpt -144.72 -146.86 0.2 Allowed 'General case' 0 N--CA 1.485 1.283 0 O-C-N 121.626 -0.671 . . . . 0.0 109.239 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -92.33 163.22 27.61 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.088 -1.008 . . . . 0.0 110.208 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -73.06 -29.52 11.74 Favored 'Trans proline' 0 C--N 1.317 -1.13 0 O-C-N 123.452 1.238 . . . . 0.0 110.495 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 18.3 p-10 -101.81 29.34 5.02 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.606 -0.683 . . . . 0.0 110.275 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -100.11 134.78 20.62 Favored Pre-proline 0 N--CA 1.494 1.726 0 O-C-N 121.646 -0.659 . . . . 0.0 110.178 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -72.84 69.5 3.69 Favored 'Trans proline' 0 C--N 1.318 -1.042 0 O-C-N 123.209 1.11 . . . . 0.0 110.008 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 35.87 -156.49 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.324 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 178.596 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -108.43 153.92 41.78 Favored Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.583 -0.698 . . . . 0.0 109.483 179.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -73.15 113.96 3.91 Favored 'Trans proline' 0 C--N 1.316 -1.155 0 O-C-N 123.316 1.166 . . . . 0.0 110.803 -179.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -82.98 173.18 10.34 Favored 'Trans proline' 0 C--N 1.318 -1.045 0 O-C-N 123.37 1.194 . . . . 0.0 110.122 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 42.2 t -165.4 63.33 0.12 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.492 -0.755 . . . . 0.0 110.616 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 66.64 -77.25 0.04 OUTLIER 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.114 -0.991 . . . . 0.0 110.361 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -47.7 -49.49 27.66 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.302 -0.874 . . . . 0.0 111.401 -179.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -59.07 -35.86 74.08 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.616 -0.677 . . . . 0.0 109.945 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 23.0 mt -74.27 -32.62 62.99 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.624 -0.673 . . . . 0.0 110.323 -179.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.422 ' CE1' ' CZ ' ' A' ' 23' ' ' TYR . 68.1 t80 -79.65 -55.26 5.15 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.498 -0.751 . . . . 0.0 110.647 -179.363 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.9 t -57.15 -54.58 45.13 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.526 -0.734 . . . . 0.0 110.686 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.1 t -55.74 -22.49 24.13 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.438 -0.788 . . . . 0.0 110.982 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 41.1 mm-40 -100.93 -25.1 14.2 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.406 -0.809 . . . . 0.0 110.936 -179.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.422 ' CZ ' ' CE1' ' A' ' 19' ' ' PHE . 10.9 m-85 -96.71 12.43 31.94 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.395 -0.815 . . . . 0.0 111.522 -179.376 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.484 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 50.9 mtt180 -87.04 -45.02 0.53 Allowed Pre-proline 0 N--CA 1.489 1.482 0 O-C-N 121.226 -0.921 . . . . 0.0 112.164 179.538 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.497 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.1 Cg_endo -66.71 -15.67 48.11 Favored 'Trans proline' 0 N--CA 1.49 1.308 0 O-C-N 122.89 0.942 . . . . 0.0 110.484 -179.231 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -72.88 -50.19 25.32 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 177.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 28.0 mm -54.62 -32.96 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 CA-C-O 121.377 0.608 . . . . 0.0 110.288 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.502 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 5.0 mmmm -72.3 -36.59 68.98 Favored 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.3 -177.149 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.8 t -60.02 -25.76 65.56 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.551 -0.718 . . . . 0.0 110.661 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -115.35 -22.73 9.22 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.545 -0.722 . . . . 0.0 110.766 -179.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 39.2 m80 -121.41 96.07 48.01 Favored Pre-proline 0 N--CA 1.496 1.865 0 O-C-N 121.485 -0.76 . . . . 0.0 109.596 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -75.21 -31.17 6.16 Favored 'Trans proline' 0 C--N 1.315 -1.221 0 O-C-N 123.393 1.207 . . . . 0.0 110.344 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.409 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -80.38 -16.37 76.23 Favored Glycine 0 N--CA 1.489 2.193 0 N-CA-C 110.298 -1.121 . . . . 0.0 110.298 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.16 82.64 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.408 -1.054 . . . . 0.0 111.222 -179.356 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.409 ' N ' ' O ' ' A' ' 33' ' ' GLY . 71.8 m -69.55 172.43 7.34 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.479 -0.763 . . . . 0.0 109.701 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.5 mp -56.15 -28.39 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.108 0 O-C-N 121.273 -0.892 . . . . 0.0 109.735 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.79 -65.34 3.39 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.235 -1.546 . . . . 0.0 109.235 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -70.02 -30.82 68.22 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.604 -0.939 . . . . 0.0 110.466 179.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 54.7 m -63.97 -30.66 71.72 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.494 -0.754 . . . . 0.0 109.96 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.78 -43.29 47.19 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.562 -0.711 . . . . 0.0 110.118 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -87.72 -10.02 52.38 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.62 -0.675 . . . . 0.0 111.695 -179.525 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.42 -60.99 2.11 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.05 -1.031 . . . . 0.0 109.683 179.571 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 21.8 mt -49.23 -25.66 2.43 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.518 -0.739 . . . . 0.0 111.378 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -66.28 -36.89 92.34 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 109.365 -1.494 . . . . 0.0 109.365 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -51.92 -34.61 42.35 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.474 -1.015 . . . . 0.0 111.016 -179.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 7.6 mtt -85.14 -43.01 14.23 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.495 -0.753 . . . . 0.0 109.998 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . 0.421 ' CH2' ' HG2' ' A' ' 55' ' ' LYS . 64.4 t-105 -51.19 -36.69 42.58 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.528 -0.733 . . . . 0.0 111.174 -179.532 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 6.9 t -85.53 -27.8 25.34 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.438 -0.789 . . . . 0.0 110.117 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -58.63 -39.04 79.39 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.479 -0.763 . . . . 0.0 110.113 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.28 167.33 16.58 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.58 -0.7 . . . . 0.0 109.749 179.523 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.4 m -146.57 101.39 3.46 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.608 -0.683 . . . . 0.0 110.498 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 51.51 48.55 22.71 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.409 -0.807 . . . . 0.0 110.969 179.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 14.1 tttp -141.6 -65.57 0.42 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.553 -0.717 . . . . 0.0 110.236 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -64.48 -24.88 67.77 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.524 -0.735 . . . . 0.0 110.721 -179.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.421 ' HG2' ' CH2' ' A' ' 47' ' ' TRP . 39.9 mtpt -80.45 -35.14 35.34 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.476 -0.765 . . . . 0.0 110.759 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -46.4 -53.22 24.88 Favored Pre-proline 0 N--CA 1.505 2.303 0 O-C-N 121.51 -0.744 . . . . 0.0 112.021 -179.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -77.62 -39.98 0.47 Allowed 'Trans proline' 0 C--N 1.314 -1.257 0 O-C-N 123.171 1.09 . . . . 0.0 110.956 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -80.21 5.33 14.86 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.453 -0.779 . . . . 0.0 112.07 -178.404 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.32 -18.68 16.68 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.876 -1.14 . . . . 0.0 110.727 179.466 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -79.86 -28.12 40.02 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.261 -0.9 . . . . 0.0 110.224 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 45.6 tttm -60.25 -41.24 92.77 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.544 -0.722 . . . . 0.0 110.097 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.05 -10.93 60.03 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.596 -0.69 . . . . 0.0 110.817 179.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -90.27 6.17 44.04 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.122 -0.986 . . . . 0.0 110.634 179.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -106.2 -36.94 6.73 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.254 -0.903 . . . . 0.0 109.028 178.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 6.8 mp -76.85 -0.08 22.75 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.912 -0.493 . . . . 0.0 111.07 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 19.1 tttm -91.3 -22.83 20.35 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.062 -1.024 . . . . 0.0 110.005 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -84.02 -16.16 44.94 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.475 -0.765 . . . . 0.0 110.522 179.55 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -102.2 -27.57 12.8 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.307 -0.871 . . . . 0.0 109.981 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 17.0 t80 -78.05 -51.05 10.92 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.62 -0.675 . . . . 0.0 109.799 179.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -60.67 -15.53 29.68 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.783 -0.573 . . . . 0.0 111.419 -179.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -107.3 -30.47 8.7 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.092 -1.005 . . . . 0.0 110.056 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -86.14 -31.27 21.92 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.559 -0.713 . . . . 0.0 110.488 -179.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 6.0 tp -66.36 -29.48 46.76 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.539 -0.725 . . . . 0.0 109.993 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -50.63 -32.77 19.94 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.603 -0.686 . . . . 0.0 110.749 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -76.08 -8.0 56.0 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.609 -0.682 . . . . 0.0 110.568 179.282 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -105.77 -2.68 22.91 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.238 -0.914 . . . . 0.0 110.713 179.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 13.3 mtt180 -119.64 -29.02 5.16 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.31 -0.869 . . . . 0.0 110.771 -179.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 52.83 74.85 0.27 Allowed 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.206 -0.934 . . . . 0.0 110.724 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.791 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.293 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.9 ttp . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 121.121 0.486 . . . . 0.0 110.187 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.5 mttm -89.02 178.89 6.28 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.576 -0.703 . . . . 0.0 110.291 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt 52.79 94.55 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.494 -0.754 . . . . 0.0 110.784 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 46.2 mttm -60.02 -70.62 0.16 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.696 -0.627 . . . . 0.0 110.389 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -118.24 165.98 14.94 Favored Pre-proline 0 N--CA 1.494 1.736 0 O-C-N 121.62 -0.675 . . . . 0.0 110.354 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.52 -20.79 23.21 Favored 'Trans proline' 0 C--N 1.317 -1.116 0 O-C-N 123.426 1.224 . . . . 0.0 110.809 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -105.6 -24.64 12.53 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.399 -0.813 . . . . 0.0 110.322 179.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -81.08 141.63 50.61 Favored Pre-proline 0 N--CA 1.493 1.721 0 O-C-N 121.517 -0.739 . . . . 0.0 110.114 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -74.24 138.24 24.75 Favored 'Trans proline' 0 C--N 1.317 -1.108 0 O-C-N 123.299 1.157 . . . . 0.0 110.27 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.31 -165.98 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.522 -0.736 . . . . 0.0 109.993 179.823 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -70.57 145.8 93.08 Favored Pre-proline 0 N--CA 1.496 1.874 0 O-C-N 121.429 -0.795 . . . . 0.0 110.207 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.426 ' HD3' ' CZ ' ' A' ' 69' ' ' TYR . 47.8 Cg_endo -76.25 128.85 10.8 Favored 'Trans proline' 0 C--N 1.318 -1.04 0 O-C-N 123.342 1.18 . . . . 0.0 109.993 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -81.65 -175.82 2.77 Favored 'Trans proline' 0 C--N 1.318 -1.048 0 O-C-N 123.24 1.126 . . . . 0.0 110.181 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 33.6 t -168.74 56.77 0.05 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.53 -0.731 . . . . 0.0 110.628 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 70.32 -76.92 0.06 Allowed 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.15 -0.969 . . . . 0.0 110.198 -179.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -49.19 -49.81 40.98 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.228 -0.92 . . . . 0.0 111.058 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -57.88 -37.72 74.47 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.604 -0.685 . . . . 0.0 109.457 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.3 mt -67.06 -45.48 77.24 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.725 -0.609 . . . . 0.0 109.992 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -63.58 -50.17 70.5 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.541 -0.724 . . . . 0.0 109.728 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.9 t -62.87 -29.38 70.71 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 120.05 -0.66 . . . . 0.0 109.597 179.309 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 65.4 p -95.26 14.74 21.29 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.627 -0.671 . . . . 0.0 111.034 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -139.51 -5.02 1.41 Allowed 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.137 -0.977 . . . . 0.0 111.965 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -121.19 -29.22 4.56 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.902 -1.124 . . . . 0.0 110.895 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.486 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 5.9 mtt180 -47.64 -53.28 31.75 Favored Pre-proline 0 N--CA 1.498 1.944 0 O-C-N 121.284 -0.885 . . . . 0.0 112.491 -179.506 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.486 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 35.3 Cg_endo -58.61 -27.74 83.79 Favored 'Trans proline' 0 N--CA 1.495 1.611 0 O-C-N 123.188 1.099 . . . . 0.0 110.202 -179.594 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -69.23 -45.73 69.11 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 177.505 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.9 mm -60.4 -17.46 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.847 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.487 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 8.2 mmmm -86.89 -27.37 23.46 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.078 -1.014 . . . . 0.0 110.39 -177.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 6.6 t -70.11 -14.32 62.6 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.425 -0.797 . . . . 0.0 110.992 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -133.26 2.47 3.57 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.14 -0.975 . . . . 0.0 111.784 -179.551 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 31.5 m80 -142.39 93.46 7.1 Favored Pre-proline 0 N--CA 1.498 1.927 0 O-C-N 121.073 -1.017 . . . . 0.0 109.298 179.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -75.0 -33.98 4.18 Favored 'Trans proline' 0 C--N 1.315 -1.204 0 O-C-N 123.52 1.274 . . . . 0.0 110.29 -179.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.407 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -72.48 -30.93 63.73 Favored Glycine 0 N--CA 1.487 2.076 0 N-CA-C 109.304 -1.518 . . . . 0.0 109.304 179.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -46.01 90.65 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.76 -0.847 . . . . 0.0 111.925 -179.487 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.407 ' N ' ' O ' ' A' ' 33' ' ' GLY . 22.8 t -88.72 170.94 10.35 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.558 -0.714 . . . . 0.0 109.596 179.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 3.2 mp -53.12 -24.63 8.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.073 0 O-C-N 121.372 -0.83 . . . . 0.0 110.26 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.3 -66.4 2.62 Favored Glycine 0 N--CA 1.493 2.467 0 N-CA-C 108.958 -1.657 . . . . 0.0 108.958 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -75.16 -28.29 60.04 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.755 -0.85 . . . . 0.0 110.216 179.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 88.3 m -68.87 -28.51 66.78 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.573 -0.704 . . . . 0.0 110.347 179.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -79.6 -25.37 41.51 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.453 -0.78 . . . . 0.0 109.975 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -105.17 -11.94 16.33 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.617 -0.677 . . . . 0.0 111.014 179.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.4 tptt -84.77 -10.76 56.9 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.026 -1.046 . . . . 0.0 110.483 179.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 28.8 mt -90.16 -31.99 16.83 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.331 -0.856 . . . . 0.0 109.294 179.096 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.53 -32.3 71.3 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 108.717 -1.753 . . . . 0.0 108.717 179.119 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -55.96 -40.05 72.67 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.62 -0.929 . . . . 0.0 110.576 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 9.2 mmt -78.73 -46.09 19.74 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.568 -0.708 . . . . 0.0 110.209 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . 0.43 ' CE2' ' HG2' ' A' ' 55' ' ' LYS . 67.1 t-105 -59.95 -17.3 36.89 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.543 -0.723 . . . . 0.0 111.245 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.6 t -103.48 -37.72 7.47 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.226 -0.921 . . . . 0.0 111.575 -179.095 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -75.12 -32.89 61.51 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.284 -0.885 . . . . 0.0 111.745 -178.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 13.5 mm-40 -59.27 156.78 11.86 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.21 -0.931 . . . . 0.0 110.919 -179.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 77.2 p -77.87 -137.8 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 179.161 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -90.5 36.1 0.89 Allowed 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.854 -1.154 . . . . 0.0 110.795 179.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 11.6 mptt -116.11 -35.56 4.35 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.359 -0.838 . . . . 0.0 109.67 179.483 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -92.92 53.66 2.04 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 108.485 -0.932 . . . . 0.0 108.485 178.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.43 ' HG2' ' CE2' ' A' ' 47' ' ' TRP . 0.0 OUTLIER -173.01 -65.18 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 179.696 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.406 ' CB ' ' CD ' ' A' ' 57' ' ' PRO . 0.3 OUTLIER -40.2 -58.05 2.53 Favored Pre-proline 0 N--CA 1.506 2.346 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -179.253 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.406 ' CD ' ' CB ' ' A' ' 56' ' ' GLN . 42.4 Cg_endo -67.37 -32.38 32.6 Favored 'Trans proline' 0 N--CA 1.488 1.16 0 O-C-N 123.072 1.038 . . . . 0.0 110.833 -179.285 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -82.99 -14.18 54.53 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.5 -0.75 . . . . 0.0 110.69 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.403 ' N ' ' O ' ' A' ' 55' ' ' LYS . 29.0 mm-40 -77.9 -64.03 1.25 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.348 -0.845 . . . . 0.0 110.132 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -53.05 -23.52 7.84 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.548 -0.72 . . . . 0.0 111.366 -179.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 66.4 tttt -63.08 -48.73 77.37 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.465 -0.772 . . . . 0.0 110.13 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -78.05 -16.31 58.16 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.559 -0.713 . . . . 0.0 110.176 179.187 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.7 -35.08 77.0 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.428 -0.795 . . . . 0.0 110.454 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 67.5 mmtt -74.58 -63.41 1.25 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.322 -0.861 . . . . 0.0 110.102 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.0 mp -45.59 -26.59 0.62 Allowed 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.599 -0.688 . . . . 0.0 111.882 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 32.4 tptt -65.68 -45.08 84.21 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.324 -0.86 . . . . 0.0 109.507 179.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -66.17 -55.16 17.73 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.665 -0.647 . . . . 0.0 110.121 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -55.0 -31.49 61.06 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.466 -0.771 . . . . 0.0 110.485 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.426 ' CZ ' ' HD3' ' A' ' 12' ' ' PRO . 76.5 t80 -75.92 -68.64 0.56 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.538 -0.726 . . . . 0.0 109.674 179.621 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -48.73 -28.45 3.62 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.687 -0.633 . . . . 0.0 111.284 -179.612 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.2 mmmt -86.22 -57.72 2.91 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.6 -0.687 . . . . 0.0 110.545 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -62.88 -30.92 71.9 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.504 -0.747 . . . . 0.0 110.968 -179.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.7 tp -72.12 -35.6 53.88 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 O-C-N 121.419 -0.8 . . . . 0.0 110.496 -179.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.6 -42.52 78.89 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.441 -0.787 . . . . 0.0 110.493 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.33 -11.52 54.45 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.631 -0.668 . . . . 0.0 110.821 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -79.35 -26.34 42.12 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.241 -0.912 . . . . 0.0 110.426 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 50.1 mtt180 -101.79 2.35 38.26 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.531 -0.731 . . . . 0.0 111.282 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 51.8 95.61 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.95 -1.094 . . . . 0.0 111.01 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.7 ptmt . . . . . 0 N--CA 1.493 1.723 0 CA-C-O 118.028 -0.986 . . . . 0.0 110.354 179.889 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.7 ttt . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.01 0.433 . . . . 0.0 110.188 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 3.1 mttm -106.87 94.99 5.41 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.62 -0.675 . . . . 0.0 110.222 179.918 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 71.1 tttt -170.19 132.68 1.07 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.456 -0.778 . . . . 0.0 110.247 179.926 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 38.6 mtpt -60.08 -72.28 0.11 Allowed 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.557 -0.714 . . . . 0.0 110.352 -179.96 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -163.91 157.47 15.96 Favored Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.59 -0.693 . . . . 0.0 110.34 -179.913 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -73.2 -37.87 3.1 Favored 'Trans proline' 0 C--N 1.317 -1.095 0 O-C-N 123.432 1.228 . . . . 0.0 110.444 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -79.21 -20.59 47.93 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.591 -0.693 . . . . 0.0 110.817 -179.491 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -99.38 135.26 20.74 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.379 -0.826 . . . . 0.0 109.729 179.521 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -72.05 108.59 2.5 Favored 'Trans proline' 0 C--N 1.319 -1.001 0 O-C-N 123.144 1.076 . . . . 0.0 110.561 -179.69 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -166.2 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.484 -0.76 . . . . 0.0 110.018 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.72 141.24 92.69 Favored Pre-proline 0 N--CA 1.497 1.913 0 O-C-N 121.509 -0.745 . . . . 0.0 109.938 179.943 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -74.37 132.56 16.46 Favored 'Trans proline' 0 C--N 1.317 -1.099 0 O-C-N 123.309 1.163 . . . . 0.0 109.972 179.786 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -81.12 -173.15 1.72 Allowed 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.184 1.097 . . . . 0.0 110.004 -179.737 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 31.1 t -167.98 59.41 0.07 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.41 -0.806 . . . . 0.0 110.549 -179.898 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 69.43 -75.76 0.07 Allowed 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.256 -0.902 . . . . 0.0 110.303 -179.527 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -47.3 -52.53 16.05 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.323 -0.861 . . . . 0.0 111.439 -179.388 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -58.1 -39.98 80.01 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.578 -0.701 . . . . 0.0 109.656 179.666 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 51.4 mt -62.32 -45.41 93.33 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.646 -0.659 . . . . 0.0 109.84 179.833 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.497 ' CZ ' ' CE2' ' A' ' 23' ' ' TYR . 43.0 t80 -68.48 -51.62 41.39 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.757 -0.59 . . . . 0.0 110.421 -179.649 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.6 m -56.4 -54.98 39.21 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.523 -0.735 . . . . 0.0 110.813 -179.613 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 88.7 p -57.42 -30.09 64.68 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.466 -0.771 . . . . 0.0 110.856 -179.666 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 -89.95 -23.55 21.52 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.475 -0.766 . . . . 0.0 111.302 -179.29 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.497 ' CE2' ' CZ ' ' A' ' 19' ' ' PHE . 9.0 m-85 -96.02 -34.25 11.83 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.352 -0.842 . . . . 0.0 110.927 -179.423 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.497 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 29.8 mtt-85 -48.28 -53.02 37.72 Favored Pre-proline 0 N--CA 1.498 1.959 0 O-C-N 121.376 -0.828 . . . . 0.0 112.109 -179.881 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.5 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.1 Cg_endo -59.38 -28.61 88.03 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 O-C-N 123.218 1.115 . . . . 0.0 110.155 179.968 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.0 tmtt? -68.89 -45.2 71.54 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 177.918 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 47.4 mm -58.93 -27.4 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.233 179.755 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.5 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.6 mmmm -75.66 -35.23 60.46 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 119.789 -0.765 . . . . 0.0 110.214 -177.53 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 13.4 t -64.94 -21.39 66.82 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.444 -0.785 . . . . 0.0 110.591 179.932 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -121.42 -10.36 8.89 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.307 -0.871 . . . . 0.0 111.415 -179.56 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -134.36 94.2 17.98 Favored Pre-proline 0 N--CA 1.497 1.911 0 O-C-N 121.227 -0.92 . . . . 0.0 109.449 179.175 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -74.95 -32.63 5.29 Favored 'Trans proline' 0 C--N 1.315 -1.198 0 O-C-N 123.531 1.28 . . . . 0.0 110.193 -179.679 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.411 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -76.36 -23.11 71.69 Favored Glycine 0 N--CA 1.488 2.118 0 N-CA-C 109.767 -1.333 . . . . 0.0 109.767 179.674 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -54.78 86.01 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.696 -0.885 . . . . 0.0 111.37 -179.548 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.411 ' N ' ' O ' ' A' ' 33' ' ' GLY . 75.7 m -77.6 172.09 13.92 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.466 -0.771 . . . . 0.0 109.523 179.573 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.2 mm -52.74 -30.02 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.133 0 O-C-N 121.31 -0.868 . . . . 0.0 110.322 -179.934 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.98 -66.64 2.55 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.197 -1.561 . . . . 0.0 109.197 179.7 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.87 -31.41 69.22 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.622 -0.928 . . . . 0.0 110.381 179.639 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 91.1 m -65.26 -31.35 72.46 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.403 -0.81 . . . . 0.0 110.0 179.514 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.89 -42.63 48.55 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.551 -0.718 . . . . 0.0 110.303 179.973 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -88.2 -12.58 43.41 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.522 -0.736 . . . . 0.0 111.853 -179.284 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.7 tptt -77.73 -58.86 3.04 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 120.941 -1.099 . . . . 0.0 109.869 179.694 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 39.9 mt -48.11 -28.27 2.81 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 121.528 -0.732 . . . . 0.0 111.184 -179.579 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -64.56 -37.58 94.59 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.236 -1.545 . . . . 0.0 109.236 179.6 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -49.42 -34.98 17.81 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.551 -0.97 . . . . 0.0 111.225 -179.639 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 7.9 mmt -89.63 -36.64 15.16 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.578 -0.701 . . . . 0.0 110.112 179.763 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . 0.418 ' CZ2' ' HG2' ' A' ' 55' ' ' LYS . 73.6 t-105 -65.27 -12.29 50.06 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.603 -0.686 . . . . 0.0 111.254 -179.596 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 27.8 t -99.94 -42.7 6.67 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.109 -0.994 . . . . 0.0 110.781 -179.684 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -66.13 -29.21 69.47 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.441 -0.787 . . . . 0.0 110.493 -179.696 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -58.37 150.36 22.39 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.506 -0.746 . . . . 0.0 110.309 179.902 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.4 t -94.13 -154.08 0.4 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.612 -0.68 . . . . 0.0 109.684 179.75 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -86.19 52.32 2.46 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.361 -0.837 . . . . 0.0 110.028 179.624 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 22.4 mttp -127.63 -46.89 1.42 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.544 -0.722 . . . . 0.0 110.302 -179.855 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -67.97 -31.32 70.96 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.577 -0.702 . . . . 0.0 111.214 -179.203 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.418 ' HG2' ' CZ2' ' A' ' 47' ' ' TRP . 34.3 mtpt -80.43 -37.64 31.65 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.344 -0.847 . . . . 0.0 111.127 -179.198 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -43.46 -56.12 7.37 Favored Pre-proline 0 N--CA 1.509 2.476 0 O-C-N 121.451 -0.781 . . . . 0.0 112.7 -178.443 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -76.2 -35.92 2.12 Favored 'Trans proline' 0 C--N 1.315 -1.203 0 O-C-N 123.049 1.026 . . . . 0.0 111.417 -179.35 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -82.04 -8.85 59.69 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.39 -0.819 . . . . 0.0 112.132 -178.314 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.07 -23.76 22.46 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.021 -1.049 . . . . 0.0 111.201 -179.193 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -78.98 -20.79 48.27 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.376 -0.828 . . . . 0.0 110.804 -179.823 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 22.1 tttp -60.43 -50.04 75.18 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.365 -0.834 . . . . 0.0 110.301 179.997 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.48 -10.84 59.71 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 119.839 -0.744 . . . . 0.0 110.429 179.493 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.9 -25.73 67.29 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.286 -0.884 . . . . 0.0 109.469 179.277 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -79.57 -64.8 1.1 Allowed 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.835 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.8 mp -42.07 -20.52 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.279 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 -178.914 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 57.2 tttt -70.39 -32.83 70.64 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.646 -1.284 . . . . 0.0 109.067 178.491 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -85.99 -5.3 59.25 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.703 -0.623 . . . . 0.0 110.751 179.451 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.2 tptt -102.4 -37.77 7.89 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.251 -0.906 . . . . 0.0 108.952 179.234 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.421 ' CE2' HD11 ' A' ' 73' ' ' ILE . 19.0 t80 -75.7 -56.58 4.55 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 179.149 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -57.22 -20.28 26.21 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.839 -0.538 . . . . 0.0 111.236 -179.674 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.0 mttt -98.9 -23.64 15.26 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.226 -0.921 . . . . 0.0 111.07 -179.379 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -103.3 -31.35 10.1 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.428 -0.795 . . . . 0.0 111.125 -179.216 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . 0.421 HD11 ' CE2' ' A' ' 69' ' ' TYR . 2.5 tp -66.96 -33.57 64.29 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 O-C-N 121.43 -0.794 . . . . 0.0 110.539 -179.422 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -55.78 -42.91 76.26 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.533 -0.729 . . . . 0.0 110.584 -179.784 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -89.73 -20.46 23.55 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.589 -0.694 . . . . 0.0 110.476 179.726 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 59.0 t80 -75.34 -30.89 60.4 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.38 -0.825 . . . . 0.0 110.352 -179.853 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 27.9 mtp180 -78.65 -83.4 0.09 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.614 -0.679 . . . . 0.0 110.32 -179.846 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -136.98 -143.1 0.17 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.252 -0.905 . . . . 0.0 109.701 -179.751 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 16.6 mtmt . . . . . 0 N--CA 1.502 2.155 0 O-C-N 120.981 -1.074 . . . . 0.0 110.793 179.823 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.2 0.524 . . . . 0.0 110.243 . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 52.82 69.78 0.65 Allowed 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.393 -0.817 . . . . 0.0 110.814 179.997 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 9.0 ttpt -170.85 -158.07 0.14 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.505 -0.747 . . . . 0.0 109.953 179.935 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 8.8 mtpt -155.64 -164.16 1.67 Allowed 'General case' 0 N--CA 1.485 1.277 0 O-C-N 121.611 -0.68 . . . . 0.0 109.64 179.838 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.68 145.65 98.2 Favored Pre-proline 0 N--CA 1.494 1.728 0 O-C-N 121.664 -0.647 . . . . 0.0 110.275 -179.992 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -73.93 -19.08 21.05 Favored 'Trans proline' 0 C--N 1.317 -1.128 0 O-C-N 123.376 1.198 . . . . 0.0 110.903 179.877 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -83.9 -26.81 29.07 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.329 -0.857 . . . . 0.0 110.477 -179.725 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -92.36 154.99 42.85 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.473 -0.767 . . . . 0.0 110.352 -179.825 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.424 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 48.0 Cg_endo -73.66 133.85 19.36 Favored 'Trans proline' 0 C--N 1.317 -1.111 0 O-C-N 123.425 1.224 . . . . 0.0 110.521 -179.94 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.4 pttm -144.18 31.37 1.24 Allowed 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.646 -0.659 . . . . 0.0 110.451 -179.966 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 43.1 mtt180 -147.17 68.78 11.49 Favored Pre-proline 0 N--CA 1.493 1.711 0 C-N-CA 120.444 -0.502 . . . . 0.0 110.183 -179.807 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.416 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.3 Cg_endo -77.31 123.6 6.69 Favored 'Trans proline' 0 C--N 1.316 -1.149 0 O-C-N 123.264 1.139 . . . . 0.0 110.452 -179.932 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -81.52 176.44 8.58 Favored 'Trans proline' 0 C--N 1.318 -1.053 0 O-C-N 123.26 1.137 . . . . 0.0 109.835 179.793 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 52.4 p -167.48 56.54 0.07 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.379 -0.826 . . . . 0.0 111.043 -179.753 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 68.94 -79.81 0.04 OUTLIER 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.143 -0.973 . . . . 0.0 110.807 -179.905 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -47.36 -51.04 20.77 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.117 -0.989 . . . . 0.0 111.412 -179.33 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -54.97 -27.73 46.14 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.523 -0.735 . . . . 0.0 110.28 179.743 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 21.3 mt -85.17 -24.63 27.84 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.523 -0.735 . . . . 0.0 110.386 -179.925 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.496 ' CE1' ' CE1' ' A' ' 23' ' ' TYR . 80.5 t80 -81.27 -57.45 3.49 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.469 -0.769 . . . . 0.0 110.756 -179.267 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.7 t -60.18 -48.8 80.19 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.502 -0.749 . . . . 0.0 110.403 -179.717 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 30.7 t -57.43 -21.5 37.13 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.636 -0.665 . . . . 0.0 110.881 -179.768 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -107.67 -13.61 15.0 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.35 -0.843 . . . . 0.0 111.442 -179.489 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.496 ' CE1' ' CE1' ' A' ' 19' ' ' PHE . 2.6 m-85 -94.69 -37.76 11.14 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.173 -0.955 . . . . 0.0 110.602 -179.592 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.503 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 5.9 mtt180 -46.88 -51.77 37.04 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.437 -0.789 . . . . 0.0 112.265 -179.625 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 36.5 Cg_endo -60.2 -26.52 82.77 Favored 'Trans proline' 0 N--CA 1.493 1.486 0 O-C-N 123.24 1.126 . . . . 0.0 110.089 179.779 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.0 tmtt? -69.65 -47.37 63.57 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 177.494 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.4 ' O ' ' HB2' ' A' ' 31' ' ' HIS . 46.4 mm -57.97 -18.67 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.607 179.543 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.497 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 7.1 mmmm -85.24 -28.58 25.29 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.189 -0.944 . . . . 0.0 110.293 -177.843 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.1 t -68.55 -18.74 64.41 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.507 -0.745 . . . . 0.0 110.846 -179.979 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -127.59 -1.59 6.14 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.313 -0.867 . . . . 0.0 111.611 -179.598 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.4 ' HB2' ' O ' ' A' ' 27' ' ' ILE . 26.7 m80 -140.71 93.58 8.49 Favored Pre-proline 0 N--CA 1.497 1.925 0 O-C-N 121.135 -0.978 . . . . 0.0 109.057 179.035 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -74.68 -37.32 2.32 Favored 'Trans proline' 0 C--N 1.316 -1.155 0 O-C-N 123.511 1.269 . . . . 0.0 110.384 -179.467 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.68 -26.73 73.56 Favored Glycine 0 N--CA 1.488 2.159 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 179.571 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -48.2 90.87 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.616 -0.932 . . . . 0.0 111.704 -179.501 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.1 p -76.71 -179.67 5.49 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.533 -0.729 . . . . 0.0 109.475 179.595 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.0 mp -60.54 -33.91 56.29 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 O-C-N 121.37 -0.831 . . . . 0.0 109.297 179.822 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.09 -54.61 36.6 Favored Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.024 -1.631 . . . . 0.0 109.024 179.483 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.421 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 23.8 m-20 -73.39 -36.9 66.1 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.763 -0.845 . . . . 0.0 110.031 179.017 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.9 m -65.3 -25.13 67.49 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.238 -0.914 . . . . 0.0 110.263 179.265 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -84.43 -33.02 23.79 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.418 -0.802 . . . . 0.0 110.328 -179.942 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.0 ptpt -100.06 -14.7 18.5 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.442 -0.786 . . . . 0.0 111.79 -179.179 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.421 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -85.06 -5.21 59.35 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.921 -1.112 . . . . 0.0 110.547 179.338 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 86.4 mt -96.83 -38.74 9.74 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.283 -0.886 . . . . 0.0 109.237 179.337 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -59.22 -32.76 72.59 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 109.863 -1.295 . . . . 0.0 109.863 -179.943 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -55.36 -37.22 67.21 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.513 -0.992 . . . . 0.0 110.419 -179.992 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 14.3 mtt -76.14 -44.42 38.47 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.621 -0.674 . . . . 0.0 109.598 179.408 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 70.7 t-105 -54.64 -22.69 14.34 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.621 -0.674 . . . . 0.0 110.897 -179.955 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.1 t -88.82 -31.49 18.3 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.282 -0.886 . . . . 0.0 110.117 179.94 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -90.88 -4.8 56.27 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.533 -0.73 . . . . 0.0 110.995 179.674 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.4 pp0? -59.03 -167.35 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.217 -0.927 . . . . 0.0 110.621 179.928 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.2 t -156.75 -147.07 0.18 Allowed 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 179.897 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.88 -3.82 31.2 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.135 -0.978 . . . . 0.0 111.035 179.684 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.4 mtmt -90.89 -38.78 12.69 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.92 -1.113 . . . . 0.0 110.901 -179.524 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -87.91 49.87 1.88 Allowed 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.339 -0.851 . . . . 0.0 110.777 -179.366 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.417 ' O ' ' N ' ' A' ' 59' ' ' GLU . 17.6 mtmt -159.82 -59.81 0.06 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.581 -0.699 . . . . 0.0 109.697 178.673 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 -41.15 -52.29 7.29 Favored Pre-proline 0 N--CA 1.506 2.352 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -179.097 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -75.29 -36.03 2.61 Favored 'Trans proline' 0 N--CA 1.489 1.213 0 O-C-N 123.129 1.068 . . . . 0.0 112.182 -179.208 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -87.68 -17.85 30.87 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 121.221 -0.925 . . . . 0.0 111.848 -178.611 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.417 ' N ' ' O ' ' A' ' 55' ' ' LYS . 0.2 OUTLIER -85.35 -30.9 23.3 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.25 -0.907 . . . . 0.0 110.018 -179.417 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -77.71 -24.74 49.11 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.748 -0.595 . . . . 0.0 110.159 179.494 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 73.1 tttt -62.91 -43.1 99.71 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.46 -0.775 . . . . 0.0 109.858 179.728 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -78.94 -16.38 57.04 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.515 -0.741 . . . . 0.0 109.943 178.987 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.25 -42.75 87.08 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.404 -0.81 . . . . 0.0 110.449 179.954 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -70.08 -62.27 1.45 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.306 -0.871 . . . . 0.0 110.055 -179.989 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.3 mp -45.69 -27.15 0.75 Allowed 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.688 -0.632 . . . . 0.0 111.815 -179.419 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.1 tptt -64.25 -51.85 61.56 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.42 -0.8 . . . . 0.0 109.421 179.142 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -60.82 -52.0 66.94 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.647 -0.658 . . . . 0.0 109.846 179.499 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 69.5 mttt -56.19 -26.11 49.5 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.527 -0.733 . . . . 0.0 110.536 179.926 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.424 ' CD2' ' HB2' ' A' ' 9' ' ' PRO . 32.8 t80 -81.92 -63.37 1.4 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.396 -0.815 . . . . 0.0 109.538 179.468 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -55.21 -23.87 24.36 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.475 -0.766 . . . . 0.0 110.682 179.718 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 25.3 ttmt -89.42 -59.86 2.1 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.452 -0.78 . . . . 0.0 110.426 -179.924 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -56.28 -23.09 34.29 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.529 -0.732 . . . . 0.0 111.084 -179.403 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 7.1 tp -78.15 -32.05 16.86 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 121.342 -0.849 . . . . 0.0 109.88 179.764 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -51.9 -30.66 25.13 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.453 -0.78 . . . . 0.0 110.514 -179.86 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -83.1 -2.58 55.77 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.65 -0.656 . . . . 0.0 110.594 179.098 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.406 ' O ' ' CG ' ' A' ' 76' ' ' TYR . 83.5 t80 -106.1 20.85 18.3 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.153 -0.967 . . . . 0.0 109.963 178.858 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 40.9 mtp85 -130.5 -32.76 1.71 Allowed 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.331 -0.855 . . . . 0.0 111.301 -179.169 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 53.06 75.39 0.25 Allowed 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.187 -0.946 . . . . 0.0 110.777 -179.935 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 8.9 tttt . . . . . 0 N--CA 1.494 1.753 0 CA-C-O 118.035 -0.984 . . . . 0.0 110.196 -179.918 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 121.167 0.508 . . . . 0.0 110.116 . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.96 150.47 23.43 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.555 -0.715 . . . . 0.0 110.154 179.842 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.1 tttp 53.78 -172.09 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.459 -0.775 . . . . 0.0 110.611 -179.952 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.7 mttt -166.19 -75.83 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.626 -0.671 . . . . 0.0 110.135 179.791 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -168.28 167.21 6.61 Favored Pre-proline 0 N--CA 1.494 1.744 0 O-C-N 121.437 -0.789 . . . . 0.0 110.313 -179.939 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -72.92 -39.95 2.07 Favored 'Trans proline' 0 C--N 1.317 -1.124 0 O-C-N 123.501 1.263 . . . . 0.0 110.319 179.883 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -78.88 -14.23 59.35 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.618 -0.676 . . . . 0.0 110.996 -179.305 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -96.77 130.99 28.88 Favored Pre-proline 0 N--CA 1.493 1.724 0 O-C-N 121.238 -0.914 . . . . 0.0 109.595 179.349 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -72.47 105.49 1.89 Allowed 'Trans proline' 0 C--N 1.319 -1.005 0 O-C-N 123.161 1.085 . . . . 0.0 110.286 -179.715 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.53 -164.78 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.631 -0.668 . . . . 0.0 110.438 -179.779 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.4 mpt_? -60.6 142.27 91.5 Favored Pre-proline 0 N--CA 1.496 1.854 0 O-C-N 121.618 -0.677 . . . . 0.0 110.124 -179.989 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -75.13 131.55 14.28 Favored 'Trans proline' 0 C--N 1.318 -1.076 0 O-C-N 123.324 1.171 . . . . 0.0 110.053 179.876 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -81.72 -177.08 3.36 Favored 'Trans proline' 0 C--N 1.318 -1.075 0 O-C-N 123.195 1.103 . . . . 0.0 110.21 -179.815 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.7 t -166.31 65.2 0.1 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.513 -0.742 . . . . 0.0 110.527 -179.846 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 66.91 -76.59 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.057 -1.027 . . . . 0.0 110.043 -179.388 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -48.8 -46.81 42.23 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.354 -0.841 . . . . 0.0 111.274 -179.812 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -60.38 -32.75 71.6 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.597 -0.689 . . . . 0.0 110.118 179.784 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 22.2 mt -79.4 -30.43 42.42 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.571 -0.706 . . . . 0.0 110.433 -179.496 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.498 ' CE2' ' CE1' ' A' ' 23' ' ' TYR . 31.0 t80 -77.41 -54.43 6.45 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.562 -0.711 . . . . 0.0 110.685 -179.392 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 45.3 t -57.91 -50.38 73.53 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.578 -0.702 . . . . 0.0 110.675 -179.539 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 99.5 p -59.01 -24.48 62.83 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.553 -0.717 . . . . 0.0 110.944 -179.688 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -99.36 -25.62 14.41 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.398 -0.813 . . . . 0.0 111.305 -179.251 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.498 ' CE1' ' CE2' ' A' ' 19' ' ' PHE . 4.6 m-85 -86.5 -34.41 20.03 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.345 -0.847 . . . . 0.0 111.123 -179.281 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.461 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 4.0 mtt180 -46.6 -54.45 18.95 Favored Pre-proline 0 N--CA 1.499 1.995 0 O-C-N 121.384 -0.823 . . . . 0.0 112.251 -179.59 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.461 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 37.0 Cg_endo -61.09 -25.73 81.65 Favored 'Trans proline' 0 N--CA 1.494 1.507 0 O-C-N 123.305 1.161 . . . . 0.0 110.194 179.895 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -69.87 -46.6 65.16 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.179 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 35.9 mm -57.67 -29.61 35.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 CA-C-O 121.171 0.51 . . . . 0.0 110.402 179.873 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.524 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 5.5 mmmm -74.04 -36.28 64.39 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 120.01 -0.676 . . . . 0.0 110.204 -177.068 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.4 t -67.51 -19.15 65.28 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.458 -0.776 . . . . 0.0 110.48 179.7 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -118.65 -12.28 9.75 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.333 -0.854 . . . . 0.0 111.356 -179.628 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 42.3 m80 -133.54 94.25 19.86 Favored Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 121.152 -0.967 . . . . 0.0 109.737 179.515 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -75.65 -33.73 3.78 Favored 'Trans proline' 0 C--N 1.316 -1.155 0 O-C-N 123.592 1.312 . . . . 0.0 110.109 -179.841 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.43 -21.15 75.88 Favored Glycine 0 N--CA 1.489 2.198 0 N-CA-C 109.845 -1.302 . . . . 0.0 109.845 179.643 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -50.18 91.11 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.497 -1.002 . . . . 0.0 111.373 -179.691 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 50.6 p -77.35 165.49 24.38 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.53 -0.731 . . . . 0.0 109.757 179.707 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.4 mp -52.12 -27.38 9.62 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 O-C-N 121.432 -0.793 . . . . 0.0 110.171 -179.953 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.15 -61.44 6.65 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.054 -1.618 . . . . 0.0 109.054 179.607 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.422 ' O ' ' N ' ' A' ' 42' ' ' LYS . 32.8 t0 -76.86 -25.26 52.91 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.735 -0.862 . . . . 0.0 110.584 179.865 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 49.3 m -52.93 -45.55 67.7 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 120.867 -1.146 . . . . 0.0 110.072 179.451 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.15 -44.04 40.08 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 178.475 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.74 -30.3 65.46 Favored 'General case' 0 N--CA 1.497 1.924 0 CA-C-O 121.378 0.609 . . . . 0.0 110.034 179.272 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.422 ' N ' ' O ' ' A' ' 38' ' ' ASP . 2.7 tptt -88.19 -3.02 58.93 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.636 -0.665 . . . . 0.0 110.964 -179.583 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.9 mt -90.17 -42.79 10.85 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.261 -0.9 . . . . 0.0 109.064 179.322 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -70.7 -32.24 67.25 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 108.762 -1.735 . . . . 0.0 108.762 179.264 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -58.58 -54.28 48.84 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.65 -0.912 . . . . 0.0 109.835 179.522 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 58.4 mtt -65.86 -54.59 24.69 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.643 -0.661 . . . . 0.0 109.438 179.206 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 68.2 t-105 -51.21 -56.45 12.78 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.605 -0.684 . . . . 0.0 110.787 -179.858 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 35.1 t -61.41 -34.34 75.2 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.436 -0.79 . . . . 0.0 110.252 -179.972 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -61.71 -39.84 92.92 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.578 -0.701 . . . . 0.0 110.114 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 31.4 mm-40 -57.97 155.69 10.38 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.62 -0.675 . . . . 0.0 110.614 -179.906 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.0 t -92.75 -149.58 0.26 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.69 -0.631 . . . . 0.0 109.41 179.527 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.04 50.33 1.99 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.211 -0.931 . . . . 0.0 110.312 179.726 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.59 -42.91 1.28 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.445 -0.784 . . . . 0.0 110.044 179.944 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -60.08 -29.79 68.8 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.454 -0.779 . . . . 0.0 110.584 -179.671 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 44.2 tttt -95.3 22.7 6.55 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.283 -0.886 . . . . 0.0 111.214 -179.368 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.405 ' CB ' ' CD ' ' A' ' 57' ' ' PRO . 10.0 mp0 -100.36 -61.09 0.1 OUTLIER Pre-proline 0 N--CA 1.497 1.876 0 O-C-N 121.349 -0.844 . . . . 0.0 111.047 179.683 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.405 ' CD ' ' CB ' ' A' ' 56' ' ' GLN . 55.5 Cg_endo -76.96 -36.76 1.33 Allowed 'Trans proline' 0 N--CA 1.485 0.987 0 O-C-N 122.618 0.799 . . . . 0.0 110.7 179.884 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -79.79 3.6 19.02 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.407 -0.808 . . . . 0.0 111.916 -178.929 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -98.31 -18.86 18.12 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.075 -1.016 . . . . 0.0 110.882 179.983 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -77.64 -24.39 49.5 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.286 -0.884 . . . . 0.0 110.363 179.817 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 55.0 tttt -59.82 -40.02 87.04 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.462 -0.774 . . . . 0.0 109.718 179.456 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.42 -10.71 59.2 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.626 -0.671 . . . . 0.0 110.537 179.312 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.85 6.78 33.78 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.163 -0.961 . . . . 0.0 110.439 179.218 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 38.1 mmtt -105.78 -35.04 7.48 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.255 -0.903 . . . . 0.0 109.078 178.86 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.1 mp -78.38 -0.0 27.38 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.936 -0.478 . . . . 0.0 110.888 179.44 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 59.5 tttt -89.3 -26.16 21.28 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.168 -0.958 . . . . 0.0 109.805 179.292 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -83.27 -15.77 48.96 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.573 -0.704 . . . . 0.0 110.478 179.425 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 32.8 mtpt -101.48 -27.17 13.27 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.307 -0.87 . . . . 0.0 109.992 179.688 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 23.0 t80 -77.68 -51.47 10.55 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.557 -0.714 . . . . 0.0 109.642 179.627 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -70.51 -6.82 38.95 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.685 -0.634 . . . . 0.0 111.589 -179.632 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 47.8 mttt -110.66 -33.9 6.43 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.077 -1.014 . . . . 0.0 110.174 179.868 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -87.34 -29.88 21.23 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.556 -0.715 . . . . 0.0 110.833 -179.47 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 3.2 tp -66.8 -24.22 32.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 O-C-N 121.401 -0.812 . . . . 0.0 110.436 -179.69 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -55.48 -30.54 60.77 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.394 -0.816 . . . . 0.0 110.225 179.934 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -84.19 -10.81 57.43 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.688 -0.632 . . . . 0.0 110.501 179.201 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -105.46 26.33 9.6 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.248 -0.908 . . . . 0.0 109.984 179.531 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 6.2 mtt180 -128.39 -33.19 2.14 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.55 -0.719 . . . . 0.0 111.151 -179.468 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 53.24 72.83 0.4 Allowed 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.119 -0.988 . . . . 0.0 110.652 -179.865 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.229 -179.974 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.7 tpt . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 121.129 0.49 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -137.2 71.23 1.4 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.576 -0.703 . . . . 0.0 110.26 -179.982 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -170.02 -48.8 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.49 -0.756 . . . . 0.0 110.323 179.842 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.5 mttt -168.53 -165.69 0.61 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.477 -0.764 . . . . 0.0 110.36 179.966 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -118.61 174.28 2.8 Favored Pre-proline 0 N--CA 1.494 1.748 0 O-C-N 121.551 -0.718 . . . . 0.0 110.171 -179.825 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.4 -34.35 12.62 Favored 'Trans proline' 0 N--CA 1.486 1.086 0 O-C-N 123.36 1.189 . . . . 0.0 110.205 179.821 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 29.0 m120 -78.4 -10.19 59.59 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.598 -0.689 . . . . 0.0 110.876 -179.356 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -100.61 133.46 21.24 Favored Pre-proline 0 N--CA 1.493 1.692 0 O-C-N 121.127 -0.983 . . . . 0.0 109.278 179.07 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -73.2 107.71 2.44 Favored 'Trans proline' 0 C--N 1.318 -1.05 0 O-C-N 123.078 1.041 . . . . 0.0 110.628 -179.519 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.56 -163.08 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.803 -0.56 . . . . 0.0 110.302 -179.821 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 7.1 mpt_? -55.22 154.62 10.62 Favored Pre-proline 0 N--CA 1.5 2.045 0 O-C-N 121.37 -0.831 . . . . 0.0 110.768 -179.889 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -73.74 121.9 7.38 Favored 'Trans proline' 0 C--N 1.317 -1.122 0 O-C-N 123.541 1.285 . . . . 0.0 110.01 179.795 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -82.23 162.48 17.62 Favored 'Trans proline' 0 C--N 1.317 -1.099 0 O-C-N 123.208 1.11 . . . . 0.0 110.353 -179.614 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -162.75 65.76 0.21 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.554 -0.716 . . . . 0.0 110.223 -179.758 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 66.83 -76.58 0.05 OUTLIER 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.171 -0.956 . . . . 0.0 109.926 -179.35 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.439 ' CD1' ' CD1' ' A' ' 47' ' ' TRP . 11.7 t80 -51.64 -42.16 61.85 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.206 -0.934 . . . . 0.0 110.807 179.878 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -65.16 -26.34 68.13 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 120.085 -0.646 . . . . 0.0 109.824 179.716 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 35.9 mt -84.03 -39.2 19.92 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.5 -0.75 . . . . 0.0 110.064 -179.736 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -67.16 -49.77 63.56 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.557 -0.715 . . . . 0.0 110.223 -179.862 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 9.0 t -67.2 -28.29 67.96 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.62 -0.675 . . . . 0.0 109.964 179.561 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 42.0 t -87.57 4.23 44.46 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.491 -0.756 . . . . 0.0 111.632 -179.415 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 50.8 mm-40 -141.51 2.58 1.64 Allowed 'General case' 0 N--CA 1.499 1.997 0 O-C-N 120.974 -1.079 . . . . 0.0 112.367 -179.568 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 33.9 m-85 -122.27 22.2 10.17 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 120.826 -1.171 . . . . 0.0 111.129 -179.671 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.463 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 15.3 mtp180 -87.82 -45.49 0.49 Allowed Pre-proline 0 N--CA 1.489 1.49 0 O-C-N 121.361 -0.837 . . . . 0.0 112.403 179.815 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.5 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.4 Cg_endo -66.83 -14.68 44.71 Favored 'Trans proline' 0 N--CA 1.492 1.393 0 O-C-N 122.917 0.956 . . . . 0.0 110.686 -179.035 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -74.25 -52.58 11.92 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 177.837 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 30.2 mm -52.46 -31.26 15.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 CA-C-O 121.297 0.57 . . . . 0.0 110.454 179.649 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.5 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.9 mmmm -72.54 -33.45 66.84 Favored 'General case' 0 N--CA 1.496 1.855 0 C-N-CA 120.123 -0.631 . . . . 0.0 110.176 -177.303 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.7 t -62.03 -25.98 67.98 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.589 -0.694 . . . . 0.0 110.508 -179.922 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -115.7 -24.55 8.19 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.551 -0.718 . . . . 0.0 110.79 -179.669 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 38.3 m80 -119.3 96.75 50.13 Favored Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.476 -0.765 . . . . 0.0 109.543 -179.889 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -75.33 -28.79 8.36 Favored 'Trans proline' 0 C--N 1.313 -1.293 0 O-C-N 123.444 1.234 . . . . 0.0 110.49 -179.813 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -83.88 -13.94 73.81 Favored Glycine 0 N--CA 1.488 2.129 0 N-CA-C 110.506 -1.037 . . . . 0.0 110.506 -179.947 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.71 79.56 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.413 -1.051 . . . . 0.0 111.273 -179.333 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.404 ' N ' ' O ' ' A' ' 33' ' ' GLY . 79.5 p -69.48 174.79 4.55 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.394 -0.816 . . . . 0.0 109.581 179.847 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 40.3 mm -54.33 -29.9 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 O-C-N 121.308 -0.87 . . . . 0.0 110.15 179.895 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.7 -65.91 3.1 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 179.906 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -69.83 -29.72 67.05 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.622 -0.928 . . . . 0.0 110.757 179.857 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 73.7 m -64.65 -31.0 72.02 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.393 -0.817 . . . . 0.0 110.133 179.707 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.38 -43.78 48.41 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.584 -0.698 . . . . 0.0 110.158 -179.983 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.23 -12.06 47.87 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.596 -0.69 . . . . 0.0 111.822 -179.403 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.4 tptt -77.59 -59.64 2.7 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.987 -1.071 . . . . 0.0 109.797 179.529 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 43.8 mt -48.95 -26.08 2.3 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.413 -0.805 . . . . 0.0 111.336 -179.729 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.1 -37.87 82.79 Favored Glycine 0 N--CA 1.492 2.425 0 N-CA-C 109.277 -1.529 . . . . 0.0 109.277 179.673 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -50.9 -35.04 30.94 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.462 -1.022 . . . . 0.0 110.919 -179.839 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 22.8 mmt -81.84 -42.85 19.05 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.66 -0.65 . . . . 0.0 109.591 179.587 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . 0.439 ' CD1' ' CD1' ' A' ' 16' ' ' PHE . 45.4 t-105 -51.86 -52.66 47.93 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.526 -0.734 . . . . 0.0 110.788 -179.862 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.9 t -68.17 -32.1 72.11 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.381 -0.824 . . . . 0.0 110.506 -179.572 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -58.68 -38.84 79.1 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.516 -0.74 . . . . 0.0 110.252 -179.86 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -73.63 172.09 12.04 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.514 -0.741 . . . . 0.0 109.944 179.668 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 88.6 p -164.17 110.86 1.07 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.486 -0.758 . . . . 0.0 110.507 -179.918 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 51.6 35.34 14.49 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.429 -0.794 . . . . 0.0 111.054 179.611 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 70.8 mttt -135.39 -73.51 0.46 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.547 -0.721 . . . . 0.0 110.302 179.961 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -66.87 -20.67 65.96 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.511 -0.743 . . . . 0.0 110.687 -179.937 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.415 ' HG2' ' CH2' ' A' ' 47' ' ' TRP . 50.3 mttt -82.99 -35.27 26.0 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.368 -0.833 . . . . 0.0 110.678 -179.763 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -45.78 -51.55 29.26 Favored Pre-proline 0 N--CA 1.507 2.395 0 O-C-N 121.569 -0.707 . . . . 0.0 111.759 -179.176 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -79.09 -39.29 0.35 Allowed 'Trans proline' 0 C--N 1.314 -1.239 0 O-C-N 123.186 1.098 . . . . 0.0 110.747 179.889 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -81.51 4.68 20.38 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.605 -0.684 . . . . 0.0 112.104 -178.657 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.84 -20.35 17.56 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 120.996 -1.065 . . . . 0.0 110.358 179.387 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -77.72 -26.35 49.97 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.442 -0.786 . . . . 0.0 110.085 179.598 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 50.4 tttt -61.89 -40.38 95.24 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.571 -0.706 . . . . 0.0 110.092 179.855 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -79.34 -14.0 59.27 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.482 -0.761 . . . . 0.0 110.539 179.606 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -81.16 0.34 36.84 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.313 -0.867 . . . . 0.0 110.299 179.159 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 24.0 mmtp -105.72 -29.81 9.84 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.164 -0.96 . . . . 0.0 109.93 179.4 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.9 mp -87.15 -2.47 58.65 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.882 -0.511 . . . . 0.0 110.361 178.834 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.5 tptt -83.98 -35.64 23.79 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.299 -0.876 . . . . 0.0 108.771 178.916 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -66.95 -59.57 3.38 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 119.939 -0.704 . . . . 0.0 109.324 179.323 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -58.85 -20.3 49.56 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.607 -0.683 . . . . 0.0 111.02 -179.888 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -77.5 -61.25 2.05 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.158 -0.964 . . . . 0.0 109.579 179.471 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -64.2 -12.49 41.03 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.613 -0.679 . . . . 0.0 111.334 -179.955 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.1 mmtm -102.49 -29.31 11.67 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.131 -0.981 . . . . 0.0 110.516 -179.949 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -99.78 -26.96 13.87 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.528 -0.732 . . . . 0.0 110.95 -179.612 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.3 tp -61.5 -27.19 41.51 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.886 0 O-C-N 121.276 -0.89 . . . . 0.0 109.907 179.891 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -50.56 -43.98 56.42 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.474 -0.766 . . . . 0.0 110.576 179.841 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.38 -15.29 63.6 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.416 -0.803 . . . . 0.0 110.112 178.625 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -107.88 -1.23 20.94 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.406 -0.809 . . . . 0.0 109.755 176.727 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -148.03 75.01 1.32 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.476 -0.765 . . . . 0.0 111.328 -178.311 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.98 -1.39 43.57 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.414 -0.803 . . . . 0.0 110.918 178.991 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.494 1.732 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.333 -179.914 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 121.069 0.462 . . . . 0.0 110.194 . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.62 153.09 36.52 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.536 -0.727 . . . . 0.0 110.371 -179.914 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.7 tttt -169.93 163.31 9.51 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.552 -0.717 . . . . 0.0 110.22 179.806 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.9 mttp -60.04 -26.83 66.44 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.556 -0.715 . . . . 0.0 110.487 -179.821 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 59.3 163.13 0.09 OUTLIER Pre-proline 0 N--CA 1.501 2.111 0 O-C-N 121.338 -0.851 . . . . 0.0 110.363 -179.633 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -73.04 -19.47 22.98 Favored 'Trans proline' 0 C--N 1.316 -1.137 0 O-C-N 123.355 1.187 . . . . 0.0 111.205 -179.416 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -78.93 -29.94 44.42 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.281 -0.887 . . . . 0.0 110.605 -179.034 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.401 ' HB3' ' CZ ' ' A' ' 76' ' ' TYR . . . -95.33 176.27 2.35 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.268 -0.895 . . . . 0.0 109.879 179.709 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -73.92 134.83 20.36 Favored 'Trans proline' 0 C--N 1.318 -1.065 0 O-C-N 123.323 1.17 . . . . 0.0 110.123 179.806 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.35 -166.43 0.09 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.616 -0.678 . . . . 0.0 110.326 -179.706 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -58.37 146.34 72.06 Favored Pre-proline 0 N--CA 1.497 1.883 0 O-C-N 121.551 -0.718 . . . . 0.0 110.408 -179.92 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -74.35 125.3 9.57 Favored 'Trans proline' 0 C--N 1.317 -1.113 0 O-C-N 123.433 1.228 . . . . 0.0 110.009 179.783 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -82.21 174.81 9.67 Favored 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.232 1.122 . . . . 0.0 110.181 -179.731 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -169.59 69.07 0.06 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.556 -0.715 . . . . 0.0 110.495 -179.956 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 67.11 -77.64 0.04 OUTLIER 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.045 -1.035 . . . . 0.0 110.574 -179.794 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -47.79 -47.87 30.69 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.237 -0.914 . . . . 0.0 111.508 -179.34 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -61.83 -29.92 70.49 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.621 -0.674 . . . . 0.0 109.87 179.812 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 18.2 mt -83.16 -29.9 28.26 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.479 -0.763 . . . . 0.0 109.989 -179.82 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.498 ' CE2' ' CE1' ' A' ' 23' ' ' TYR . 55.8 t80 -77.56 -54.58 6.24 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.542 -0.724 . . . . 0.0 110.481 -179.463 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.7 t -58.43 -50.93 71.93 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.535 -0.728 . . . . 0.0 110.646 -179.704 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.1 t -58.23 -21.67 48.95 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.518 -0.739 . . . . 0.0 110.916 -179.798 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -101.63 -23.63 14.23 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.343 -0.848 . . . . 0.0 111.003 -179.662 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.498 ' CE1' ' CE2' ' A' ' 19' ' ' PHE . 2.4 m-85 -86.7 -33.87 19.9 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.479 -0.763 . . . . 0.0 110.681 -179.61 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.509 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 4.4 mtt-85 -48.35 -52.23 44.46 Favored Pre-proline 0 N--CA 1.498 1.93 0 O-C-N 121.318 -0.864 . . . . 0.0 111.85 179.903 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.509 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 36.2 Cg_endo -60.28 -27.9 85.8 Favored 'Trans proline' 0 N--CA 1.492 1.431 0 O-C-N 123.218 1.115 . . . . 0.0 109.933 179.797 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.8 tmtm? -69.64 -46.64 65.73 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 177.872 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 44.5 mm -56.42 -31.2 32.76 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.032 179.711 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.533 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 4.7 mmmm -72.95 -37.58 67.07 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 120.079 -0.649 . . . . 0.0 110.449 -177.552 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.4 t -60.56 -24.43 65.4 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.501 -0.749 . . . . 0.0 110.649 -179.633 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -117.62 -17.03 10.04 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.49 -0.756 . . . . 0.0 111.158 -179.625 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 39.8 m80 -127.77 95.15 35.54 Favored Pre-proline 0 N--CA 1.496 1.865 0 O-C-N 121.297 -0.877 . . . . 0.0 109.528 179.736 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -75.1 -36.14 2.66 Favored 'Trans proline' 0 C--N 1.315 -1.197 0 O-C-N 123.54 1.284 . . . . 0.0 110.307 -179.736 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.402 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -75.58 -18.46 79.77 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 179.771 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.79 88.14 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.465 -1.021 . . . . 0.0 111.375 -179.507 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.402 ' N ' ' O ' ' A' ' 33' ' ' GLY . 45.2 t -70.88 175.91 4.7 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.517 -0.739 . . . . 0.0 109.741 179.722 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 2.1 mp -59.64 -34.23 54.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.306 -0.871 . . . . 0.0 109.513 179.953 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.13 -58.83 12.53 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 109.104 -1.598 . . . . 0.0 109.104 179.63 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.432 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 6.5 t70 -70.21 -37.76 75.13 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.742 -0.858 . . . . 0.0 110.063 179.107 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.9 m -61.78 -31.08 71.26 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.159 -0.963 . . . . 0.0 110.107 179.268 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.94 -43.03 46.84 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.568 -0.708 . . . . 0.0 110.398 -179.845 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 2.3 ptpt -89.44 -12.97 38.69 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.595 -0.691 . . . . 0.0 111.979 -178.925 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -88.98 5.7 42.98 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 120.892 -1.13 . . . . 0.0 110.602 179.721 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 91.0 mt -107.92 -31.23 8.08 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.133 -0.979 . . . . 0.0 109.546 179.486 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.56 -31.9 82.34 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -61.76 -53.84 50.51 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.564 -0.963 . . . . 0.0 109.895 179.918 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 23.6 mtt -64.19 -23.55 67.36 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.589 -0.694 . . . . 0.0 110.345 179.803 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 77.0 t-105 -78.08 -38.92 43.12 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.46 -0.775 . . . . 0.0 110.121 179.794 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.9 m -80.14 -25.07 40.01 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.514 -0.741 . . . . 0.0 110.58 -179.899 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -70.21 -43.86 69.8 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.42 -0.8 . . . . 0.0 109.774 179.72 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 16.3 mm-40 -56.27 154.39 8.14 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.514 -0.742 . . . . 0.0 110.579 -179.92 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.4 m -93.52 -149.76 0.27 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.653 -0.654 . . . . 0.0 109.571 179.698 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -92.26 41.81 1.08 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.262 -0.899 . . . . 0.0 110.259 179.685 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -119.46 -49.06 2.38 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.529 -0.732 . . . . 0.0 110.109 179.899 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -61.62 -27.5 68.7 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.584 -0.698 . . . . 0.0 110.533 -179.831 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.8 ttpt -82.92 -34.38 26.61 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.434 -0.791 . . . . 0.0 110.638 -179.747 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -43.33 -53.09 11.84 Favored Pre-proline 0 N--CA 1.507 2.407 0 O-C-N 121.472 -0.768 . . . . 0.0 112.317 -178.861 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -79.12 -36.44 0.71 Allowed 'Trans proline' 0 C--N 1.315 -1.19 0 O-C-N 123.14 1.074 . . . . 0.0 111.273 179.999 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -85.21 0.02 53.16 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.454 -0.779 . . . . 0.0 112.319 -178.065 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.84 -25.41 15.04 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 120.938 -1.101 . . . . 0.0 110.699 -179.384 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -73.99 -21.56 59.95 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.468 -0.77 . . . . 0.0 110.644 179.94 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -60.32 -43.11 96.67 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.49 -0.756 . . . . 0.0 110.233 179.877 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.23 -12.32 59.93 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.4 -0.813 . . . . 0.0 110.131 179.153 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.38 -38.99 78.42 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.244 -0.91 . . . . 0.0 109.229 179.223 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.6 ttpt -67.52 -61.47 1.88 Allowed 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 178.513 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -44.74 -23.63 0.14 Allowed 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.798 -0.564 . . . . 0.0 112.328 -179.582 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 58.9 tttt -71.89 -44.43 63.76 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.256 -0.902 . . . . 0.0 108.658 178.241 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -82.26 -9.93 59.31 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.738 -0.601 . . . . 0.0 110.058 178.597 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.94 -32.56 11.6 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.309 -0.869 . . . . 0.0 109.153 179.267 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 58.8 t80 -77.28 -51.13 11.42 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.131 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -70.91 -8.31 51.99 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.606 -0.684 . . . . 0.0 111.113 179.837 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.7 ttmm -108.87 -34.35 6.67 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.063 -1.023 . . . . 0.0 110.596 -179.907 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -82.24 -31.11 30.36 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.466 -0.772 . . . . 0.0 110.502 -179.853 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.4 tp -68.72 -19.23 23.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.517 -0.739 . . . . 0.0 110.447 179.964 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.25 -33.5 75.95 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.48 -0.763 . . . . 0.0 109.011 179.427 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -83.09 -14.35 53.88 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.888 -0.507 . . . . 0.0 110.117 178.824 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.401 ' CZ ' ' HB3' ' A' ' 8' ' ' ALA . 32.1 t80 -93.81 30.7 1.75 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.242 -0.911 . . . . 0.0 110.605 179.844 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 76.4 mtp85 -137.76 -104.76 0.19 Allowed 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.041 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -145.17 51.78 1.21 Allowed 'General case' 0 N--CA 1.496 1.825 0 O-C-N 120.763 -1.21 . . . . 0.0 110.239 -179.969 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.779 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.031 -179.992 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.5 ptp . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.124 0.487 . . . . 0.0 110.3 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -97.59 41.73 1.11 Allowed 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.519 -0.738 . . . . 0.0 110.233 179.984 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 27.8 ttmt -59.2 -56.39 22.71 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.523 -0.736 . . . . 0.0 110.357 -179.982 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.4 mtpt -153.45 -167.92 2.84 Favored 'General case' 0 N--CA 1.484 1.253 0 O-C-N 121.605 -0.684 . . . . 0.0 109.731 179.597 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -57.19 145.06 67.91 Favored Pre-proline 0 N--CA 1.497 1.896 0 O-C-N 121.55 -0.719 . . . . 0.0 110.488 -179.9 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -73.75 -25.29 14.77 Favored 'Trans proline' 0 C--N 1.317 -1.098 0 O-C-N 123.377 1.199 . . . . 0.0 110.459 179.96 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -79.21 -16.83 55.95 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.534 -0.728 . . . . 0.0 111.0 -179.359 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -105.4 134.14 19.82 Favored Pre-proline 0 N--CA 1.494 1.734 0 O-C-N 121.25 -0.906 . . . . 0.0 109.566 179.327 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -72.68 113.63 3.8 Favored 'Trans proline' 0 N--CA 1.486 1.033 0 O-C-N 123.097 1.051 . . . . 0.0 110.722 -179.712 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.7 pttt -59.47 -160.38 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.644 -0.66 . . . . 0.0 110.452 -179.724 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -57.05 149.35 45.96 Favored Pre-proline 0 N--CA 1.499 1.995 0 O-C-N 121.282 -0.886 . . . . 0.0 110.786 -179.884 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.419 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.6 Cg_endo -76.41 124.37 7.68 Favored 'Trans proline' 0 C--N 1.317 -1.114 0 O-C-N 123.455 1.24 . . . . 0.0 109.651 179.31 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -81.2 177.08 8.17 Favored 'Trans proline' 0 C--N 1.316 -1.139 0 O-C-N 123.261 1.137 . . . . 0.0 110.158 -179.644 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 8.9 t -167.77 60.13 0.07 Allowed 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.458 -0.776 . . . . 0.0 110.684 -179.766 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 70.14 -74.79 0.08 Allowed 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.199 -0.938 . . . . 0.0 110.1 -179.469 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -48.76 -50.42 33.97 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.347 -0.846 . . . . 0.0 111.241 -179.643 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -58.91 -40.96 86.11 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.593 -0.692 . . . . 0.0 109.477 179.431 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.413 ' HB3' ' CE2' ' A' ' 58' ' ' TYR . 53.2 mt -61.67 -46.61 89.01 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.681 -0.637 . . . . 0.0 109.884 179.732 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.499 ' CE2' ' CE2' ' A' ' 23' ' ' TYR . 23.6 t80 -65.88 -50.43 64.56 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.715 -0.616 . . . . 0.0 110.252 -179.891 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.3 m -65.71 -29.1 69.59 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.673 -0.642 . . . . 0.0 110.057 179.981 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.7 m -67.85 -23.68 65.18 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.559 -0.713 . . . . 0.0 110.75 -179.749 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -110.2 -27.76 8.97 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.38 -0.825 . . . . 0.0 111.42 -179.104 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.499 ' CE2' ' CE2' ' A' ' 19' ' ' PHE . 7.2 m-85 -81.6 -37.23 27.96 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.18 -0.95 . . . . 0.0 110.849 -179.238 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.512 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 11.2 mtt85 -48.76 -51.75 51.27 Favored Pre-proline 0 N--CA 1.495 1.802 0 O-C-N 121.305 -0.872 . . . . 0.0 111.823 -179.974 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.512 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 36.0 Cg_endo -59.71 -27.62 85.39 Favored 'Trans proline' 0 N--CA 1.492 1.421 0 O-C-N 123.137 1.072 . . . . 0.0 109.821 179.455 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.88 -48.09 48.23 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 177.349 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.416 HG23 ' CG ' ' A' ' 31' ' ' HIS . 41.6 mm -54.71 -33.02 26.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.479 179.826 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.545 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 0.3 OUTLIER -68.23 -31.26 70.63 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.569 -0.707 . . . . 0.0 110.399 -177.579 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.9 t -82.11 -17.86 45.02 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.505 -0.747 . . . . 0.0 111.195 -179.853 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -114.72 -15.94 11.85 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.179 -0.951 . . . . 0.0 111.362 -179.485 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.542 ' HB3' ' CB ' ' A' ' 34' ' ' LEU . 25.0 m80 -117.26 91.92 38.43 Favored Pre-proline 0 N--CA 1.499 1.977 0 O-C-N 121.27 -0.894 . . . . 0.0 109.634 -179.702 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -77.43 -71.74 0.01 OUTLIER 'Trans proline' 0 N--CA 1.484 0.969 0 O-C-N 123.378 1.199 . . . . 0.0 111.689 -179.199 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -56.26 -21.93 34.89 Favored Glycine 0 N--CA 1.499 2.867 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 -179.752 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.542 ' CB ' ' HB3' ' A' ' 31' ' ' HIS . 7.8 tt -53.41 92.85 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.48 -1.012 . . . . 0.0 110.845 179.506 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 18.8 m -57.7 175.53 0.18 Allowed 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.461 -0.774 . . . . 0.0 110.116 -179.386 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 14.7 mm -56.19 -61.32 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 O-C-N 121.351 -0.843 . . . . 0.0 110.312 -179.897 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.424 ' O ' ' HE2' ' A' ' 41' ' ' LYS . . . -48.59 -38.19 21.15 Favored Glycine 0 N--CA 1.497 2.701 0 N-CA-C 110.319 -1.112 . . . . 0.0 110.319 -179.12 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.4 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 33.4 m-20 -65.39 -36.5 84.15 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.558 -0.966 . . . . 0.0 109.737 178.755 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.95 -36.43 79.36 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.571 -0.705 . . . . 0.0 110.678 179.743 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.98 -49.64 17.12 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.526 -0.734 . . . . 0.0 110.242 -179.713 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.424 ' HE2' ' O ' ' A' ' 37' ' ' GLY . 0.9 OUTLIER -74.71 -13.41 60.61 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.602 -0.686 . . . . 0.0 111.294 -179.621 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.4 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 5.4 tptt -84.63 -59.73 2.28 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 120.933 -1.104 . . . . 0.0 109.836 179.339 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 16.3 mt -49.15 -29.25 5.17 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.541 -0.724 . . . . 0.0 111.043 -179.819 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.27 -38.58 96.69 Favored Glycine 0 N--CA 1.493 2.444 0 N-CA-C 109.425 -1.47 . . . . 0.0 109.425 179.934 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -50.56 -33.89 23.57 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.445 -1.032 . . . . 0.0 111.041 -179.708 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 31.9 mtt -86.69 -41.31 14.29 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.536 -0.728 . . . . 0.0 110.495 -179.793 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 72.3 t-105 -55.55 -21.21 16.05 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.502 -0.749 . . . . 0.0 111.136 -179.421 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.6 t -93.01 -33.46 14.12 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.324 -0.86 . . . . 0.0 110.239 -179.979 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -63.27 -36.32 83.28 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.637 -0.665 . . . . 0.0 110.067 179.891 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -62.56 150.68 39.82 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.587 -0.696 . . . . 0.0 110.201 179.949 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 83.9 p -98.22 -152.08 0.39 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.611 -0.681 . . . . 0.0 109.588 179.677 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -82.58 56.57 3.38 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.305 -0.872 . . . . 0.0 110.053 179.794 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -134.98 -46.03 0.72 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.444 -0.785 . . . . 0.0 110.198 179.932 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -63.72 -31.14 72.22 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.545 -0.722 . . . . 0.0 110.457 -179.708 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 19.8 ttpt -99.09 22.75 9.92 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.46 -0.775 . . . . 0.0 110.824 -179.73 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.436 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 4.9 mt-30 -93.44 -59.79 0.2 Allowed Pre-proline 0 N--CA 1.495 1.807 0 O-C-N 121.146 -0.971 . . . . 0.0 110.787 -179.659 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.436 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.5 Cg_endo -79.28 -27.3 4.44 Favored 'Trans proline' 0 N--CA 1.486 1.071 0 O-C-N 122.953 0.975 . . . . 0.0 111.468 -179.58 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . 0.413 ' CE2' ' HB3' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -84.48 -21.12 30.74 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.354 -0.841 . . . . 0.0 111.914 -178.163 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.61 -27.08 64.77 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.245 -0.909 . . . . 0.0 111.033 -179.287 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -78.14 -20.03 52.87 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.42 -0.8 . . . . 0.0 110.508 179.923 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 58.1 tttt -64.05 -46.38 84.63 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.462 -0.773 . . . . 0.0 109.803 179.717 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.5 -13.14 59.99 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.555 -0.715 . . . . 0.0 110.532 179.578 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -78.21 -3.0 40.49 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.325 -0.86 . . . . 0.0 110.081 178.832 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 26.2 mmtm -105.25 -25.31 12.49 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.108 -0.995 . . . . 0.0 110.068 179.507 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.2 mp -88.8 -16.21 32.66 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.749 -0.595 . . . . 0.0 109.926 178.704 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.5 tptt -74.7 -35.89 62.72 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.46 -0.775 . . . . 0.0 109.482 179.397 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -67.2 -57.48 6.65 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.686 -0.634 . . . . 0.0 109.829 179.776 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -58.28 -26.72 63.32 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.601 -0.687 . . . . 0.0 110.593 -179.955 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.419 ' CE2' ' HD3' ' A' ' 12' ' ' PRO . 37.0 t80 -73.63 -68.25 0.52 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.473 -0.767 . . . . 0.0 109.445 179.503 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -55.34 -21.15 13.95 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.798 -0.564 . . . . 0.0 111.211 -179.772 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -95.46 -19.1 20.14 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.423 -0.798 . . . . 0.0 111.316 -179.485 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -109.73 -31.93 7.27 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.242 -0.911 . . . . 0.0 110.907 -179.537 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.5 tp -67.05 -33.13 61.3 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 C-N-CA 119.822 -0.751 . . . . 0.0 110.024 -179.733 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.19 -35.68 74.01 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.615 -0.678 . . . . 0.0 109.907 179.702 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -91.62 -20.0 22.1 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.659 -0.651 . . . . 0.0 110.241 179.469 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -73.14 -41.13 64.3 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.409 -0.807 . . . . 0.0 110.198 179.813 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 36.1 mtt180 -94.04 6.02 49.86 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.511 -0.743 . . . . 0.0 111.081 179.982 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 56.32 68.14 0.9 Allowed 'General case' 0 N--CA 1.502 2.126 0 O-C-N 120.982 -1.074 . . . . 0.0 110.419 -179.738 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.2 ptmm? . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.365 179.81 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.1 tpt . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.051 0.453 . . . . 0.0 110.199 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.56 175.36 5.52 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.543 -0.723 . . . . 0.0 110.26 179.904 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 66.7 tttt -169.94 34.43 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.601 -0.687 . . . . 0.0 110.23 179.857 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.7 mttt 53.89 -161.42 0.13 Allowed 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.469 -0.769 . . . . 0.0 110.677 179.837 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -133.36 177.23 2.35 Favored Pre-proline 0 N--CA 1.494 1.729 0 O-C-N 121.583 -0.698 . . . . 0.0 110.125 -179.765 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.19 -28.27 18.91 Favored 'Trans proline' 0 N--CA 1.487 1.091 0 O-C-N 123.415 1.219 . . . . 0.0 110.376 -179.856 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -78.67 -23.28 45.79 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.61 -0.682 . . . . 0.0 110.399 -179.389 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -99.1 133.69 21.95 Favored Pre-proline 0 N--CA 1.492 1.675 0 O-C-N 121.384 -0.823 . . . . 0.0 109.395 179.15 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -71.65 111.64 3.18 Favored 'Trans proline' 0 C--N 1.318 -1.043 0 O-C-N 123.138 1.072 . . . . 0.0 110.517 -179.517 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.7 pttt -67.97 -160.17 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.541 -0.725 . . . . 0.0 109.751 179.815 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -60.44 141.03 91.86 Favored Pre-proline 0 N--CA 1.497 1.898 0 O-C-N 121.359 -0.838 . . . . 0.0 109.88 179.769 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.408 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 46.8 Cg_endo -73.77 129.87 14.0 Favored 'Trans proline' 0 C--N 1.317 -1.094 0 O-C-N 123.248 1.131 . . . . 0.0 110.193 -179.897 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -81.26 -179.59 5.13 Favored 'Trans proline' 0 C--N 1.318 -1.051 0 O-C-N 123.271 1.143 . . . . 0.0 110.08 -179.94 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.2 t -170.01 62.51 0.05 OUTLIER 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.505 -0.747 . . . . 0.0 110.828 -179.928 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 70.88 -75.98 0.07 Allowed 'General case' 0 N--CA 1.505 2.308 0 O-C-N 121.043 -1.035 . . . . 0.0 110.504 -179.601 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -50.78 -45.83 59.31 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.23 -0.919 . . . . 0.0 110.952 -179.823 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -61.45 -34.35 75.27 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 120.183 -0.607 . . . . 0.0 109.71 179.622 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 29.8 mt -76.44 -40.16 51.38 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.486 -0.759 . . . . 0.0 110.404 -179.539 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.494 ' CE2' ' CZ ' ' A' ' 23' ' ' TYR . 32.0 t80 -66.45 -51.18 59.61 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.554 -0.716 . . . . 0.0 110.586 -179.43 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 2.2 t -65.7 -28.94 69.44 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.453 -0.78 . . . . 0.0 110.051 179.707 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.9 m -70.06 -15.87 63.06 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.647 -0.658 . . . . 0.0 111.54 -179.273 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -125.65 -25.72 3.64 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.068 -1.02 . . . . 0.0 112.133 -179.116 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.494 ' CZ ' ' CE2' ' A' ' 19' ' ' PHE . 10.6 m-85 -76.95 -38.47 53.25 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.165 -0.959 . . . . 0.0 110.798 -179.448 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.471 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 2.1 mtt180 -48.08 -53.33 33.86 Favored Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 121.359 -0.838 . . . . 0.0 112.415 -179.527 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.471 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 36.2 Cg_endo -59.61 -27.66 85.49 Favored 'Trans proline' 0 N--CA 1.494 1.517 0 O-C-N 123.221 1.116 . . . . 0.0 110.185 -179.624 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.0 tmtm? -70.46 -46.78 63.16 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 177.542 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 46.1 mm -57.71 -21.68 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.632 179.724 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.527 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 4.9 mmmm -81.06 -26.96 35.91 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.141 -0.974 . . . . 0.0 110.426 -177.573 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.8 t -86.28 -3.23 58.94 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.482 -0.761 . . . . 0.0 111.119 179.627 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -132.51 -2.01 3.45 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.062 -1.024 . . . . 0.0 112.018 -179.464 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.533 ' HB3' ' CB ' ' A' ' 34' ' ' LEU . 54.4 m80 -126.33 95.65 38.15 Favored Pre-proline 0 N--CA 1.499 2.015 0 O-C-N 120.915 -1.116 . . . . 0.0 109.779 179.924 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -78.34 -75.41 0.01 OUTLIER 'Trans proline' 0 N--CA 1.485 0.979 0 O-C-N 123.43 1.226 . . . . 0.0 111.708 -179.301 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -51.35 -28.71 20.91 Favored Glycine 0 N--CA 1.503 3.113 0 N-CA-C 110.343 -1.103 . . . . 0.0 110.343 -179.483 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.533 ' CB ' ' HB3' ' A' ' 31' ' ' HIS . 7.8 tt -46.59 96.04 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.792 -0.828 . . . . 0.0 111.455 179.844 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 44.8 m -66.52 178.3 1.3 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.675 -0.64 . . . . 0.0 109.863 -179.77 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 13.8 mm -58.72 -61.44 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.053 0 O-C-N 121.46 -0.775 . . . . 0.0 110.201 179.908 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.435 ' O ' ' HE2' ' A' ' 41' ' ' LYS . . . -46.9 -38.34 10.18 Favored Glycine 0 N--CA 1.498 2.777 0 N-CA-C 110.617 -0.993 . . . . 0.0 110.617 -178.806 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.443 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 1.6 m-20 -68.57 -33.44 74.09 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.585 -0.95 . . . . 0.0 110.055 178.917 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.34 -38.63 85.14 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.333 -0.854 . . . . 0.0 110.776 179.69 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.2 -38.36 78.58 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.65 -0.656 . . . . 0.0 110.121 -179.226 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.435 ' HE2' ' O ' ' A' ' 37' ' ' GLY . 1.2 ptpm? -89.72 -13.8 36.06 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 119.988 -0.685 . . . . 0.0 111.167 -179.69 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.443 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 3.4 tptt -87.66 -9.33 54.5 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.006 -1.058 . . . . 0.0 110.556 179.015 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 22.4 mt -95.11 -32.82 12.91 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.39 -0.819 . . . . 0.0 109.287 179.362 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.91 -35.42 72.36 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 108.605 -1.798 . . . . 0.0 108.605 179.178 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -57.13 -39.26 74.8 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.633 -0.922 . . . . 0.0 110.363 179.881 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 30.5 mtt -77.69 -48.69 16.12 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.54 -0.725 . . . . 0.0 110.355 179.991 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 68.8 t-105 -58.3 -25.46 61.87 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.539 -0.726 . . . . 0.0 110.659 -179.712 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 62.5 p -85.9 -37.26 19.3 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.394 -0.816 . . . . 0.0 110.054 179.963 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -63.92 -31.95 73.31 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.523 -0.736 . . . . 0.0 109.967 179.873 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 89.4 mm-40 -62.28 148.73 44.06 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.58 -0.7 . . . . 0.0 110.134 179.889 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.8 m -101.41 -153.01 0.44 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.58 -0.7 . . . . 0.0 109.621 179.724 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -82.52 56.34 3.27 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.344 -0.847 . . . . 0.0 110.119 179.753 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 17.6 tptt -132.25 -49.29 0.93 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.449 -0.782 . . . . 0.0 110.133 -179.994 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -66.8 -35.7 80.68 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.57 -0.706 . . . . 0.0 110.46 -179.948 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.419 ' O ' ' N ' ' A' ' 59' ' ' GLU . 17.6 tttt -71.59 -37.78 70.96 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.552 -0.718 . . . . 0.0 110.864 -179.669 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.0 mm-40 -43.53 -57.19 5.9 Favored Pre-proline 0 N--CA 1.507 2.406 0 O-C-N 121.318 -0.864 . . . . 0.0 112.751 -178.674 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -77.19 -36.21 1.44 Allowed 'Trans proline' 0 N--CA 1.489 1.255 0 O-C-N 123.071 1.037 . . . . 0.0 111.903 -179.52 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -83.46 -12.28 56.53 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.352 -0.843 . . . . 0.0 112.561 -177.645 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.419 ' N ' ' O ' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -82.72 -27.47 31.13 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.033 -1.042 . . . . 0.0 111.112 -179.165 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -74.01 -20.04 60.45 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.343 -0.848 . . . . 0.0 110.751 -179.987 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 43.5 tttm -65.8 -42.08 91.11 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.286 -0.883 . . . . 0.0 109.962 179.796 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -81.34 -16.79 51.29 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.599 -0.688 . . . . 0.0 110.224 179.385 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.27 -36.86 78.77 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.343 -0.848 . . . . 0.0 110.306 179.89 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -70.82 -62.34 1.43 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.239 -0.913 . . . . 0.0 110.003 179.858 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.7 mp -46.88 -24.15 0.55 Allowed 'General case' 0 N--CA 1.505 2.291 0 O-C-N 121.555 -0.716 . . . . 0.0 112.157 -179.453 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.8 tptm -68.23 -48.14 65.95 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.299 -0.876 . . . . 0.0 109.506 179.189 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -65.0 -55.49 18.7 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.735 -0.603 . . . . 0.0 109.953 179.718 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 60.3 mttm -56.67 -26.89 57.56 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.467 -0.771 . . . . 0.0 110.481 179.888 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.408 ' CE2' ' HD3' ' A' ' 12' ' ' PRO . 50.1 t80 -75.91 -67.99 0.62 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.499 -0.751 . . . . 0.0 109.296 179.385 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -51.36 -24.34 4.66 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.662 -0.648 . . . . 0.0 111.478 -179.548 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 46.8 mttp -92.62 -62.53 1.38 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.439 -0.788 . . . . 0.0 110.917 -179.44 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -58.1 -31.04 66.74 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.609 -0.682 . . . . 0.0 111.135 -179.078 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.6 tp -62.48 -35.84 71.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 O-C-N 121.342 -0.849 . . . . 0.0 110.457 -179.474 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.98 -52.5 65.13 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.571 -0.706 . . . . 0.0 110.095 -179.949 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.89 -25.92 61.25 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.656 -0.653 . . . . 0.0 110.122 179.682 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -66.27 -31.52 72.37 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.569 -0.707 . . . . 0.0 110.073 179.92 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 17.7 mtt-85 -84.23 -80.84 0.19 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.65 -0.656 . . . . 0.0 110.082 -179.958 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -168.71 44.8 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.264 -0.897 . . . . 0.0 110.076 -179.932 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 15.2 mtmt . . . . . 0 N--CA 1.494 1.735 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.232 -179.972 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.5 ttt . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.035 0.445 . . . . 0.0 110.26 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -100.89 108.32 20.05 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.667 -0.645 . . . . 0.0 110.197 179.977 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -70.6 68.24 0.38 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.604 -0.685 . . . . 0.0 110.423 -179.782 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.3 mtpt -66.66 -137.11 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.524 -0.735 . . . . 0.0 109.843 179.99 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -171.01 175.01 1.41 Allowed Pre-proline 0 N--CA 1.496 1.842 0 O-C-N 120.695 -1.253 . . . . 0.0 109.681 179.978 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -69.84 -34.68 13.85 Favored 'Trans proline' 0 N--CA 1.488 1.154 0 O-C-N 123.273 1.144 . . . . 0.0 109.926 179.744 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.7 p30 -76.92 5.85 7.22 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.777 -0.577 . . . . 0.0 112.056 -177.591 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -98.4 155.74 36.52 Favored Pre-proline 0 N--CA 1.492 1.665 0 O-C-N 120.927 -1.108 . . . . 0.0 108.304 177.68 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.422 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 53.7 Cg_endo -84.73 43.37 1.3 Allowed 'Trans proline' 0 C--N 1.315 -1.202 0 O-C-N 123.047 1.025 . . . . 0.0 112.123 -179.264 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.5 mtpt -43.3 139.91 1.78 Allowed 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.396 -0.815 . . . . 0.0 112.872 -179.065 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.7 tpt180 49.79 99.82 0.04 OUTLIER Pre-proline 0 N--CA 1.497 1.923 0 O-C-N 121.795 -0.566 . . . . 0.0 112.156 178.911 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.421 ' HB3' ' CD2' ' A' ' 69' ' ' TYR . 47.1 Cg_endo -75.79 132.21 14.17 Favored 'Trans proline' 0 C--N 1.318 -1.028 0 O-C-N 123.248 1.131 . . . . 0.0 109.321 178.581 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -80.06 155.88 23.02 Favored 'Trans proline' 0 C--N 1.316 -1.152 0 O-C-N 123.161 1.085 . . . . 0.0 110.196 -179.576 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 7.6 t -158.73 51.43 0.39 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.515 -0.741 . . . . 0.0 110.961 -179.584 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 71.58 -73.83 0.09 Allowed 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.348 -0.845 . . . . 0.0 110.403 -179.518 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -46.71 -53.72 11.16 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.327 -0.858 . . . . 0.0 111.442 -179.561 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -55.61 -40.93 72.75 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.518 -0.739 . . . . 0.0 109.965 179.512 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.4 mt -62.09 -41.41 98.16 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.719 -0.613 . . . . 0.0 109.834 179.819 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -75.19 -53.89 8.05 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.592 -0.692 . . . . 0.0 110.232 -179.996 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 3.7 m -55.44 -55.96 25.7 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.435 -0.791 . . . . 0.0 110.434 -179.976 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 62.9 p -53.6 -29.92 39.97 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.467 -0.771 . . . . 0.0 110.521 179.994 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -88.56 -32.51 18.1 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.618 -0.677 . . . . 0.0 110.74 -179.781 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -94.63 13.61 23.7 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.451 -0.781 . . . . 0.0 111.513 -179.446 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.486 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 8.5 mtt180 -88.37 -42.92 0.47 Allowed Pre-proline 0 N--CA 1.488 1.434 0 O-C-N 121.192 -0.942 . . . . 0.0 112.367 179.471 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.509 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.1 Cg_endo -67.04 -16.95 50.68 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 O-C-N 122.711 0.848 . . . . 0.0 110.427 -179.203 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.41 -50.78 23.91 Favored 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 177.859 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 39.0 mm -52.93 -32.7 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 CA-C-O 121.49 0.662 . . . . 0.0 110.281 179.641 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.509 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.6 mmmm -72.37 -37.43 68.77 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.252 -177.215 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.0 t -59.91 -24.57 64.43 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.377 -0.827 . . . . 0.0 110.619 -179.699 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -116.37 -21.83 9.08 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.455 -0.778 . . . . 0.0 110.903 -179.609 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 43.7 m80 -121.71 96.32 47.34 Favored Pre-proline 0 N--CA 1.495 1.788 0 O-C-N 121.342 -0.849 . . . . 0.0 109.682 179.93 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -74.98 -33.27 4.74 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.366 1.193 . . . . 0.0 110.361 -179.817 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -79.48 -11.8 84.46 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 110.35 -1.1 . . . . 0.0 110.35 179.805 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.46 81.64 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.287 -1.125 . . . . 0.0 110.753 -179.668 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.1 t -74.89 177.9 5.94 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.425 -0.797 . . . . 0.0 109.721 179.721 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 37.3 mm -51.33 -37.25 18.21 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.207 0 O-C-N 121.234 -0.916 . . . . 0.0 110.586 -179.899 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -55.57 -68.94 1.43 Allowed Glycine 0 N--CA 1.494 2.502 0 N-CA-C 109.328 -1.509 . . . . 0.0 109.328 179.824 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.499 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 1.9 m-20 -66.19 -29.65 69.97 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.786 -0.832 . . . . 0.0 110.724 179.475 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 75.1 m -66.58 -29.26 69.27 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.164 -0.96 . . . . 0.0 110.291 179.648 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.11 -45.05 59.27 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.553 -0.717 . . . . 0.0 109.948 179.848 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -82.92 -17.72 42.66 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.668 -0.645 . . . . 0.0 112.213 -178.897 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.499 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -82.18 3.18 28.25 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 120.762 -1.211 . . . . 0.0 110.818 179.665 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 34.1 mt -105.79 -29.44 10.04 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.268 -0.895 . . . . 0.0 109.632 179.502 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.09 -37.8 82.85 Favored Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -179.79 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -50.16 -36.02 28.46 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.428 -1.043 . . . . 0.0 110.906 -179.644 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 64.2 mtm -87.27 -39.24 15.58 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.518 -0.739 . . . . 0.0 109.946 179.614 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 67.3 t-105 -55.56 -31.07 61.85 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.605 -0.684 . . . . 0.0 110.994 -179.643 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.2 t -87.35 -32.84 19.4 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.276 -0.89 . . . . 0.0 110.229 -179.802 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -63.66 -37.06 85.92 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.509 -0.744 . . . . 0.0 109.915 179.869 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.0 mm-40 -59.7 149.68 29.99 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.628 -0.67 . . . . 0.0 110.336 179.919 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 85.6 p -92.83 -152.15 0.31 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.688 -0.633 . . . . 0.0 109.613 179.679 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -83.67 55.55 3.27 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.313 -0.867 . . . . 0.0 110.151 179.82 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -135.95 -43.61 0.65 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.453 -0.779 . . . . 0.0 110.255 -179.936 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -62.49 -33.85 75.7 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.457 -0.777 . . . . 0.0 110.336 -179.904 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -96.87 22.35 8.41 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.442 -0.786 . . . . 0.0 111.092 -179.556 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.443 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 2.6 mm100 -92.19 -57.46 0.24 Allowed Pre-proline 0 N--CA 1.496 1.852 0 O-C-N 121.072 -1.017 . . . . 0.0 110.278 179.889 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.443 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 57.5 Cg_endo -82.96 -26.35 2.42 Favored 'Trans proline' 0 N--CA 1.484 0.945 0 O-C-N 122.929 0.963 . . . . 0.0 110.748 179.568 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -83.21 -18.54 38.92 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.456 -0.777 . . . . 0.0 111.955 -178.149 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.2 -26.14 52.48 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.175 -0.953 . . . . 0.0 110.944 -179.288 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -79.45 -21.31 45.64 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.501 -0.75 . . . . 0.0 110.648 179.947 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 62.2 tttt -65.9 -44.33 85.57 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.455 -0.778 . . . . 0.0 109.74 179.643 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -79.99 -15.13 57.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.581 -0.699 . . . . 0.0 110.161 179.174 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.08 -32.97 72.61 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.351 -0.843 . . . . 0.0 109.942 179.592 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -77.59 -63.9 1.27 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.579 -0.701 . . . . 0.0 109.73 179.45 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.0 mp -50.1 -25.68 3.72 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.48 -0.762 . . . . 0.0 111.114 -179.807 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -67.19 -49.95 62.74 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.523 -0.736 . . . . 0.0 109.373 179.307 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -61.98 -49.31 76.61 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.68 -0.637 . . . . 0.0 109.351 179.298 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 37.1 mttp -60.33 -27.37 67.3 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.719 -0.613 . . . . 0.0 110.067 179.444 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.422 ' CD2' ' HB2' ' A' ' 9' ' ' PRO . 19.8 t80 -74.2 -65.11 0.89 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.378 -0.826 . . . . 0.0 109.13 179.024 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -58.1 -25.5 61.42 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.784 -0.572 . . . . 0.0 111.115 -179.495 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.2 mmmt -91.83 -14.25 30.06 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.354 -0.841 . . . . 0.0 111.89 -179.102 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -111.84 -30.13 7.41 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.057 -1.027 . . . . 0.0 110.902 -179.624 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 2.5 tp -66.99 -36.21 76.57 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.529 -0.732 . . . . 0.0 110.115 -179.787 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.02 -49.83 76.4 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.527 -0.733 . . . . 0.0 110.019 179.809 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.49 -17.87 60.0 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.656 -0.653 . . . . 0.0 110.377 179.453 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 62.2 t80 -77.6 -34.95 53.29 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.396 -0.815 . . . . 0.0 110.043 179.809 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 35.0 mtt180 -84.54 6.87 21.99 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.644 -0.66 . . . . 0.0 111.153 -179.98 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 51.12 88.5 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.08 -1.013 . . . . 0.0 110.982 179.844 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.79 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.191 179.897 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.1 ttt . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 121.124 0.488 . . . . 0.0 110.183 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.79 37.58 4.05 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.564 -0.71 . . . . 0.0 110.246 179.981 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 68.6 tttt -169.47 121.95 0.74 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.571 -0.706 . . . . 0.0 109.991 179.885 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 25.0 mtmm -61.25 -83.45 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.67 -0.644 . . . . 0.0 110.624 -179.55 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -138.6 163.86 43.97 Favored Pre-proline 0 N--CA 1.495 1.785 0 O-C-N 121.16 -0.963 . . . . 0.0 111.332 -179.339 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -73.01 -9.49 23.61 Favored 'Trans proline' 0 N--CA 1.49 1.277 0 O-C-N 123.709 1.373 . . . . 0.0 111.729 179.698 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -108.52 -25.3 11.0 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.377 -0.827 . . . . 0.0 109.751 179.264 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -95.25 140.87 22.58 Favored Pre-proline 0 N--CA 1.494 1.743 0 O-C-N 121.628 -0.67 . . . . 0.0 110.046 179.777 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -74.99 124.48 8.66 Favored 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.28 1.147 . . . . 0.0 110.499 -179.816 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.3 pttt -70.82 -154.84 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.529 -0.732 . . . . 0.0 109.73 179.651 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.26 141.65 87.0 Favored Pre-proline 0 N--CA 1.498 1.956 0 O-C-N 121.374 -0.829 . . . . 0.0 109.806 179.661 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -74.1 133.39 17.97 Favored 'Trans proline' 0 C--N 1.318 -1.076 0 O-C-N 123.305 1.16 . . . . 0.0 110.321 -179.811 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -80.94 173.7 11.71 Favored 'Trans proline' 0 C--N 1.319 -1.004 0 O-C-N 123.299 1.157 . . . . 0.0 109.903 179.909 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 37.2 t -170.53 62.9 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.44 -0.787 . . . . 0.0 110.868 -179.899 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 69.7 -76.31 0.06 Allowed 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.041 -1.037 . . . . 0.0 110.452 -179.62 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -47.67 -50.22 25.36 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.267 -0.896 . . . . 0.0 111.267 -179.463 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -58.73 -35.78 73.25 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.67 -0.643 . . . . 0.0 110.108 179.785 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 24.1 mt -74.4 -35.01 63.43 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.501 -0.749 . . . . 0.0 110.228 -179.581 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . 0.502 ' CE2' ' CZ ' ' A' ' 23' ' ' TYR . 54.9 t80 -74.28 -54.2 8.17 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.599 -0.688 . . . . 0.0 110.626 -179.373 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.8 t -59.54 -48.77 80.36 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.583 -0.698 . . . . 0.0 110.489 -179.744 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.7 t -58.63 -26.05 63.32 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.509 -0.744 . . . . 0.0 110.671 -179.694 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -99.13 -22.03 15.87 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.519 -0.738 . . . . 0.0 111.212 -179.316 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.502 ' CZ ' ' CE2' ' A' ' 19' ' ' PHE . 7.1 m-85 -92.68 -36.38 12.98 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.389 -0.819 . . . . 0.0 110.829 -179.466 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.47 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 9.6 mtt180 -47.59 -53.56 29.34 Favored Pre-proline 0 N--CA 1.499 1.986 0 O-C-N 121.38 -0.825 . . . . 0.0 112.215 -179.55 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.47 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 36.8 Cg_endo -60.64 -26.93 83.93 Favored 'Trans proline' 0 N--CA 1.494 1.544 0 O-C-N 123.198 1.104 . . . . 0.0 110.021 179.997 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.06 -47.13 63.25 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 177.726 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.426 ' O ' ' HB2' ' A' ' 31' ' ' HIS . 46.5 mm -55.97 -22.7 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.328 179.551 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.535 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 16.1 mmmt -82.74 -29.64 29.6 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.327 -0.858 . . . . 0.0 111.34 -176.717 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.9 t -72.91 -34.73 66.81 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.177 -0.952 . . . . 0.0 110.18 -179.627 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -97.67 -4.43 37.36 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.72 -0.612 . . . . 0.0 111.226 -179.258 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.441 ' CB ' ' HB2' ' A' ' 34' ' ' LEU . 27.8 m80 -140.08 96.46 8.14 Favored Pre-proline 0 N--CA 1.493 1.703 0 O-C-N 121.26 -0.9 . . . . 0.0 108.698 179.016 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -75.03 -47.36 0.2 Allowed 'Trans proline' 0 C--N 1.315 -1.205 0 O-C-N 123.481 1.253 . . . . 0.0 110.662 -179.306 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.59 -20.59 63.92 Favored Glycine 0 N--CA 1.494 2.513 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 179.03 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.441 ' HB2' ' CB ' ' A' ' 31' ' ' HIS . 0.2 OUTLIER -48.01 92.22 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.471 -1.017 . . . . 0.0 111.705 -179.769 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.8 m -66.89 -179.3 0.88 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.497 -0.752 . . . . 0.0 109.461 179.3 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 17.8 mm -60.78 -56.39 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.382 -0.824 . . . . 0.0 109.843 179.946 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.414 ' O ' ' HE2' ' A' ' 41' ' ' LYS . . . -49.89 -43.41 39.48 Favored Glycine 0 N--CA 1.497 2.754 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 -179.018 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.453 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 40.5 m-20 -61.5 -36.17 79.73 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.636 -0.92 . . . . 0.0 109.993 178.949 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 10.9 m -60.08 -36.9 78.4 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.28 -0.887 . . . . 0.0 110.785 179.573 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.54 -54.02 6.91 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.624 -0.673 . . . . 0.0 110.357 -179.695 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.414 ' HE2' ' O ' ' A' ' 37' ' ' GLY . 1.8 ptpm? -67.39 -28.34 67.84 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.63 -0.669 . . . . 0.0 111.458 -179.23 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.453 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -81.5 -2.01 48.18 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.911 -1.118 . . . . 0.0 110.916 179.697 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 26.2 mt -106.6 -34.12 7.44 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.203 -0.935 . . . . 0.0 110.174 -179.904 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.5 -40.93 96.45 Favored Glycine 0 N--CA 1.494 2.504 0 N-CA-C 109.885 -1.286 . . . . 0.0 109.885 -179.653 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -55.88 -34.12 65.22 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.544 -0.974 . . . . 0.0 110.732 -179.628 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 47.1 mmm -80.65 -46.88 14.91 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.542 -0.724 . . . . 0.0 110.358 -179.876 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 74.2 t-105 -56.76 -22.11 33.3 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.53 -0.731 . . . . 0.0 110.989 -179.621 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 16.5 t -91.83 -35.52 14.04 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.269 -0.894 . . . . 0.0 110.231 179.976 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -65.02 -34.66 78.97 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.551 -0.718 . . . . 0.0 110.041 179.89 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 63.2 mm-40 -59.01 150.58 24.27 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.556 -0.715 . . . . 0.0 110.417 179.999 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 10.5 t -89.91 -151.53 0.24 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.637 -0.665 . . . . 0.0 109.545 179.744 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -85.74 53.6 2.83 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.258 -0.901 . . . . 0.0 110.192 179.849 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 67.4 mttt -132.17 -43.16 0.96 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.438 -0.789 . . . . 0.0 110.208 179.97 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -59.61 -31.42 69.47 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.488 -0.757 . . . . 0.0 110.626 -179.673 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 69.8 tttt -101.0 25.54 7.96 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.467 -0.771 . . . . 0.0 110.964 -179.503 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.425 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 1.7 mm-40 -97.64 -53.43 0.21 Allowed Pre-proline 0 N--CA 1.496 1.842 0 O-C-N 121.213 -0.929 . . . . 0.0 110.786 -179.836 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.425 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.6 Cg_endo -85.11 -31.86 0.35 Allowed 'Trans proline' 0 C--N 1.321 -0.908 0 O-C-N 122.92 0.958 . . . . 0.0 111.33 -179.634 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.34 -11.63 57.46 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.417 -0.802 . . . . 0.0 111.775 -178.579 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -79.22 -26.71 42.49 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.075 -1.016 . . . . 0.0 110.856 -179.421 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -76.12 -20.06 57.97 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.487 -0.758 . . . . 0.0 110.871 -179.9 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 36.7 tttt -65.02 -44.23 89.83 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.387 -0.821 . . . . 0.0 110.109 179.977 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -82.44 -15.51 52.33 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.51 -0.744 . . . . 0.0 110.11 179.283 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.36 -28.17 67.98 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.29 -0.881 . . . . 0.0 109.362 178.923 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -81.5 -64.99 1.07 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.61 -0.681 . . . . 0.0 109.472 179.175 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.404 ' O ' ' CD1' ' A' ' 69' ' ' TYR . 3.8 mp -50.65 -24.23 3.17 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.573 -0.704 . . . . 0.0 111.318 -179.732 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.3 tttt -63.18 -53.07 59.0 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.443 -0.785 . . . . 0.0 109.663 179.292 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -62.51 -48.78 78.07 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.682 -0.636 . . . . 0.0 110.25 -179.996 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 24.2 mmtp -60.32 -27.18 67.13 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.543 -0.723 . . . . 0.0 110.466 -179.674 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.404 ' CD1' ' O ' ' A' ' 65' ' ' LEU . 3.7 m-85 -80.72 -64.69 1.13 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.518 -0.739 . . . . 0.0 109.894 179.845 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -50.56 -35.2 28.69 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.5 -0.75 . . . . 0.0 111.163 -179.697 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 41.5 mmtt -76.11 -50.82 13.62 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.546 -0.721 . . . . 0.0 110.778 -179.754 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -74.52 -23.91 58.89 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.45 -0.781 . . . . 0.0 111.302 -179.103 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 9.1 tp -80.37 -37.8 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.266 -0.896 . . . . 0.0 109.904 -179.983 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -41.57 -34.53 0.59 Allowed 'General case' 0 N--CA 1.509 2.494 0 CA-C-O 121.164 0.507 . . . . 0.0 111.371 -179.499 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.82 -49.93 64.23 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 178.208 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -70.95 -59.88 2.54 Favored 'General case' 0 N--CA 1.494 1.736 0 CA-C-O 121.437 0.637 . . . . 0.0 109.614 178.901 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.25 -57.49 12.81 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.863 -0.523 . . . . 0.0 110.238 179.917 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 56.19 65.34 1.46 Allowed 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.438 -0.789 . . . . 0.0 110.395 -179.881 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.496 1.859 0 CA-C-O 118.083 -0.96 . . . . 0.0 110.235 179.996 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.2 ttt . . . . . 0 N--CA 1.491 1.625 0 CA-C-O 121.111 0.481 . . . . 0.0 110.224 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -98.43 95.97 7.69 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.563 -0.711 . . . . 0.0 110.186 179.977 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 31.6 ttmt -170.08 71.28 0.06 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.556 -0.715 . . . . 0.0 110.159 179.867 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 50.8 mtpt -60.17 -59.58 5.19 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.453 -0.779 . . . . 0.0 110.319 -179.897 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -162.57 163.16 18.42 Favored Pre-proline 0 N--CA 1.493 1.724 0 O-C-N 121.604 -0.685 . . . . 0.0 110.211 -179.908 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -73.01 -47.18 0.33 Allowed 'Trans proline' 0 C--N 1.317 -1.091 0 O-C-N 123.399 1.21 . . . . 0.0 110.468 179.984 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -93.45 25.83 3.26 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.622 -0.674 . . . . 0.0 110.856 -179.705 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -96.86 131.58 27.63 Favored Pre-proline 0 N--CA 1.493 1.71 0 O-C-N 121.405 -0.81 . . . . 0.0 109.863 179.683 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.421 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 48.6 Cg_endo -73.13 79.78 1.99 Allowed 'Trans proline' 0 N--CA 1.485 1.001 0 O-C-N 123.145 1.076 . . . . 0.0 110.725 -179.755 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -108.2 26.27 10.62 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.585 -0.697 . . . . 0.0 110.784 179.815 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -163.27 95.62 1.08 Allowed Pre-proline 0 N--CA 1.494 1.767 0 O-C-N 121.702 -0.624 . . . . 0.0 110.16 -179.906 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.414 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 47.3 Cg_endo -75.56 114.77 4.04 Favored 'Trans proline' 0 C--N 1.316 -1.14 0 O-C-N 123.352 1.185 . . . . 0.0 110.66 -179.843 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -81.23 157.57 19.93 Favored 'Trans proline' 0 C--N 1.319 -1.013 0 O-C-N 123.303 1.159 . . . . 0.0 110.026 179.779 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 32.6 t -151.82 55.78 0.84 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.467 -0.771 . . . . 0.0 110.91 -179.625 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 67.87 -74.94 0.07 Allowed 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.194 -0.942 . . . . 0.0 110.152 -179.65 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -47.77 -51.26 23.06 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.416 -0.802 . . . . 0.0 111.402 -179.605 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -57.82 -41.67 82.73 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.455 -0.778 . . . . 0.0 109.743 179.548 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 61.9 mt -59.73 -46.65 88.46 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.576 -0.703 . . . . 0.0 109.947 179.9 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -69.67 -51.33 35.64 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.679 -0.638 . . . . 0.0 110.284 -179.729 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.5 m -56.24 -54.33 46.56 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.54 -0.725 . . . . 0.0 110.787 -179.658 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 34.7 t -57.94 -30.75 66.22 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.358 -0.839 . . . . 0.0 110.539 -179.807 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 -86.66 -29.42 22.51 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.534 -0.729 . . . . 0.0 110.721 -179.651 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -99.62 9.76 42.57 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.35 -0.844 . . . . 0.0 111.519 -179.401 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.481 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 3.6 mtt180 -79.75 -50.12 1.27 Allowed Pre-proline 0 N--CA 1.49 1.567 0 O-C-N 121.222 -0.924 . . . . 0.0 111.522 179.453 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 37.5 Cg_endo -63.74 -15.61 49.88 Favored 'Trans proline' 0 N--CA 1.491 1.362 0 O-C-N 122.918 0.957 . . . . 0.0 110.609 -179.631 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 9.1 tmtt? -72.69 -49.84 28.79 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 177.93 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 16.2 mm -55.65 -38.11 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 CA-C-O 121.51 0.671 . . . . 0.0 110.204 179.804 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.524 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 4.2 mmmm -68.15 -40.93 82.27 Favored 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.183 -177.101 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.4 t -58.04 -24.08 56.93 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.398 -0.814 . . . . 0.0 110.88 -179.527 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -114.32 -23.6 9.32 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.478 -0.764 . . . . 0.0 110.686 -179.679 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 53.8 m80 -119.67 96.79 49.79 Favored Pre-proline 0 N--CA 1.494 1.75 0 O-C-N 121.483 -0.761 . . . . 0.0 109.519 -179.783 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -75.08 -27.94 9.45 Favored 'Trans proline' 0 C--N 1.314 -1.28 0 O-C-N 123.525 1.276 . . . . 0.0 110.542 -179.855 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -85.72 -11.34 74.37 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 110.449 -1.06 . . . . 0.0 110.449 179.951 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.18 81.72 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.282 -1.128 . . . . 0.0 110.747 -179.608 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.5 m -70.98 171.0 11.58 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.407 -0.808 . . . . 0.0 109.904 -179.977 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 38.6 mm -51.76 -29.55 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.175 0 O-C-N 121.262 -0.899 . . . . 0.0 110.315 179.976 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.35 -69.06 1.39 Allowed Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.31 -1.516 . . . . 0.0 109.31 179.802 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -67.26 -28.5 68.09 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.591 -0.946 . . . . 0.0 110.698 179.723 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 85.3 m -65.26 -27.8 68.9 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.344 -0.848 . . . . 0.0 110.131 179.775 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.59 -47.27 19.83 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.44 -0.788 . . . . 0.0 109.948 179.76 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -82.57 -12.37 57.77 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.602 -0.686 . . . . 0.0 111.578 -179.603 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.85 -60.5 2.35 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.985 -1.072 . . . . 0.0 109.641 179.55 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 52.7 mt -50.96 -25.17 4.32 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.428 -0.795 . . . . 0.0 111.07 -179.873 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.47 -40.43 91.18 Favored Glycine 0 N--CA 1.493 2.435 0 N-CA-C 109.173 -1.571 . . . . 0.0 109.173 179.553 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -54.98 -37.34 66.41 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.507 -0.996 . . . . 0.0 110.676 -179.875 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 10.9 mmt -70.4 -53.09 17.94 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.531 -0.73 . . . . 0.0 109.988 179.872 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 63.9 t-105 -49.47 -54.58 16.95 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.475 -0.765 . . . . 0.0 111.115 -179.677 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 26.6 t -57.44 -36.56 71.54 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.376 -0.828 . . . . 0.0 110.304 179.993 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -63.82 -41.41 97.86 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.544 -0.722 . . . . 0.0 109.743 179.69 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -60.14 156.76 14.45 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.583 -0.698 . . . . 0.0 110.268 179.814 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.0 m -100.52 -151.93 0.41 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.681 -0.637 . . . . 0.0 109.395 179.485 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.42 51.15 2.15 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.329 -0.857 . . . . 0.0 109.993 179.613 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 42.1 mtmt -130.46 -49.92 1.08 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.431 -0.793 . . . . 0.0 110.523 -179.84 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -70.83 -16.37 62.72 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.553 -0.717 . . . . 0.0 111.481 -179.102 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 32.2 pttt -107.07 -37.31 6.34 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.152 -0.967 . . . . 0.0 111.116 -179.592 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.403 ' CB ' ' CD ' ' A' ' 57' ' ' PRO . 5.9 mm100 -42.87 -56.52 6.02 Favored Pre-proline 0 N--CA 1.508 2.444 0 O-C-N 121.402 -0.811 . . . . 0.0 112.438 -178.847 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.403 ' CD ' ' CB ' ' A' ' 56' ' ' GLN . 48.6 Cg_endo -72.52 -34.15 7.74 Favored 'Trans proline' 0 C--N 1.316 -1.172 0 O-C-N 123.061 1.032 . . . . 0.0 109.891 179.624 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -75.66 -8.16 56.11 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.647 -0.658 . . . . 0.0 110.667 179.818 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -77.49 -58.39 3.3 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.18 -0.95 . . . . 0.0 109.96 179.776 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -47.75 -28.2 2.38 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.697 -0.627 . . . . 0.0 111.535 -179.413 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 70.1 tttt -60.35 -50.35 73.97 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.319 -0.863 . . . . 0.0 109.886 179.648 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.64 -8.25 54.35 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.654 -0.654 . . . . 0.0 110.575 179.426 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.58 0.3 52.93 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.175 -0.953 . . . . 0.0 110.215 178.895 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 48.8 mmtt -105.28 -29.34 10.36 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.105 -0.997 . . . . 0.0 109.695 179.398 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.5 mp -88.47 -9.72 51.53 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.78 -0.575 . . . . 0.0 110.157 178.758 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.3 tptm -81.53 -31.17 32.88 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.3 -0.875 . . . . 0.0 109.204 179.154 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -67.89 -61.34 1.92 Allowed 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 120.114 -0.634 . . . . 0.0 109.359 179.411 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.9 mtpp -57.59 -23.9 53.35 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.573 -0.705 . . . . 0.0 110.72 179.887 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.421 ' CD2' ' HB2' ' A' ' 9' ' ' PRO . 23.9 t80 -74.22 -60.28 2.34 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.263 -0.898 . . . . 0.0 109.857 179.662 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -80.2 -17.81 51.32 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.698 -0.627 . . . . 0.0 112.046 -178.723 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.0 ttmm -98.93 -23.76 15.2 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.102 -0.999 . . . . 0.0 112.052 -178.621 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -102.25 -31.98 10.28 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.151 -0.968 . . . . 0.0 111.457 -179.149 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.9 tp -55.55 -33.86 33.77 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.13 0 O-C-N 121.242 -0.911 . . . . 0.0 110.666 -179.492 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.88 -55.34 34.18 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.476 -0.765 . . . . 0.0 109.148 179.275 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.3 -38.08 89.74 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 178.045 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.415 ' O ' ' N ' ' A' ' 78' ' ' ALA . 2.6 t80 -73.85 -150.2 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 178.43 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 66.91 -61.87 0.32 Allowed 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.307 -0.87 . . . . 0.0 109.807 179.476 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.415 ' N ' ' O ' ' A' ' 76' ' ' TYR . . . 59.41 47.75 10.78 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.856 -0.528 . . . . 0.0 110.136 -179.592 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 16.7 mttm . . . . . 0 N--CA 1.494 1.725 0 CA-C-O 118.052 -0.975 . . . . 0.0 110.115 179.998 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo . . . . . 0 N--CA 1.483 0.902 0 N-CA-C 110.568 -0.589 . . . . 0.0 110.568 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.8 mtpt -56.07 -171.57 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.662 -0.649 . . . . 0.0 110.711 -179.767 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.2 mtt85 -56.64 139.46 75.94 Favored Pre-proline 0 N--CA 1.498 1.933 0 O-C-N 121.412 -0.805 . . . . 0.0 110.456 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.422 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 50.0 Cg_endo -77.03 133.27 13.48 Favored 'Trans proline' 0 C--N 1.318 -1.039 0 O-C-N 123.382 1.201 . . . . 0.0 110.252 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.78 ' CG ' HD21 ' A' ' 18' ' ' LEU . 50.3 Cg_endo -82.42 -162.5 0.18 Allowed 'Trans proline' 0 C--N 1.319 -0.993 0 O-C-N 123.236 1.124 . . . . 0.0 109.903 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.539 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 31.0 t -165.82 63.52 0.11 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.445 -0.784 . . . . 0.0 110.458 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.539 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 67.63 -75.54 0.06 Allowed 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.21 -0.931 . . . . 0.0 109.958 -179.368 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -47.19 -50.48 20.71 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.424 -0.798 . . . . 0.0 111.386 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -59.18 -39.53 82.82 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.614 -0.679 . . . . 0.0 109.746 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.78 HD21 ' CG ' ' A' ' 13' ' ' PRO . 45.0 mt -65.94 -37.19 85.39 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.594 -0.691 . . . . 0.0 109.891 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.492 ' CE2' ' CZ ' ' A' ' 23' ' ' TYR . 28.0 t80 -77.37 -54.06 6.91 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.634 -0.666 . . . . 0.0 110.654 -179.517 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 14.6 t -56.91 -53.07 62.14 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.459 -0.776 . . . . 0.0 110.707 -179.618 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 82.7 p -57.77 -25.4 60.44 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.577 -0.702 . . . . 0.0 110.859 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -96.55 -26.44 15.26 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.378 -0.826 . . . . 0.0 111.143 -179.352 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.492 ' CZ ' ' CE2' ' A' ' 19' ' ' PHE . 6.2 m-85 -88.5 -34.66 17.35 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.322 -0.861 . . . . 0.0 110.96 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.521 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 25.5 mtt180 -48.18 -52.83 38.61 Favored Pre-proline 0 N--CA 1.498 1.947 0 O-C-N 121.338 -0.851 . . . . 0.0 112.12 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.564 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.3 Cg_endo -59.64 -27.62 85.4 Favored 'Trans proline' 0 N--CA 1.494 1.541 0 O-C-N 123.184 1.097 . . . . 0.0 110.233 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.9 tmtt? -69.76 -45.9 67.02 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.1 mm -57.77 -31.59 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.246 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.564 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 4.8 mmmm -71.26 -36.23 71.67 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 120.004 -0.678 . . . . 0.0 110.427 -177.283 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 39.7 t -63.09 -23.38 67.42 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.393 -0.817 . . . . 0.0 110.8 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -117.14 -18.87 9.9 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.447 -0.783 . . . . 0.0 111.122 -179.524 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.701 ' HB3' HD23 ' A' ' 34' ' ' LEU . 52.0 m80 -123.25 96.1 44.74 Favored Pre-proline 0 N--CA 1.496 1.85 0 O-C-N 121.374 -0.829 . . . . 0.0 109.676 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -74.87 -36.73 2.49 Favored 'Trans proline' 0 C--N 1.316 -1.171 0 O-C-N 123.461 1.242 . . . . 0.0 110.303 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.403 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -74.37 -16.89 79.73 Favored Glycine 0 N--CA 1.49 2.261 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.701 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -59.74 80.17 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.529 -0.983 . . . . 0.0 111.335 -179.354 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.403 ' N ' ' O ' ' A' ' 33' ' ' GLY . 75.8 p -74.57 173.0 11.01 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.311 -0.868 . . . . 0.0 109.521 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 40.4 mm -52.13 -30.39 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.173 0 O-C-N 121.322 -0.862 . . . . 0.0 110.399 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.22 -68.81 1.5 Allowed Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.338 -1.505 . . . . 0.0 109.338 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.428 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 0.4 OUTLIER -67.82 -28.59 67.7 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.686 -0.891 . . . . 0.0 110.655 179.745 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 78.4 m -66.45 -29.75 69.95 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.297 -0.877 . . . . 0.0 110.014 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.53 -46.09 34.21 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.592 -0.692 . . . . 0.0 109.87 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.86 -13.01 54.69 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.621 -0.674 . . . . 0.0 111.774 -179.446 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.428 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 3.7 tppt? -77.46 -59.58 2.72 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 120.986 -1.071 . . . . 0.0 109.825 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.508 HD22 ' HG3' ' A' ' 24' ' ' ARG . 1.2 mp -53.33 -28.88 30.88 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.419 -0.801 . . . . 0.0 110.578 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -71.24 -44.57 52.57 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.114 -1.595 . . . . 0.0 109.114 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -55.31 -33.63 63.47 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.605 -0.938 . . . . 0.0 110.532 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 65.5 mmm -76.81 -49.62 15.4 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.634 -0.666 . . . . 0.0 109.564 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 70.1 t-105 -50.37 -53.02 32.24 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.563 -0.711 . . . . 0.0 110.964 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.4 t -62.74 -34.6 77.55 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.46 -0.775 . . . . 0.0 110.129 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -63.9 -39.72 94.83 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.558 -0.714 . . . . 0.0 110.141 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -57.54 157.52 6.84 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.602 -0.686 . . . . 0.0 110.594 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 17.5 t -88.51 -148.91 0.17 Allowed 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -89.31 47.58 1.5 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.154 -0.967 . . . . 0.0 110.257 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 40.7 mttp -126.94 -42.51 1.74 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.464 -0.772 . . . . 0.0 110.095 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -54.9 -26.64 37.17 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.42 -0.8 . . . . 0.0 110.926 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 40.9 tttm -107.29 26.85 9.68 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.43 -0.794 . . . . 0.0 110.963 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.432 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 3.9 mm-40 -99.91 -55.24 0.16 Allowed Pre-proline 0 N--CA 1.497 1.897 0 O-C-N 121.338 -0.851 . . . . 0.0 110.966 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.432 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.1 Cg_endo -83.37 -37.2 0.18 Allowed 'Trans proline' 0 C--N 1.322 -0.851 0 O-C-N 122.935 0.966 . . . . 0.0 110.692 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -80.51 4.9 16.79 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.523 -0.735 . . . . 0.0 111.579 -179.215 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.07 -19.98 18.33 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.178 -0.951 . . . . 0.0 110.567 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -77.48 -24.63 50.11 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.46 -0.775 . . . . 0.0 110.267 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.431 ' HD3' HD13 ' A' ' 18' ' ' LEU . 35.1 tttt -60.76 -41.52 95.64 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.482 -0.761 . . . . 0.0 109.863 179.725 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.1 -10.41 59.74 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.564 -0.71 . . . . 0.0 110.939 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -98.01 4.3 49.34 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.246 -0.908 . . . . 0.0 110.83 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.66 -40.7 5.67 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.126 -0.984 . . . . 0.0 109.787 179.569 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.746 HD11 ' HD2' ' A' ' 13' ' ' PRO . 3.4 pp -78.88 -0.16 29.64 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.831 -0.543 . . . . 0.0 110.737 179.671 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.0 ttpt -92.55 -21.06 20.32 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.243 -0.911 . . . . 0.0 109.871 179.355 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -83.29 -12.42 56.7 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.46 -0.775 . . . . 0.0 110.196 178.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -105.31 -30.39 9.67 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.327 -0.858 . . . . 0.0 109.347 178.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.67 ' O ' HG22 ' A' ' 73' ' ' ILE . 4.4 t80 -74.8 -53.59 8.88 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.716 -0.615 . . . . 0.0 109.577 179.435 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -56.44 -19.43 15.08 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.614 -0.679 . . . . 0.0 111.405 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.8 mttt -105.95 -29.0 10.24 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.262 -0.899 . . . . 0.0 110.802 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -86.7 -39.57 15.9 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.466 -0.771 . . . . 0.0 111.099 -179.27 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.67 HG22 ' O ' ' A' ' 69' ' ' TYR . 6.6 tp . . . . . 0 N--CA 1.497 1.888 0 O-C-N 121.378 -0.826 . . . . 0.0 110.919 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.416 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 50.0 Cg_endo . . . . . 0 N--CA 1.485 1.004 0 N-CA-C 110.578 -0.585 . . . . 0.0 110.578 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.02 -168.25 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.494 -0.754 . . . . 0.0 110.016 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -60.15 137.21 91.32 Favored Pre-proline 0 N--CA 1.498 1.936 0 O-C-N 121.447 -0.783 . . . . 0.0 110.208 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -76.5 136.21 17.21 Favored 'Trans proline' 0 C--N 1.318 -1.063 0 O-C-N 123.36 1.19 . . . . 0.0 109.808 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.661 ' CB ' HD21 ' A' ' 18' ' ' LEU . 49.4 Cg_endo -79.94 -169.84 0.88 Allowed 'Trans proline' 0 C--N 1.317 -1.107 0 O-C-N 123.28 1.147 . . . . 0.0 110.213 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.495 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 1.0 OUTLIER -163.22 61.33 0.18 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.491 -0.756 . . . . 0.0 110.773 -179.787 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.495 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 65.77 -78.88 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.166 -0.959 . . . . 0.0 110.64 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -46.02 -52.26 12.15 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.237 -0.915 . . . . 0.0 111.729 -179.183 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -57.42 -33.75 68.22 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.499 -0.75 . . . . 0.0 110.131 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.661 HD21 ' CB ' ' A' ' 13' ' ' PRO . 47.8 mt -70.48 -38.3 74.37 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.613 -0.679 . . . . 0.0 110.204 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.497 ' CE2' ' CE1' ' A' ' 23' ' ' TYR . 52.7 t80 -77.21 -54.91 5.91 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.688 -0.632 . . . . 0.0 110.478 -179.537 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -56.81 -53.06 62.13 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.572 -0.705 . . . . 0.0 110.505 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.7 t -59.49 -17.99 36.23 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.578 -0.702 . . . . 0.0 111.131 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -107.89 -11.73 15.3 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.25 -0.906 . . . . 0.0 111.663 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.497 ' CE1' ' CE2' ' A' ' 19' ' ' PHE . 2.5 m-85 -100.35 -33.9 10.2 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.065 -1.022 . . . . 0.0 110.869 -179.421 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.523 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 27.7 mtt180 -47.8 -51.7 44.44 Favored Pre-proline 0 N--CA 1.498 1.943 0 O-C-N 121.31 -0.869 . . . . 0.0 112.3 -179.662 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.567 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.3 Cg_endo -60.43 -26.23 82.26 Favored 'Trans proline' 0 N--CA 1.494 1.539 0 O-C-N 123.252 1.133 . . . . 0.0 110.343 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.2 tmtt? -70.31 -45.38 66.35 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 178.112 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 47.8 mm -58.83 -28.79 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 CA-C-O 121.173 0.511 . . . . 0.0 110.309 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.567 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.7 mmmm -73.27 -33.65 65.36 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.593 -0.692 . . . . 0.0 110.547 -177.247 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 13.1 t -67.69 -23.53 65.31 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.397 -0.814 . . . . 0.0 110.636 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -116.09 -14.42 11.18 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.414 -0.804 . . . . 0.0 111.247 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.671 ' HB3' HD23 ' A' ' 34' ' ' LEU . 44.4 m80 -130.62 94.7 28.54 Favored Pre-proline 0 N--CA 1.496 1.834 0 O-C-N 121.301 -0.874 . . . . 0.0 109.376 179.377 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -74.95 -38.72 1.49 Allowed 'Trans proline' 0 C--N 1.315 -1.192 0 O-C-N 123.465 1.245 . . . . 0.0 110.401 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.416 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -71.99 -22.57 78.74 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 109.864 -1.294 . . . . 0.0 109.864 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.671 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -52.07 86.79 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.627 -0.925 . . . . 0.0 111.775 -179.312 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.416 ' N ' ' O ' ' A' ' 33' ' ' GLY . 17.2 m -76.27 172.06 13.5 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.513 -0.742 . . . . 0.0 109.653 179.545 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 44.9 mm -56.87 -27.49 26.45 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.975 0 O-C-N 121.407 -0.808 . . . . 0.0 110.095 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.32 -63.78 4.72 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.412 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 17.7 t70 -74.07 -32.35 63.24 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.574 -0.956 . . . . 0.0 110.61 179.796 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.44 ' OG1' HD12 ' A' ' 34' ' ' LEU . 89.8 m -66.34 -33.86 76.68 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.304 -0.872 . . . . 0.0 110.162 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.1 -31.65 68.06 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.629 -0.669 . . . . 0.0 109.956 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -102.2 -8.05 21.65 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.604 -0.685 . . . . 0.0 111.543 -179.603 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.1 OUTLIER -87.38 3.64 46.19 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.001 -1.062 . . . . 0.0 110.203 179.062 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.8 mt -102.21 -33.87 9.47 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.023 -1.048 . . . . 0.0 109.493 179.093 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -68.48 -31.0 73.3 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.427 -1.469 . . . . 0.0 109.427 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -56.93 -45.8 82.49 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.501 -0.999 . . . . 0.0 110.241 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 25.8 mtt -77.25 -49.6 14.71 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.642 -0.661 . . . . 0.0 109.646 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 73.3 t-105 -54.93 -22.14 14.02 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.613 -0.679 . . . . 0.0 110.879 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.0 p -88.87 -35.26 16.65 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.322 -0.861 . . . . 0.0 109.885 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.13 -34.98 77.39 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.629 -0.669 . . . . 0.0 109.821 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 87.3 mm-40 -63.08 157.6 21.77 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.59 -0.694 . . . . 0.0 109.809 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.2 m -147.33 103.65 3.58 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.514 -0.741 . . . . 0.0 110.339 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 52.95 51.95 14.84 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.472 -0.768 . . . . 0.0 110.994 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.6 tppt? -150.77 -69.77 0.18 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.498 -0.751 . . . . 0.0 109.939 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -64.39 -36.31 83.74 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.353 -0.842 . . . . 0.0 110.437 -179.65 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -93.28 19.44 8.16 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.436 -0.79 . . . . 0.0 111.358 -179.317 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.402 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 4.3 mt-30 -92.23 -52.13 0.28 Allowed Pre-proline 0 N--CA 1.496 1.831 0 O-C-N 121.398 -0.814 . . . . 0.0 110.415 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.402 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 55.8 Cg_endo -83.23 -28.53 1.47 Allowed 'Trans proline' 0 C--N 1.319 -0.975 0 O-C-N 123.074 1.039 . . . . 0.0 110.275 179.775 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -84.28 1.83 42.98 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.543 -0.723 . . . . 0.0 111.649 -179.051 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.07 -24.65 16.23 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.082 -1.012 . . . . 0.0 110.704 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -75.87 -21.42 57.21 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.413 -0.804 . . . . 0.0 110.217 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 20.0 tttp -59.93 -44.66 94.22 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.46 -0.775 . . . . 0.0 109.932 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.68 -10.41 59.33 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.532 -0.73 . . . . 0.0 110.511 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.09 5.38 37.97 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.235 -0.916 . . . . 0.0 110.383 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 19.9 mmmt -105.48 -33.13 8.23 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.246 -0.909 . . . . 0.0 109.334 179.139 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.7 mp -80.03 2.87 22.11 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.881 -0.512 . . . . 0.0 111.052 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -95.92 -26.0 15.76 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.081 -1.012 . . . . 0.0 110.009 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -84.88 -15.13 45.68 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.545 -0.722 . . . . 0.0 110.588 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -103.19 -28.83 11.68 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.38 -0.825 . . . . 0.0 109.715 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.453 ' O ' HG22 ' A' ' 73' ' ' ILE . 20.6 t80 -74.61 -53.47 9.3 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.752 -0.593 . . . . 0.0 109.868 179.653 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -68.78 -9.63 51.99 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.737 -0.602 . . . . 0.0 111.587 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 38.5 mttm -104.29 -31.81 9.39 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.143 -0.973 . . . . 0.0 110.779 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -93.99 -28.68 15.64 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.494 -0.754 . . . . 0.0 111.136 -179.369 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.453 HG22 ' O ' ' A' ' 69' ' ' TYR . 3.5 tp . . . . . 0 N--CA 1.497 1.877 0 O-C-N 121.426 -0.796 . . . . 0.0 110.917 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo . . . . . 0 N--CA 1.483 0.857 0 N-CA-C 110.412 -0.649 . . . . 0.0 110.412 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.3 pttt -59.93 -163.65 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.615 -0.678 . . . . 0.0 110.363 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -64.3 141.05 98.09 Favored Pre-proline 0 N--CA 1.496 1.837 0 O-C-N 121.543 -0.723 . . . . 0.0 110.236 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -75.66 132.11 14.24 Favored 'Trans proline' 0 C--N 1.318 -1.063 0 O-C-N 123.26 1.137 . . . . 0.0 109.852 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.691 ' CB ' HD21 ' A' ' 18' ' ' LEU . 49.2 Cg_endo -81.23 -171.2 1.17 Allowed 'Trans proline' 0 C--N 1.317 -1.116 0 O-C-N 123.237 1.125 . . . . 0.0 110.352 -179.611 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.498 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 32.1 t -166.32 63.02 0.1 Allowed 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.524 -0.735 . . . . 0.0 110.582 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 65.75 -79.0 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.173 -0.954 . . . . 0.0 110.329 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.5 ' CE2' ' CD1' ' A' ' 47' ' ' TRP . 2.8 t80 -47.56 -49.07 27.39 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.217 -0.927 . . . . 0.0 111.403 -179.421 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -58.01 -30.25 65.95 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.658 -0.651 . . . . 0.0 110.074 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.691 HD21 ' CB ' ' A' ' 13' ' ' PRO . 36.0 mt -79.04 -31.76 44.7 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.48 -0.763 . . . . 0.0 110.489 -179.607 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.5 ' CE1' ' CZ ' ' A' ' 23' ' ' TYR . 59.4 t80 -79.2 -55.04 5.39 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.518 -0.739 . . . . 0.0 110.669 -179.349 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.438 ' SG ' HD13 ' A' ' 43' ' ' LEU . 5.7 t -56.7 -54.63 43.98 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.406 -0.809 . . . . 0.0 110.581 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 84.2 p -55.88 -21.52 20.54 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.444 -0.785 . . . . 0.0 110.967 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.5 mm-40 -101.23 -24.87 14.17 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.398 -0.814 . . . . 0.0 110.828 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.5 ' CZ ' ' CE1' ' A' ' 19' ' ' PHE . 8.0 m-85 -95.58 11.83 31.79 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.43 -0.794 . . . . 0.0 111.456 -179.293 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.524 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 4.5 mtt180 -87.1 -45.13 0.53 Allowed Pre-proline 0 N--CA 1.488 1.454 0 O-C-N 121.173 -0.955 . . . . 0.0 112.263 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.598 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.0 Cg_endo -66.76 -16.93 51.67 Favored 'Trans proline' 0 N--CA 1.49 1.275 0 O-C-N 122.899 0.947 . . . . 0.0 110.449 -179.203 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.8 tmtt? -71.69 -48.74 45.37 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 178.116 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 26.9 mm -56.67 -33.38 40.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 CA-C-O 121.376 0.608 . . . . 0.0 110.315 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.598 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 4.6 mmmm -72.1 -38.42 69.35 Favored 'General case' 0 N--CA 1.497 1.92 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.337 -177.072 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.7 t -57.81 -26.29 61.77 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.401 -0.812 . . . . 0.0 110.693 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -114.92 -22.68 9.48 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.53 -0.731 . . . . 0.0 110.721 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.741 ' HB3' HD23 ' A' ' 34' ' ' LEU . 36.5 m80 -122.1 95.7 47.17 Favored Pre-proline 0 N--CA 1.496 1.86 0 O-C-N 121.393 -0.817 . . . . 0.0 109.649 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -75.29 -36.2 2.51 Favored 'Trans proline' 0 C--N 1.316 -1.155 0 O-C-N 123.418 1.22 . . . . 0.0 110.346 -179.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.403 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -75.5 -17.87 80.02 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 110.203 -1.159 . . . . 0.0 110.203 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.741 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -55.79 86.99 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.253 0 O-C-N 121.563 -0.963 . . . . 0.0 111.191 -179.469 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.403 ' N ' ' O ' ' A' ' 33' ' ' GLY . 40.6 t -72.44 171.57 12.04 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.581 -0.7 . . . . 0.0 110.011 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.7 mm -55.84 -28.99 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.072 0 O-C-N 121.411 -0.806 . . . . 0.0 110.125 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.91 -64.15 4.45 Favored Glycine 0 N--CA 1.493 2.471 0 N-CA-C 109.178 -1.569 . . . . 0.0 109.178 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.593 ' HB3' HD13 ' A' ' 34' ' ' LEU . 13.7 t70 -72.19 -34.01 68.09 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.546 -0.973 . . . . 0.0 110.438 179.626 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 96.4 m -64.21 -33.15 75.15 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.338 -0.851 . . . . 0.0 110.151 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.01 -36.97 69.88 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.638 -0.664 . . . . 0.0 110.062 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -96.24 -9.56 30.09 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.581 -0.699 . . . . 0.0 111.888 -179.332 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -88.8 7.33 34.63 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 120.986 -1.072 . . . . 0.0 110.258 179.158 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.438 HD13 ' SG ' ' A' ' 20' ' ' CYS . 16.2 mt -105.6 -30.18 9.66 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.053 -1.029 . . . . 0.0 109.584 179.162 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.65 -28.83 73.53 Favored Glycine 0 N--CA 1.493 2.44 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -55.02 -44.16 74.33 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.437 -1.037 . . . . 0.0 110.556 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 34.5 mtm -82.31 -46.74 13.23 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.541 -0.725 . . . . 0.0 109.912 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' TRP . . . . . 0.5 ' CD1' ' CE2' ' A' ' 16' ' ' PHE . 74.6 t-105 -54.68 -22.03 12.53 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.628 -0.67 . . . . 0.0 111.06 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 11.1 t -97.5 -33.16 11.47 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.359 -0.838 . . . . 0.0 110.216 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -62.73 -36.35 82.73 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.566 -0.709 . . . . 0.0 110.032 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 13.4 mm-40 -58.9 156.98 10.5 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.521 -0.737 . . . . 0.0 110.504 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.8 t -86.6 -148.43 0.13 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.671 -0.643 . . . . 0.0 109.369 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.67 49.26 1.77 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.201 -0.937 . . . . 0.0 110.335 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 17.3 mtmm -126.64 -40.19 1.94 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.523 -0.735 . . . . 0.0 110.29 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -55.79 -32.66 63.7 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.366 -0.834 . . . . 0.0 110.845 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.5 tttm -103.24 26.28 8.5 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.41 -0.806 . . . . 0.0 110.931 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.441 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 3.9 mt-30 -99.0 -55.0 0.18 Allowed Pre-proline 0 N--CA 1.495 1.823 0 O-C-N 121.288 -0.882 . . . . 0.0 110.655 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.441 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.0 Cg_endo -83.94 -35.15 0.23 Allowed 'Trans proline' 0 C--N 1.321 -0.912 0 O-C-N 122.918 0.957 . . . . 0.0 110.779 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -81.54 4.33 21.72 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.411 -0.806 . . . . 0.0 111.446 -179.302 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.408 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -96.71 -23.0 16.65 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.976 -1.077 . . . . 0.0 110.731 -179.806 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -75.61 -22.65 56.69 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.458 -0.777 . . . . 0.0 110.239 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 66.0 tttt -60.93 -41.67 96.64 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.426 -0.796 . . . . 0.0 109.93 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.78 -11.34 60.76 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.586 -0.696 . . . . 0.0 110.58 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.68 6.13 36.29 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.327 -0.858 . . . . 0.0 110.503 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 24.7 mmtp -106.12 -33.85 7.73 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.216 -0.928 . . . . 0.0 109.281 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.1 mp -79.42 0.64 28.5 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.881 -0.512 . . . . 0.0 111.004 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 31.7 tttm -91.53 -26.03 18.96 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.171 -0.956 . . . . 0.0 109.839 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -85.06 -14.44 47.24 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.5 -0.75 . . . . 0.0 110.656 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 20.4 mtpt -102.92 -29.92 11.13 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.327 -0.858 . . . . 0.0 109.854 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.447 ' O ' HG22 ' A' ' 73' ' ' ILE . 21.0 t80 -75.1 -53.24 9.22 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.631 -0.668 . . . . 0.0 109.684 179.495 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -69.28 -9.02 51.3 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.639 -0.663 . . . . 0.0 111.47 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 43.8 mttm -109.02 -33.71 6.82 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.085 -1.009 . . . . 0.0 110.697 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -87.02 -33.95 19.39 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.418 -0.801 . . . . 0.0 111.003 -179.42 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.447 HG22 ' O ' ' A' ' 69' ' ' TYR . 3.2 tp . . . . . 0 N--CA 1.496 1.873 0 O-C-N 121.433 -0.792 . . . . 0.0 110.909 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo . . . . . 0 N--CA 1.484 0.968 0 N-CA-C 110.406 -0.652 . . . . 0.0 110.406 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -103.86 33.28 3.49 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.513 -0.742 . . . . 0.0 110.399 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -169.63 100.75 0.47 Allowed Pre-proline 0 N--CA 1.495 1.797 0 O-C-N 121.795 -0.566 . . . . 0.0 110.584 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.42 ' HB3' ' CD2' ' A' ' 69' ' ' TYR . 46.6 Cg_endo -75.26 116.46 4.55 Favored 'Trans proline' 0 C--N 1.319 -1.018 0 O-C-N 123.305 1.161 . . . . 0.0 110.168 179.616 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.649 ' HB2' HD21 ' A' ' 18' ' ' LEU . 46.7 Cg_endo -81.5 163.82 19.06 Favored 'Trans proline' 0 C--N 1.317 -1.087 0 O-C-N 123.255 1.134 . . . . 0.0 110.38 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.504 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 24.7 t -164.98 62.44 0.13 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.582 -0.699 . . . . 0.0 110.518 -179.878 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.504 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 65.48 -78.1 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.167 -0.958 . . . . 0.0 110.048 -179.504 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -47.66 -50.11 25.62 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.347 -0.845 . . . . 0.0 111.435 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -58.42 -37.23 74.94 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.538 -0.726 . . . . 0.0 109.924 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.77 HD11 ' HB2' ' A' ' 62' ' ' ALA . 43.7 mt -67.95 -39.71 83.38 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.642 -0.661 . . . . 0.0 110.104 -179.76 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.497 ' CE2' ' CE1' ' A' ' 23' ' ' TYR . 37.9 t80 -72.69 -52.88 13.4 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.667 -0.645 . . . . 0.0 110.868 -179.324 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.57 ' SG ' HD13 ' A' ' 43' ' ' LEU . 23.3 t -57.57 -50.51 72.86 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.527 -0.733 . . . . 0.0 110.716 -179.638 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 94.4 p -60.19 -26.97 66.76 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.525 -0.734 . . . . 0.0 110.844 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -95.36 -23.84 17.0 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.407 -0.808 . . . . 0.0 111.372 -179.156 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.497 ' CE1' ' CE2' ' A' ' 19' ' ' PHE . 7.0 m-85 -91.53 -33.64 15.08 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.278 -0.889 . . . . 0.0 111.003 -179.308 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.523 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 17.9 mtt180 -48.5 -52.72 41.57 Favored Pre-proline 0 N--CA 1.498 1.938 0 O-C-N 121.313 -0.867 . . . . 0.0 112.138 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.573 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.2 Cg_endo -59.65 -28.36 87.18 Favored 'Trans proline' 0 N--CA 1.495 1.597 0 O-C-N 123.265 1.14 . . . . 0.0 110.134 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.67 -44.42 74.1 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 178.109 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.3 mm -59.63 -31.09 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.112 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.573 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.4 mmmm -72.78 -38.24 67.35 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 120.032 -0.667 . . . . 0.0 110.575 -177.043 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.9 t -57.7 -26.43 61.72 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.384 -0.822 . . . . 0.0 110.756 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -115.25 -22.85 9.21 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.519 -0.738 . . . . 0.0 110.822 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.702 ' HB3' HD23 ' A' ' 34' ' ' LEU . 33.7 m80 -122.18 95.57 47.16 Favored Pre-proline 0 N--CA 1.496 1.87 0 O-C-N 121.452 -0.78 . . . . 0.0 109.635 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -75.13 -40.49 0.85 Allowed 'Trans proline' 0 C--N 1.315 -1.193 0 O-C-N 123.464 1.244 . . . . 0.0 110.189 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.405 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -70.21 -19.33 75.69 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.702 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -56.63 85.3 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.527 -0.984 . . . . 0.0 111.11 -179.509 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.405 ' N ' ' O ' ' A' ' 33' ' ' GLY . 66.3 m -73.4 174.45 8.14 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.432 -0.792 . . . . 0.0 109.836 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 41.3 mm -54.57 -33.22 26.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 O-C-N 121.393 -0.817 . . . . 0.0 110.238 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.05 -64.89 3.93 Favored Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.445 ' HB3' HD13 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -69.1 -36.06 77.13 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.613 -0.934 . . . . 0.0 110.267 179.516 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.0 m -62.66 -30.7 71.57 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.356 -0.84 . . . . 0.0 110.209 179.459 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.22 -44.26 38.47 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.51 -0.743 . . . . 0.0 110.119 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.403 ' HG2' ' HA ' ' A' ' 38' ' ' ASP . 0.7 OUTLIER -86.65 -14.15 43.49 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.542 -0.724 . . . . 0.0 111.784 -179.158 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.3 OUTLIER -87.04 6.95 29.88 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.92 -1.113 . . . . 0.0 110.453 179.319 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.57 HD13 ' SG ' ' A' ' 20' ' ' CYS . 14.6 mt -103.89 -29.58 10.89 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.089 -1.007 . . . . 0.0 109.664 179.355 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -66.83 -29.41 74.63 Favored Glycine 0 N--CA 1.492 2.427 0 N-CA-C 109.449 -1.46 . . . . 0.0 109.449 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -52.4 -44.23 65.24 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.474 -1.015 . . . . 0.0 110.731 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 17.4 mtt -86.32 -42.12 13.98 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.631 -0.668 . . . . 0.0 109.873 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' TRP . . . . . 0.424 ' CH2' ' HG3' ' A' ' 55' ' ' LYS . 73.8 t-105 -55.21 -23.18 20.81 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.577 -0.702 . . . . 0.0 110.894 -179.713 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 38.1 t -94.55 -32.89 13.26 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.44 -0.788 . . . . 0.0 110.006 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -62.69 -37.08 85.04 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.589 -0.694 . . . . 0.0 109.677 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -63.22 156.4 25.48 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.669 -0.645 . . . . 0.0 109.903 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.2 m -104.94 -152.3 0.46 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.733 -0.604 . . . . 0.0 109.382 179.635 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -84.61 54.19 2.94 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.389 -0.819 . . . . 0.0 109.92 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 52.5 mttm -130.04 -51.56 1.12 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.466 -0.771 . . . . 0.0 110.251 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -75.21 -23.46 57.62 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.478 -0.764 . . . . 0.0 111.347 -179.051 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.424 ' HG3' ' CH2' ' A' ' 47' ' ' TRP . 3.5 mppt? -89.89 -40.23 12.54 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.239 -0.913 . . . . 0.0 110.911 -179.396 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.401 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 7.7 mm100 -43.72 -56.71 6.8 Favored Pre-proline 0 N--CA 1.508 2.437 0 O-C-N 121.585 -0.697 . . . . 0.0 112.497 -178.842 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.401 ' HD2' ' N ' ' A' ' 56' ' ' GLN . 45.6 Cg_endo -70.47 -35.77 10.02 Favored 'Trans proline' 0 C--N 1.316 -1.164 0 O-C-N 122.993 0.996 . . . . 0.0 110.194 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -76.04 -9.86 58.96 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.608 -0.682 . . . . 0.0 110.786 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -76.5 -58.47 3.26 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.218 -0.926 . . . . 0.0 110.005 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -48.81 -27.95 3.36 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.6 -0.688 . . . . 0.0 111.491 -179.383 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 41.5 tttt -58.35 -53.33 59.55 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.395 -0.815 . . . . 0.0 109.984 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.77 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -73.52 -9.92 59.18 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.581 -0.7 . . . . 0.0 110.436 179.116 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.92 -0.16 47.19 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.355 -0.841 . . . . 0.0 110.081 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 20.2 mmtt -105.49 -28.12 11.0 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.136 -0.977 . . . . 0.0 109.733 179.264 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.6 mp -88.24 -10.39 49.86 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.837 -0.54 . . . . 0.0 110.18 178.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 5.3 tppt? -80.55 -32.75 36.6 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.388 -0.82 . . . . 0.0 109.202 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -67.94 -60.23 2.66 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 120.071 -0.652 . . . . 0.0 109.401 179.443 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.0 mmmt -57.37 -24.78 57.41 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.604 -0.685 . . . . 0.0 110.598 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.578 ' O ' HG22 ' A' ' 73' ' ' ILE . 12.8 t80 -73.27 -66.58 0.67 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.388 -0.82 . . . . 0.0 109.48 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -61.43 -16.23 44.8 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.848 -0.533 . . . . 0.0 111.38 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.8 ttmm -97.76 -24.19 15.57 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.176 -0.952 . . . . 0.0 111.231 -179.432 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -103.83 -30.1 10.58 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.398 -0.814 . . . . 0.0 110.862 -179.511 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.578 HG22 ' O ' ' A' ' 69' ' ' TYR . 7.7 tp . . . . . 0 N--CA 1.496 1.839 0 O-C-N 121.368 -0.832 . . . . 0.0 110.313 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo . . . . . 0 N--CA 1.484 0.956 0 N-CA-C 110.419 -0.647 . . . . 0.0 110.419 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.97 -170.0 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.531 -0.731 . . . . 0.0 110.67 -179.731 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.72 145.61 98.15 Favored Pre-proline 0 N--CA 1.497 1.884 0 O-C-N 121.498 -0.751 . . . . 0.0 110.437 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -76.28 129.65 11.39 Favored 'Trans proline' 0 C--N 1.318 -1.027 0 O-C-N 123.393 1.207 . . . . 0.0 109.883 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.692 ' CB ' HD21 ' A' ' 18' ' ' LEU . 50.4 Cg_endo -81.8 -173.65 1.86 Allowed 'Trans proline' 0 C--N 1.317 -1.113 0 O-C-N 123.264 1.139 . . . . 0.0 110.428 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.523 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 60.6 p -161.7 59.64 0.26 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.567 -0.708 . . . . 0.0 110.516 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.523 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 66.82 -76.88 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.083 -1.011 . . . . 0.0 110.169 -179.568 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.428 ' CE2' ' CD1' ' A' ' 47' ' ' TRP . 5.5 t80 -47.74 -49.88 26.97 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.298 -0.876 . . . . 0.0 111.348 -179.613 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -57.99 -35.98 71.98 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.643 -0.661 . . . . 0.0 109.982 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.692 HD21 ' CB ' ' A' ' 13' ' ' PRO . 41.6 mt -70.9 -36.85 72.9 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.532 -0.73 . . . . 0.0 110.265 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.503 ' CZ ' ' CE2' ' A' ' 23' ' ' TYR . 50.8 t80 -76.15 -54.23 7.12 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.563 -0.71 . . . . 0.0 110.497 -179.412 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.46 ' SG ' HD13 ' A' ' 43' ' ' LEU . 48.8 t -58.03 -51.78 68.25 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.565 -0.709 . . . . 0.0 110.616 -179.63 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 72.2 p -57.84 -22.95 50.46 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.536 -0.728 . . . . 0.0 111.036 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.4 mm-40 -102.6 -24.98 13.73 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.354 -0.841 . . . . 0.0 111.446 -179.22 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.503 ' CE2' ' CZ ' ' A' ' 19' ' ' PHE . 10.4 m-85 -93.09 12.61 23.59 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.308 -0.87 . . . . 0.0 111.595 -179.323 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.532 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 3.6 mtp180 -85.76 -45.33 0.61 Allowed Pre-proline 0 N--CA 1.489 1.478 0 O-C-N 121.145 -0.972 . . . . 0.0 112.03 179.302 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.589 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 37.7 Cg_endo -65.83 -15.41 48.94 Favored 'Trans proline' 0 N--CA 1.49 1.318 0 O-C-N 122.883 0.938 . . . . 0.0 110.483 -179.13 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.5 tmtm? -73.4 -51.64 16.6 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 177.766 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 37.5 mm -52.61 -33.71 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 CA-C-O 121.465 0.65 . . . . 0.0 110.317 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.589 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.7 mmmm -72.18 -37.49 69.3 Favored 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.279 -177.243 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.9 t -59.13 -25.48 63.89 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.466 -0.771 . . . . 0.0 110.753 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -116.8 -23.37 8.13 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.421 -0.8 . . . . 0.0 110.873 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.727 ' HB3' HD23 ' A' ' 34' ' ' LEU . 37.4 m80 -120.65 96.33 48.87 Favored Pre-proline 0 N--CA 1.496 1.87 0 O-C-N 121.403 -0.81 . . . . 0.0 109.574 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -75.32 -32.66 4.86 Favored 'Trans proline' 0 C--N 1.316 -1.16 0 O-C-N 123.465 1.245 . . . . 0.0 110.464 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -80.45 -13.44 81.7 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.727 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -60.83 83.19 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.381 -1.07 . . . . 0.0 110.987 -179.5 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 78.2 p -74.72 170.64 15.44 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.541 -0.724 . . . . 0.0 109.78 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.2 mm -52.6 -27.7 11.79 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.155 0 O-C-N 121.218 -0.926 . . . . 0.0 110.369 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -61.56 -71.67 0.77 Allowed Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.118 -1.593 . . . . 0.0 109.118 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.426 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 7.1 t70 -67.33 -25.01 65.8 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.642 -0.917 . . . . 0.0 110.623 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 64.5 m -71.64 -46.98 57.37 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.549 -0.719 . . . . 0.0 109.962 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -52.55 -41.79 63.85 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.545 -0.722 . . . . 0.0 110.069 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -86.03 -10.15 55.52 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.72 -0.613 . . . . 0.0 111.231 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.426 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -74.21 -59.48 2.71 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.004 -1.06 . . . . 0.0 109.449 179.236 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.46 HD13 ' SG ' ' A' ' 20' ' ' CYS . 14.5 mt -53.51 -27.74 27.31 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.806 -0.559 . . . . 0.0 110.899 -179.767 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -60.34 -45.44 96.15 Favored Glycine 0 N--CA 1.496 2.669 0 N-CA-C 109.614 -1.394 . . . . 0.0 109.614 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -62.32 -48.89 77.84 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.567 -0.96 . . . . 0.0 109.878 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 17.5 mmt -60.13 -24.5 64.75 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.588 -0.695 . . . . 0.0 110.551 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' TRP . . . . . 0.428 ' CD1' ' CE2' ' A' ' 16' ' ' PHE . 72.4 t-105 -79.71 -48.93 12.84 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.537 -0.727 . . . . 0.0 109.473 179.539 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.1 t -67.66 -26.96 66.46 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.64 -0.663 . . . . 0.0 110.007 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -68.22 -44.72 75.13 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.557 -0.714 . . . . 0.0 109.596 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 19.7 mm-40 -57.17 153.3 12.06 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.618 -0.676 . . . . 0.0 110.372 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.4 t -98.34 -152.47 0.4 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.649 -0.657 . . . . 0.0 109.533 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -88.01 49.55 1.82 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.38 -0.825 . . . . 0.0 110.082 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -127.48 -49.14 1.41 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.512 -0.743 . . . . 0.0 110.289 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -67.2 -27.4 67.23 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.461 -0.774 . . . . 0.0 110.74 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.3 tttt -81.43 -36.53 29.34 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.414 -0.804 . . . . 0.0 110.713 -179.648 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -43.83 -52.95 13.73 Favored Pre-proline 0 N--CA 1.507 2.386 0 O-C-N 121.507 -0.745 . . . . 0.0 112.324 -178.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -78.53 -37.19 0.73 Allowed 'Trans proline' 0 C--N 1.315 -1.206 0 O-C-N 123.172 1.09 . . . . 0.0 111.073 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.59 1.42 46.1 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.433 -0.792 . . . . 0.0 112.102 -178.362 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.469 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -97.69 -23.86 15.76 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.023 -1.048 . . . . 0.0 110.601 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -77.85 -22.56 49.72 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.442 -0.786 . . . . 0.0 110.29 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 65.4 tttt -61.32 -43.14 99.37 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.411 -0.806 . . . . 0.0 109.944 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -74.2 -10.84 60.01 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.619 -0.676 . . . . 0.0 110.658 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -86.08 3.06 44.17 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.299 -0.875 . . . . 0.0 110.451 179.11 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 36.7 mmtm -105.64 -31.61 8.84 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.181 -0.949 . . . . 0.0 109.741 179.381 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.5 mp -82.38 1.73 35.83 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.802 -0.561 . . . . 0.0 110.624 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 65.7 tttt -91.49 -28.46 17.59 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.205 -0.934 . . . . 0.0 109.629 179.454 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -87.07 -10.89 51.81 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.61 -0.681 . . . . 0.0 110.613 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 34.3 mmtt -103.73 -34.19 8.67 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.336 -0.853 . . . . 0.0 109.551 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.421 ' O ' HG22 ' A' ' 73' ' ' ILE . 24.8 t80 -73.78 -53.83 9.41 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.74 -0.6 . . . . 0.0 109.685 179.488 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -68.41 -12.31 60.96 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.7 -0.625 . . . . 0.0 111.219 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.83 -31.73 8.7 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.288 -0.882 . . . . 0.0 110.972 -179.471 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -91.22 -35.64 14.39 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.403 -0.811 . . . . 0.0 111.096 -179.263 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.421 HG22 ' O ' ' A' ' 69' ' ' TYR . 4.5 tp . . . . . 0 N--CA 1.5 2.064 0 O-C-N 121.308 -0.87 . . . . 0.0 110.95 -179.179 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo . . . . . 0 N--CA 1.485 0.995 0 N-CA-C 110.688 -0.543 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.61 -161.03 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.638 -0.663 . . . . 0.0 109.974 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.33 140.96 93.13 Favored Pre-proline 0 N--CA 1.497 1.921 0 O-C-N 121.236 -0.915 . . . . 0.0 110.099 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -75.24 135.52 18.75 Favored 'Trans proline' 0 C--N 1.318 -1.077 0 O-C-N 123.314 1.165 . . . . 0.0 109.767 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.543 ' CB ' HD21 ' A' ' 18' ' ' LEU . 49.8 Cg_endo -80.04 -177.32 3.73 Favored 'Trans proline' 0 C--N 1.317 -1.092 0 O-C-N 123.285 1.15 . . . . 0.0 110.262 -179.677 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.532 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 23.2 t -159.36 59.5 0.4 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.418 -0.801 . . . . 0.0 110.47 -179.668 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.532 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 67.6 -75.53 0.06 Allowed 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.196 -0.94 . . . . 0.0 110.172 -179.508 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -48.49 -48.73 37.82 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.333 -0.855 . . . . 0.0 111.271 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -59.66 -41.41 90.53 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.511 -0.743 . . . . 0.0 109.189 179.279 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.543 HD21 ' CB ' ' A' ' 13' ' ' PRO . 57.1 mt -62.05 -46.3 89.75 Favored 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.993 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -64.31 -50.37 68.09 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.603 -0.686 . . . . 0.0 110.006 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.596 ' SG ' HD13 ' A' ' 43' ' ' LEU . 6.6 t -68.64 -19.01 64.4 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.59 -0.693 . . . . 0.0 110.28 179.289 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.7 t -76.95 -17.69 58.74 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.286 -0.884 . . . . 0.0 111.725 -178.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -128.58 -14.45 4.65 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.02 -1.05 . . . . 0.0 112.776 -178.779 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.4 ' HB3' ' CD2' ' A' ' 43' ' ' LEU . 12.4 m-85 -87.92 13.85 10.06 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 120.944 -1.097 . . . . 0.0 111.671 -179.19 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.641 ' HG2' HD11 ' A' ' 43' ' ' LEU . 11.2 mtp180 -87.53 -45.97 0.5 Allowed Pre-proline 0 N--CA 1.49 1.556 0 O-C-N 121.162 -0.961 . . . . 0.0 112.386 179.746 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.578 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.1 Cg_endo -65.92 -15.97 50.9 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 O-C-N 122.981 0.99 . . . . 0.0 110.663 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.9 tmtt? -73.28 -52.34 14.31 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 177.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 42.1 mm -52.53 -30.98 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 CA-C-O 121.36 0.6 . . . . 0.0 110.439 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.578 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 6.2 mmmm -73.11 -36.78 66.82 Favored 'General case' 0 N--CA 1.498 1.945 0 C-N-CA 120.111 -0.636 . . . . 0.0 110.334 -177.246 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.2 t -58.7 -25.26 62.69 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.429 -0.795 . . . . 0.0 110.679 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -118.26 -22.84 7.52 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.515 -0.741 . . . . 0.0 110.949 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.72 ' HB3' HD23 ' A' ' 34' ' ' LEU . 34.4 m80 -121.11 96.54 48.34 Favored Pre-proline 0 N--CA 1.496 1.863 0 O-C-N 121.281 -0.887 . . . . 0.0 109.669 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -75.23 -35.58 2.91 Favored 'Trans proline' 0 C--N 1.315 -1.192 0 O-C-N 123.426 1.224 . . . . 0.0 110.513 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.78 -11.27 85.59 Favored Glycine 0 N--CA 1.492 2.409 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.72 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -64.44 80.91 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.209 -1.171 . . . . 0.0 110.55 -179.818 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.4 t -75.03 173.69 10.38 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.522 -0.737 . . . . 0.0 109.485 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 39.0 mm -51.08 -32.02 11.59 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.213 0 O-C-N 121.187 -0.946 . . . . 0.0 110.503 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.6 -74.4 0.37 Allowed Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.223 -1.551 . . . . 0.0 109.223 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.97 -23.24 67.33 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.657 -0.908 . . . . 0.0 110.85 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 38.9 m -72.24 -46.22 56.93 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.366 -0.834 . . . . 0.0 109.904 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -53.34 -49.48 67.01 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.416 -0.803 . . . . 0.0 110.073 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.97 -12.37 60.33 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.763 -0.586 . . . . 0.0 111.152 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.57 -57.93 3.66 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.154 -0.966 . . . . 0.0 109.631 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.641 HD11 ' HG2' ' A' ' 24' ' ' ARG . 22.2 mt -54.5 -34.6 61.94 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.725 -0.609 . . . . 0.0 111.064 -179.667 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -61.02 -49.68 75.86 Favored Glycine 0 N--CA 1.494 2.558 0 N-CA-C 109.974 -1.25 . . . . 0.0 109.974 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -53.69 -35.59 61.27 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.401 -1.058 . . . . 0.0 110.833 -179.719 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 20.2 mmt -69.1 -50.95 43.55 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.621 -0.674 . . . . 0.0 109.488 179.535 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 31.2 t-105 -51.37 -58.31 6.59 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.708 -0.62 . . . . 0.0 110.818 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 12.6 t -60.97 -34.57 74.97 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.517 -0.739 . . . . 0.0 110.382 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -58.48 -41.6 85.65 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.576 -0.702 . . . . 0.0 110.432 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 41.7 mm-40 -67.17 167.79 11.47 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.46 -0.775 . . . . 0.0 110.029 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.1 m -141.06 96.09 2.94 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.53 -0.731 . . . . 0.0 110.506 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 51.84 46.4 26.63 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.409 -0.807 . . . . 0.0 111.133 179.673 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 11.3 tmtt? -141.48 -63.03 0.46 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.538 -0.726 . . . . 0.0 110.254 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -61.89 -17.45 56.64 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.581 -0.699 . . . . 0.0 110.904 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 53.1 tttm -99.29 -32.38 11.22 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.238 -0.913 . . . . 0.0 110.765 -179.559 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.427 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 7.4 mt-30 -43.51 -56.72 6.54 Favored Pre-proline 0 N--CA 1.508 2.461 0 O-C-N 121.469 -0.769 . . . . 0.0 112.273 -178.788 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.427 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.4 Cg_endo -78.75 -35.14 1.11 Allowed 'Trans proline' 0 C--N 1.316 -1.18 0 O-C-N 123.059 1.031 . . . . 0.0 110.658 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -83.85 5.8 23.85 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.445 -0.784 . . . . 0.0 112.186 -178.331 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.528 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -101.35 -21.36 14.86 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 120.965 -1.084 . . . . 0.0 110.625 179.808 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -78.88 -23.55 44.77 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.422 -0.798 . . . . 0.0 110.277 179.489 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 48.3 tttm -62.91 -41.35 99.43 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.479 -0.763 . . . . 0.0 109.985 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.406 ' HB1' ' HA ' ' A' ' 14' ' ' SER . . . -71.12 -9.21 57.67 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.596 -0.69 . . . . 0.0 110.896 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -89.07 4.57 47.94 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.232 -0.917 . . . . 0.0 110.646 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -105.89 -32.61 8.27 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.128 -0.982 . . . . 0.0 109.611 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.9 mp -79.3 1.18 25.88 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.826 -0.546 . . . . 0.0 111.034 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 72.7 tttt -93.2 -23.37 18.57 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.161 -0.962 . . . . 0.0 109.957 179.42 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -85.24 -12.66 52.0 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.377 -0.827 . . . . 0.0 110.654 179.48 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -102.8 -31.24 10.4 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.327 -0.858 . . . . 0.0 109.52 179.474 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.487 ' O ' HG22 ' A' ' 73' ' ' ILE . 22.2 t80 -74.65 -55.08 6.27 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.799 -0.563 . . . . 0.0 109.671 179.532 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -66.3 -12.31 55.74 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.756 -0.59 . . . . 0.0 111.437 -179.433 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -103.68 -31.13 10.03 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.187 -0.945 . . . . 0.0 110.612 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -92.38 -31.12 15.45 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.445 -0.785 . . . . 0.0 110.955 -179.394 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.487 HG22 ' O ' ' A' ' 69' ' ' TYR . 2.6 tp . . . . . 0 N--CA 1.496 1.858 0 O-C-N 121.361 -0.837 . . . . 0.0 110.839 -179.437 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.415 ' O ' ' CD1' ' A' ' 69' ' ' TYR . 55.6 Cg_endo . . . . . 0 N--CA 1.488 1.174 0 N-CA-C 111.515 -0.225 . . . . 0.0 111.515 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.5 tptt -71.97 164.22 26.48 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.021 -1.05 . . . . 0.0 110.228 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 49.17 94.83 0.04 OUTLIER Pre-proline 0 N--CA 1.5 2.056 0 O-C-N 121.579 -0.701 . . . . 0.0 111.604 179.705 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -73.52 136.51 23.83 Favored 'Trans proline' 0 C--N 1.316 -1.176 0 O-C-N 123.431 1.227 . . . . 0.0 109.769 179.405 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.736 ' HB2' HD21 ' A' ' 18' ' ' LEU . 49.6 Cg_endo -79.96 167.89 19.63 Favored 'Trans proline' 0 C--N 1.316 -1.134 0 O-C-N 123.273 1.144 . . . . 0.0 110.362 -179.65 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.517 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 57.5 p -161.37 66.38 0.28 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.569 -0.707 . . . . 0.0 110.456 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 65.79 -77.5 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.166 -0.958 . . . . 0.0 110.015 -179.589 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -51.13 -42.63 60.86 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.246 -0.908 . . . . 0.0 110.924 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -63.99 -25.04 67.95 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.617 -0.677 . . . . 0.0 109.966 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.736 HD21 ' HB2' ' A' ' 13' ' ' PRO . 41.7 mt -84.6 -39.06 19.16 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.508 -0.745 . . . . 0.0 110.363 -179.581 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.501 ' CE2' ' CZ ' ' A' ' 23' ' ' TYR . 44.5 t80 -69.32 -50.44 46.52 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.578 -0.701 . . . . 0.0 110.464 -179.5 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 35.5 t -65.95 -33.46 75.86 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.541 -0.724 . . . . 0.0 110.083 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 29.4 t -82.16 1.17 37.51 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.513 -0.742 . . . . 0.0 111.599 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -133.96 1.9 3.33 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.975 -1.078 . . . . 0.0 111.881 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.501 ' CZ ' ' CE2' ' A' ' 19' ' ' PHE . 8.6 m-85 -110.88 -27.02 9.01 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 120.969 -1.082 . . . . 0.0 110.878 -179.646 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.523 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 18.5 mtp180 -49.14 -52.03 51.41 Favored Pre-proline 0 N--CA 1.497 1.916 0 O-C-N 121.326 -0.859 . . . . 0.0 112.252 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.571 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 35.7 Cg_endo -59.37 -29.11 89.34 Favored 'Trans proline' 0 N--CA 1.495 1.576 0 O-C-N 123.171 1.09 . . . . 0.0 110.28 -179.587 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.8 tmtm? -68.26 -43.75 77.13 Favored 'General case' 0 N--CA 1.493 1.675 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 178.148 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.1 mm -60.99 -30.27 47.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.177 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.571 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.1 mmmm -73.14 -38.2 66.35 Favored 'General case' 0 N--CA 1.497 1.881 0 C-N-CA 119.937 -0.705 . . . . 0.0 110.633 -177.113 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 13.8 t -56.94 -26.83 60.32 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.324 -0.86 . . . . 0.0 110.707 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -114.86 -24.65 8.56 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.567 -0.708 . . . . 0.0 110.738 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.712 ' HB3' HD23 ' A' ' 34' ' ' LEU . 30.5 m80 -120.63 95.69 48.96 Favored Pre-proline 0 N--CA 1.497 1.897 0 O-C-N 121.464 -0.773 . . . . 0.0 109.649 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -75.06 -41.49 0.64 Allowed 'Trans proline' 0 C--N 1.315 -1.193 0 O-C-N 123.409 1.215 . . . . 0.0 110.19 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.416 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -69.07 -19.93 74.31 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 110.077 -1.209 . . . . 0.0 110.077 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.712 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -56.42 84.98 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.528 -0.983 . . . . 0.0 111.175 -179.397 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.416 ' N ' ' O ' ' A' ' 33' ' ' GLY . 71.9 p -73.27 175.81 6.52 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.452 -0.78 . . . . 0.0 109.657 179.732 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 43.5 mm -56.31 -32.64 35.8 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 O-C-N 121.395 -0.816 . . . . 0.0 110.128 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.7 -65.18 3.67 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.26 -1.536 . . . . 0.0 109.26 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.406 ' HB3' HD13 ' A' ' 34' ' ' LEU . 0.7 OUTLIER -68.37 -36.55 79.36 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.56 -0.965 . . . . 0.0 110.299 179.573 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 93.8 m -63.29 -29.93 71.16 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.448 -0.782 . . . . 0.0 110.063 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.75 -44.89 39.44 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.559 -0.713 . . . . 0.0 109.795 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -86.71 -11.78 50.19 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.606 -0.684 . . . . 0.0 111.892 -179.22 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.404 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 11.5 tptt -87.83 6.75 33.81 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 120.813 -1.18 . . . . 0.0 110.495 179.292 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.9 mt -101.08 -27.76 13.08 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.193 -0.942 . . . . 0.0 109.515 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -68.96 -28.25 73.19 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.168 -1.573 . . . . 0.0 109.168 179.272 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -57.5 -54.9 41.62 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.445 -1.032 . . . . 0.0 109.875 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 33.6 mtt -68.48 -52.33 33.53 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 120.125 -0.63 . . . . 0.0 109.398 179.203 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' TRP . . . . . 0.438 ' CH2' ' HG2' ' A' ' 55' ' ' LYS . 54.6 t-105 -50.77 -58.02 6.96 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.49 -0.756 . . . . 0.0 110.936 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 26.6 t -59.19 -34.2 71.85 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.435 -0.791 . . . . 0.0 110.39 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -61.73 -40.88 96.64 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.596 -0.69 . . . . 0.0 109.973 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -60.0 155.52 16.63 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.635 -0.666 . . . . 0.0 110.307 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.6 m -106.49 -152.12 0.47 Allowed 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.01 58.72 3.01 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.332 -0.855 . . . . 0.0 109.953 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 8.8 tttp -139.93 -52.6 0.52 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.401 -0.812 . . . . 0.0 110.211 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -62.45 -25.56 68.04 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.511 -0.743 . . . . 0.0 110.586 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.438 ' HG2' ' CH2' ' A' ' 47' ' ' TRP . 14.7 mtpt -81.57 -34.47 31.02 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.404 -0.81 . . . . 0.0 110.607 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -44.64 -52.53 17.68 Favored Pre-proline 0 N--CA 1.507 2.387 0 O-C-N 121.572 -0.705 . . . . 0.0 111.986 -179.257 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -78.71 -38.22 0.53 Allowed 'Trans proline' 0 C--N 1.315 -1.227 0 O-C-N 123.263 1.138 . . . . 0.0 110.85 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.1 5.0 23.97 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.51 -0.744 . . . . 0.0 112.055 -178.548 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.44 -23.07 15.25 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.053 -1.029 . . . . 0.0 110.363 179.743 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -77.48 -26.22 51.11 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.474 -0.766 . . . . 0.0 110.214 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 72.8 tttt -59.57 -42.26 92.04 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.538 -0.726 . . . . 0.0 110.115 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.408 ' HB1' ' O ' ' A' ' 13' ' ' PRO . . . -69.48 -11.09 60.54 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.573 -0.705 . . . . 0.0 110.63 179.494 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.66 4.94 34.17 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.195 -0.941 . . . . 0.0 110.537 179.291 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 40.4 mmtt -105.82 -34.79 7.55 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.198 -0.939 . . . . 0.0 109.309 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.674 HD22 ' HG3' ' A' ' 13' ' ' PRO . 7.6 mp -82.36 -2.34 52.62 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.828 -0.545 . . . . 0.0 110.362 178.977 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 30.0 tptt -83.3 -33.94 25.83 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.27 -0.894 . . . . 0.0 109.112 179.166 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -67.7 -61.73 1.75 Allowed 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.168 179.209 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -58.87 -18.54 33.75 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.736 -0.602 . . . . 0.0 111.067 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.415 ' CD1' ' O ' ' A' ' 9' ' ' PRO . 9.5 t80 -78.49 -60.38 2.4 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.229 -0.919 . . . . 0.0 109.494 179.465 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -76.71 -1.04 25.89 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.599 -0.688 . . . . 0.0 111.561 -179.744 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.7 ttmt -113.0 -37.61 4.75 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.995 -1.066 . . . . 0.0 111.228 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -86.93 -31.19 20.82 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.417 -0.802 . . . . 0.0 111.284 -179.057 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.409 HG22 ' O ' ' A' ' 69' ' ' TYR . 3.0 tp . . . . . 0 N--CA 1.498 1.974 0 O-C-N 121.434 -0.791 . . . . 0.0 111.129 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.404 ' O ' ' CD1' ' A' ' 69' ' ' TYR . 49.2 Cg_endo . . . . . 0 N--CA 1.483 0.861 0 N-CA-C 110.268 -0.705 . . . . 0.0 110.268 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.1 pttp -99.66 30.59 3.56 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.479 -0.763 . . . . 0.0 110.853 -179.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.53 100.57 0.43 Allowed Pre-proline 0 N--CA 1.497 1.896 0 O-C-N 121.7 -0.625 . . . . 0.0 110.811 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -76.26 118.69 5.03 Favored 'Trans proline' 0 C--N 1.319 -1.02 0 O-C-N 123.263 1.138 . . . . 0.0 110.1 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.701 ' HB2' HD21 ' A' ' 18' ' ' LEU . 48.3 Cg_endo -81.93 166.41 16.95 Favored 'Trans proline' 0 C--N 1.318 -1.077 0 O-C-N 123.236 1.124 . . . . 0.0 110.446 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.535 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 32.4 t -156.69 54.78 0.54 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.466 -0.771 . . . . 0.0 110.582 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.535 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 67.99 -76.23 0.06 Allowed 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.256 -0.902 . . . . 0.0 109.965 -179.527 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -48.81 -49.91 36.84 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.357 -0.839 . . . . 0.0 111.378 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.03 -40.73 81.62 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.541 -0.724 . . . . 0.0 109.629 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.701 HD21 ' HB2' ' A' ' 13' ' ' PRO . 59.9 mt -60.52 -48.07 83.37 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.695 -0.628 . . . . 0.0 110.159 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.409 ' CZ ' ' CE1' ' A' ' 23' ' ' TYR . 60.6 t80 -66.88 -50.19 63.27 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.674 -0.641 . . . . 0.0 110.443 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.462 ' SG ' HD13 ' A' ' 43' ' ' LEU . 1.5 m -64.07 -31.93 73.3 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.507 -0.746 . . . . 0.0 109.966 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.0 m -65.48 -22.9 66.79 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.636 -0.665 . . . . 0.0 110.768 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -107.2 -25.71 11.4 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.405 -0.809 . . . . 0.0 111.55 -179.148 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.409 ' CE1' ' CZ ' ' A' ' 19' ' ' PHE . 0.6 OUTLIER -83.21 -34.75 25.83 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.13 -0.981 . . . . 0.0 110.928 -179.133 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.514 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 35.5 mtt180 -48.43 -53.18 37.25 Favored Pre-proline 0 N--CA 1.498 1.925 0 O-C-N 121.275 -0.89 . . . . 0.0 112.022 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.528 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.4 Cg_endo -59.93 -27.09 84.16 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 O-C-N 123.169 1.089 . . . . 0.0 110.182 179.855 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.4 tmtt? -69.55 -44.83 70.12 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.1 mm -59.08 -35.0 54.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 CA-C-O 121.084 0.468 . . . . 0.0 110.094 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.544 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 4.8 mmmm -70.15 -39.92 75.08 Favored 'General case' 0 N--CA 1.497 1.908 0 C-N-CA 120.09 -0.644 . . . . 0.0 110.43 -177.173 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.9 t -57.67 -25.64 60.54 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.348 -0.845 . . . . 0.0 110.891 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -114.0 -23.62 9.47 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.508 -0.745 . . . . 0.0 110.654 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.711 ' HB3' HD23 ' A' ' 34' ' ' LEU . 43.6 m80 -120.7 96.06 48.87 Favored Pre-proline 0 N--CA 1.495 1.784 0 O-C-N 121.414 -0.804 . . . . 0.0 109.482 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -74.96 -36.25 2.7 Favored 'Trans proline' 0 C--N 1.316 -1.161 0 O-C-N 123.462 1.243 . . . . 0.0 110.351 -179.602 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.4 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -75.3 -16.73 80.44 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 110.174 -1.17 . . . . 0.0 110.174 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.711 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -57.86 83.88 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.486 -1.008 . . . . 0.0 111.255 -179.323 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 33' ' ' GLY . 19.9 m -75.71 172.89 11.86 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.502 -0.749 . . . . 0.0 109.758 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.413 ' O ' ' HB2' ' A' ' 40' ' ' ALA . 42.5 mm -54.6 -28.36 19.17 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.113 0 O-C-N 121.34 -0.85 . . . . 0.0 110.228 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.18 -70.67 0.94 Allowed Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.146 -1.582 . . . . 0.0 109.146 179.705 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.408 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 10.7 t0 -67.49 -31.99 72.5 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.672 -0.899 . . . . 0.0 110.388 179.569 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.409 ' O ' HD12 ' A' ' 43' ' ' LEU . 78.2 m -65.78 -29.93 70.5 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.457 -0.777 . . . . 0.0 109.913 179.42 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.413 ' HB2' ' O ' ' A' ' 36' ' ' ILE . . . -73.16 -44.32 60.19 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.638 -0.664 . . . . 0.0 109.566 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -86.92 -13.39 44.89 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.646 -0.659 . . . . 0.0 111.78 -179.36 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 9.0 tptt -86.23 6.54 29.05 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 120.941 -1.1 . . . . 0.0 110.696 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.462 HD13 ' SG ' ' A' ' 20' ' ' CYS . 11.8 mt -102.1 -28.58 12.25 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.107 -0.996 . . . . 0.0 109.495 179.055 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -70.4 -29.7 69.8 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.092 -1.603 . . . . 0.0 109.092 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -55.41 -49.83 71.36 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.475 -1.014 . . . . 0.0 110.22 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 31.3 mmt -73.75 -49.72 24.13 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.663 -0.648 . . . . 0.0 109.643 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 62.2 t-105 -51.71 -59.27 4.49 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.479 -0.763 . . . . 0.0 110.847 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.0 t -61.52 -33.39 73.72 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.479 -0.763 . . . . 0.0 110.274 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -59.58 -39.74 85.11 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.54 -0.725 . . . . 0.0 110.284 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -63.48 162.37 12.76 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.579 -0.701 . . . . 0.0 110.297 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 81.1 p -96.18 -147.37 0.29 Allowed 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -85.72 51.85 2.31 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.152 -0.968 . . . . 0.0 110.095 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 9.8 tptp -125.23 -42.82 1.97 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.42 -0.8 . . . . 0.0 110.121 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -62.34 -37.07 84.23 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.563 -0.71 . . . . 0.0 110.728 -179.637 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 22.0 tttp -91.03 19.9 5.33 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.375 -0.828 . . . . 0.0 111.348 -179.284 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.463 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 0.7 OUTLIER -94.25 -57.21 0.22 Allowed Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.012 -1.055 . . . . 0.0 110.341 179.888 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.463 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 57.0 Cg_endo -83.28 -31.26 0.68 Allowed 'Trans proline' 0 N--CA 1.484 0.95 0 O-C-N 122.998 0.999 . . . . 0.0 110.577 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -82.33 2.02 34.2 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.49 -0.757 . . . . 0.0 112.004 -178.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.441 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -96.72 -21.92 17.29 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.035 -1.041 . . . . 0.0 110.736 -179.916 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -82.36 -24.64 34.39 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.425 -0.797 . . . . 0.0 110.201 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 71.0 tttt -62.89 -45.0 94.6 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.514 -0.741 . . . . 0.0 109.846 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.469 ' HB2' ' H ' ' A' ' 15' ' ' ALA . . . -74.27 -10.24 59.4 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.623 -0.673 . . . . 0.0 110.835 179.694 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.87 0.65 52.53 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.256 -0.902 . . . . 0.0 110.372 179.163 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.79 -30.43 9.41 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.225 -0.922 . . . . 0.0 109.92 179.494 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.469 ' N ' HD12 ' A' ' 65' ' ' LEU . 6.5 mp -83.22 -7.16 59.65 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.89 -0.506 . . . . 0.0 110.401 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.7 ttpt -81.34 -27.33 34.98 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.272 -0.892 . . . . 0.0 109.457 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -85.22 -6.29 59.28 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.674 -0.641 . . . . 0.0 110.363 179.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 36.6 mmtm -105.38 -35.24 7.57 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.367 -0.833 . . . . 0.0 108.888 178.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.703 ' O ' HG22 ' A' ' 73' ' ' ILE . 35.8 t80 -75.5 -57.2 4.03 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 179.392 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -57.69 -19.73 29.08 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.665 -0.647 . . . . 0.0 111.218 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 33.2 mmtm -102.75 -24.62 13.71 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.32 -0.863 . . . . 0.0 111.287 -179.225 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -98.79 -36.53 9.78 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.33 -0.856 . . . . 0.0 111.314 -179.102 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.703 HG22 ' O ' ' A' ' 69' ' ' TYR . 4.7 tp . . . . . 0 N--CA 1.495 1.795 0 O-C-N 121.304 -0.873 . . . . 0.0 110.616 -179.381 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo . . . . . 0 N--CA 1.485 1.001 0 N-CA-C 110.543 -0.599 . . . . 0.0 110.543 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.1 tptt -60.93 -157.39 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.651 -0.656 . . . . 0.0 110.143 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -49.47 140.22 13.94 Favored Pre-proline 0 N--CA 1.502 2.169 0 O-C-N 121.269 -0.895 . . . . 0.0 111.227 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.407 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.0 Cg_endo -76.83 128.69 10.23 Favored 'Trans proline' 0 C--N 1.318 -1.032 0 O-C-N 123.276 1.145 . . . . 0.0 110.263 -179.803 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.472 ' HB2' HD21 ' A' ' 18' ' ' LEU . 50.4 Cg_endo -82.18 179.46 5.51 Favored 'Trans proline' 0 C--N 1.319 -1.022 0 O-C-N 123.212 1.111 . . . . 0.0 110.23 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.537 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -163.17 65.3 0.18 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.554 -0.716 . . . . 0.0 110.257 -179.861 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.537 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 67.02 -76.63 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.185 0 O-C-N 121.183 -0.948 . . . . 0.0 109.938 -179.36 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.415 ' CD2' ' CD1' ' A' ' 47' ' ' TRP . 6.6 t80 -51.78 -43.22 62.93 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.249 -0.907 . . . . 0.0 111.022 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -63.77 -30.25 71.37 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.612 -0.68 . . . . 0.0 109.386 179.572 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.472 HD21 ' HB2' ' A' ' 13' ' ' PRO . 58.2 mt -75.28 -43.97 48.3 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.589 -0.695 . . . . 0.0 110.037 -179.815 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -65.56 -48.28 72.96 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.627 -0.671 . . . . 0.0 110.077 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 12.0 t -65.93 -29.5 69.93 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.564 -0.71 . . . . 0.0 109.771 179.564 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.5 t -90.52 7.12 40.6 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.578 -0.701 . . . . 0.0 111.653 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -138.79 0.75 2.03 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 120.973 -1.08 . . . . 0.0 112.11 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -123.58 22.08 9.2 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 120.872 -1.142 . . . . 0.0 110.905 -179.68 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.514 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 8.6 mtt180 -85.47 -45.98 0.63 Allowed Pre-proline 0 N--CA 1.488 1.439 0 O-C-N 121.447 -0.783 . . . . 0.0 112.064 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.561 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.3 Cg_endo -66.57 -15.44 47.67 Favored 'Trans proline' 0 N--CA 1.491 1.341 0 O-C-N 122.853 0.922 . . . . 0.0 110.613 -179.286 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? -73.39 -50.84 19.75 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 178.108 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 30.1 mm -54.51 -33.52 26.86 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.942 0 CA-C-O 121.298 0.57 . . . . 0.0 110.263 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.561 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.2 mmmm -71.27 -37.12 71.92 Favored 'General case' 0 N--CA 1.498 1.953 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.147 -177.26 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 24.8 t -58.6 -25.61 62.79 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.422 -0.799 . . . . 0.0 110.637 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -115.29 -24.22 8.55 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.55 -0.719 . . . . 0.0 110.618 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.783 ' HB3' HD23 ' A' ' 34' ' ' LEU . 41.2 m80 -119.63 96.56 49.72 Favored Pre-proline 0 N--CA 1.496 1.864 0 O-C-N 121.45 -0.781 . . . . 0.0 109.568 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -75.37 -28.42 8.6 Favored 'Trans proline' 0 C--N 1.315 -1.233 0 O-C-N 123.4 1.211 . . . . 0.0 110.502 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -84.44 -13.55 73.15 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.783 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -60.39 82.36 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.356 -1.085 . . . . 0.0 111.019 -179.441 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.1 t -69.74 170.19 11.43 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.487 -0.758 . . . . 0.0 109.977 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 38.6 mm -52.7 -30.08 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.262 -0.899 . . . . 0.0 110.264 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.0 -65.88 3.1 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.33 -1.508 . . . . 0.0 109.33 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.715 ' HB3' HD13 ' A' ' 34' ' ' LEU . 3.4 t70 -69.55 -30.49 68.3 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.617 -0.931 . . . . 0.0 110.591 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.2 m -63.76 -29.32 70.54 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.331 -0.856 . . . . 0.0 110.249 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.41 -44.8 27.9 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.576 -0.702 . . . . 0.0 110.169 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -86.02 -13.28 47.95 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.554 -0.716 . . . . 0.0 111.669 -179.398 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.9 tptt -76.88 -59.69 2.67 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.055 -1.028 . . . . 0.0 109.718 179.522 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 45.1 mt -48.67 -25.12 1.62 Allowed 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.474 -0.766 . . . . 0.0 111.458 -179.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -71.08 -36.98 64.14 Favored Glycine 0 N--CA 1.492 2.403 0 N-CA-C 109.051 -1.62 . . . . 0.0 109.051 179.337 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -53.86 -38.18 64.42 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.577 -0.955 . . . . 0.0 110.746 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 28.3 mtp -76.41 -49.69 16.09 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.599 -0.688 . . . . 0.0 109.861 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' TRP . . . . . 0.415 ' CD1' ' CD2' ' A' ' 16' ' ' PHE . 57.6 t-105 -49.99 -53.39 26.86 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.527 -0.733 . . . . 0.0 111.067 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.3 t -59.34 -36.14 75.14 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.447 -0.783 . . . . 0.0 110.459 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -62.29 -39.29 92.46 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.612 -0.68 . . . . 0.0 110.046 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -57.52 154.21 11.56 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.546 -0.721 . . . . 0.0 110.539 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.1 m -102.01 -151.55 0.42 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.694 -0.629 . . . . 0.0 109.457 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.06 52.48 2.53 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.306 -0.871 . . . . 0.0 110.124 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -132.54 -51.75 0.93 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.408 -0.808 . . . . 0.0 110.034 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -64.95 -25.0 67.69 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.687 -0.633 . . . . 0.0 110.47 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 37.7 tttp -81.09 -35.33 31.8 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.524 -0.735 . . . . 0.0 110.534 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -44.23 -52.75 15.57 Favored Pre-proline 0 N--CA 1.507 2.391 0 O-C-N 121.498 -0.751 . . . . 0.0 112.048 -179.208 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -78.41 -37.42 0.72 Allowed 'Trans proline' 0 C--N 1.315 -1.189 0 O-C-N 123.232 1.122 . . . . 0.0 111.045 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -84.85 4.67 32.11 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.344 -0.847 . . . . 0.0 112.146 -178.433 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -101.02 -24.15 14.38 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.002 -1.061 . . . . 0.0 110.552 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -75.28 -23.32 57.4 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.446 -0.784 . . . . 0.0 110.284 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 66.7 tttt -60.42 -41.66 94.39 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.561 -0.712 . . . . 0.0 110.145 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.41 -11.51 60.49 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.494 -0.754 . . . . 0.0 110.569 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -83.69 2.62 36.83 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.222 -0.923 . . . . 0.0 110.383 179.202 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 26.6 mmtm -105.33 -32.12 8.74 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.196 -0.94 . . . . 0.0 109.742 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.423 ' N ' HD12 ' A' ' 65' ' ' LEU . 6.2 mp -83.57 1.73 40.67 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.832 -0.543 . . . . 0.0 110.685 179.297 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 74.4 tttt -92.28 -32.02 15.18 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.232 -0.918 . . . . 0.0 109.508 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -83.53 -12.8 55.75 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.658 -0.651 . . . . 0.0 110.56 179.433 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -105.07 -28.19 11.18 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.318 -0.864 . . . . 0.0 109.464 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.53 ' O ' HG22 ' A' ' 73' ' ' ILE . 17.5 t80 -76.74 -54.54 6.5 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.775 -0.578 . . . . 0.0 109.6 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -64.04 -14.2 52.65 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.578 -0.702 . . . . 0.0 111.348 -179.481 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt -106.79 -29.96 9.21 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.26 -0.9 . . . . 0.0 111.125 -179.353 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -96.02 -34.34 11.8 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.289 -0.882 . . . . 0.0 111.555 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.53 HG22 ' O ' ' A' ' 69' ' ' TYR . 5.0 tp . . . . . 0 N--CA 1.497 1.897 0 O-C-N 121.187 -0.946 . . . . 0.0 110.731 -179.256 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.442 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 44.4 Cg_endo . . . . . 0 N--CA 1.484 0.947 0 N-CA-C 110.656 -0.555 . . . . 0.0 110.656 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.7 mtpt -67.14 -172.37 0.2 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.694 -0.628 . . . . 0.0 109.956 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.0 mtt85 -52.37 136.34 41.37 Favored Pre-proline 0 N--CA 1.5 2.071 0 O-C-N 121.309 -0.87 . . . . 0.0 110.665 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -74.51 128.85 12.23 Favored 'Trans proline' 0 C--N 1.319 -1.004 0 O-C-N 123.257 1.135 . . . . 0.0 110.262 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.682 ' CB ' HD21 ' A' ' 18' ' ' LEU . 48.5 Cg_endo -82.25 174.47 9.92 Favored 'Trans proline' 0 C--N 1.317 -1.094 0 O-C-N 123.25 1.132 . . . . 0.0 110.223 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.517 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 20.2 t -157.14 67.44 0.53 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.427 -0.796 . . . . 0.0 110.599 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 65.61 -76.44 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.107 -0.996 . . . . 0.0 110.531 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -48.48 -43.86 35.28 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.262 -0.899 . . . . 0.0 111.229 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -63.86 -26.77 68.76 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 120.126 -0.63 . . . . 0.0 109.949 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.682 HD21 ' CB ' ' A' ' 13' ' ' PRO . 20.7 mt -89.23 -28.35 20.01 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.377 -0.827 . . . . 0.0 110.379 -179.375 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.495 ' CZ ' ' CE2' ' A' ' 23' ' ' TYR . 36.9 t80 -76.92 -54.62 6.35 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.551 -0.718 . . . . 0.0 110.716 -179.267 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 10.7 t -63.04 -35.66 80.96 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.608 -0.682 . . . . 0.0 110.224 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 46.6 t -69.81 -19.73 63.47 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.564 -0.71 . . . . 0.0 111.063 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -111.6 -17.59 13.0 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.261 -0.899 . . . . 0.0 111.555 -179.128 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.576 ' HB3' HD22 ' A' ' 43' ' ' LEU . 6.2 m-85 -89.0 -32.24 17.71 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.274 -0.891 . . . . 0.0 110.91 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.528 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 5.3 mtp180 -49.11 -52.23 49.55 Favored Pre-proline 0 N--CA 1.497 1.91 0 O-C-N 121.307 -0.871 . . . . 0.0 111.811 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.532 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.2 Cg_endo -59.55 -28.08 86.55 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 O-C-N 123.133 1.07 . . . . 0.0 110.054 179.691 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.8 tmtt? -69.9 -46.44 65.44 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 108.107 -1.072 . . . . 0.0 108.107 177.727 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.601 ' CG1' HD21 ' A' ' 43' ' ' LEU . 41.7 mm -56.94 -34.64 44.9 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.051 179.75 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.555 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 3.4 mmmm -70.16 -38.85 75.54 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.629 -0.67 . . . . 0.0 110.543 -177.518 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.0 t -58.29 -25.67 62.09 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.482 -0.761 . . . . 0.0 110.941 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -115.86 -24.28 8.24 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.455 -0.778 . . . . 0.0 110.853 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.728 ' HB3' HD23 ' A' ' 34' ' ' LEU . 40.3 m80 -119.96 96.25 49.35 Favored Pre-proline 0 N--CA 1.495 1.802 0 O-C-N 121.522 -0.736 . . . . 0.0 109.456 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -75.21 -29.59 7.75 Favored 'Trans proline' 0 C--N 1.315 -1.203 0 O-C-N 123.434 1.228 . . . . 0.0 110.543 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.401 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -82.72 -15.96 71.8 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.728 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -58.52 82.54 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.501 -1.0 . . . . 0.0 111.28 -179.333 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.401 ' N ' ' O ' ' A' ' 33' ' ' GLY . 66.4 m -69.94 -179.15 1.77 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.39 -0.818 . . . . 0.0 109.66 179.672 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 43.8 mm -56.93 -37.76 56.06 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 O-C-N 121.378 -0.826 . . . . 0.0 110.141 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -57.75 -59.39 10.91 Favored Glycine 0 N--CA 1.494 2.506 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.669 ' CB ' HD13 ' A' ' 34' ' ' LEU . 45.2 m-20 -67.8 -41.01 83.8 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.613 -0.933 . . . . 0.0 109.998 179.135 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 96.3 m -59.77 -26.93 66.11 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.217 -0.927 . . . . 0.0 110.271 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -83.81 -49.18 9.31 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.545 -0.722 . . . . 0.0 110.416 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -81.2 -12.33 59.19 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.548 -0.72 . . . . 0.0 111.975 -179.068 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.471 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -83.94 -61.56 1.79 Allowed 'General case' 0 N--CA 1.5 2.04 0 O-C-N 120.998 -1.064 . . . . 0.0 109.704 179.542 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.601 HD21 ' CG1' ' A' ' 27' ' ' ILE . 61.8 mt -52.18 -24.51 7.25 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.457 -0.777 . . . . 0.0 111.182 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.1 -39.75 83.61 Favored Glycine 0 N--CA 1.493 2.434 0 N-CA-C 109.728 -1.349 . . . . 0.0 109.728 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -56.71 -33.85 66.88 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.467 -1.019 . . . . 0.0 110.584 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 9.6 mtt -75.82 -51.26 12.96 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.601 -0.687 . . . . 0.0 110.18 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -47.69 -38.97 16.19 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.593 -0.692 . . . . 0.0 111.602 -179.233 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.0 t -81.83 -27.13 33.76 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.33 -0.856 . . . . 0.0 110.341 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -63.61 -41.95 98.27 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.544 -0.722 . . . . 0.0 110.312 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.2 169.33 7.24 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.515 -0.74 . . . . 0.0 109.941 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.6 m -155.52 107.16 2.59 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.493 -0.754 . . . . 0.0 110.529 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 51.92 42.05 29.94 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.475 -0.765 . . . . 0.0 110.915 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.9 mttm -139.3 -76.37 0.35 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.548 -0.72 . . . . 0.0 110.348 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -61.98 -25.98 67.94 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.508 -0.745 . . . . 0.0 110.701 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.4 ttpm? -82.89 -33.71 26.88 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.427 -0.795 . . . . 0.0 110.603 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -44.52 -52.17 18.36 Favored Pre-proline 0 N--CA 1.506 2.35 0 O-C-N 121.526 -0.734 . . . . 0.0 111.907 -179.168 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.421 ' HA ' ' NE2' ' A' ' 60' ' ' GLN . 56.1 Cg_endo -79.83 -37.53 0.45 Allowed 'Trans proline' 0 C--N 1.315 -1.186 0 O-C-N 123.262 1.138 . . . . 0.0 110.804 179.596 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -84.62 8.76 15.71 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.571 -0.706 . . . . 0.0 112.034 -178.452 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.03 -24.28 13.23 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 120.955 -1.091 . . . . 0.0 110.19 179.511 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.421 ' NE2' ' HA ' ' A' ' 57' ' ' PRO . 12.1 pt20 -74.87 -26.6 59.79 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.494 -0.754 . . . . 0.0 110.137 179.618 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.416 ' CG ' HD13 ' A' ' 18' ' ' LEU . 42.1 tttt -57.21 -43.3 82.67 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.569 -0.707 . . . . 0.0 110.5 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.621 ' HB1' ' O ' ' A' ' 13' ' ' PRO . . . -73.63 -11.18 60.34 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.452 -0.78 . . . . 0.0 110.774 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.92 -3.52 57.1 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.249 -0.907 . . . . 0.0 110.515 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 64.8 mmtt -97.55 -33.16 11.46 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.254 -0.904 . . . . 0.0 109.655 179.662 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.9 mp -84.11 5.44 26.11 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.842 -0.536 . . . . 0.0 110.964 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -98.99 -32.79 11.11 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.333 -0.855 . . . . 0.0 109.331 179.426 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -63.27 -46.67 85.76 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 120.237 -0.585 . . . . 0.0 110.079 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 22.0 tptt -71.29 -63.84 1.03 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.469 -0.769 . . . . 0.0 109.6 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.442 ' CD2' ' HB2' ' A' ' 9' ' ' PRO . 24.4 t80 -36.06 -49.27 0.64 Allowed 'General case' 0 N--CA 1.509 2.486 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -179.296 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -67.16 -32.18 73.1 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.464 -0.773 . . . . 0.0 111.377 -179.245 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.7 ttmt -95.73 -23.79 16.81 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.323 -0.861 . . . . 0.0 111.703 -178.808 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -92.14 -24.9 18.95 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.291 -0.881 . . . . 0.0 111.334 -178.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.406 HG22 ' O ' ' A' ' 69' ' ' TYR . 4.5 tp . . . . . 0 N--CA 1.495 1.812 0 O-C-N 121.433 -0.792 . . . . 0.0 110.93 -179.527 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo . . . . . 0 N--CA 1.485 0.996 0 N-CA-C 110.229 -0.72 . . . . 0.0 110.229 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -128.82 31.43 4.94 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.553 -0.717 . . . . 0.0 110.514 -179.816 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.1 mtt85 -161.97 85.5 1.6 Allowed Pre-proline 0 N--CA 1.494 1.775 0 O-C-N 121.815 -0.553 . . . . 0.0 110.042 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.403 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.2 Cg_endo -82.24 118.14 2.92 Favored 'Trans proline' 0 C--N 1.317 -1.097 0 O-C-N 123.411 1.216 . . . . 0.0 110.339 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.729 ' HB2' HD21 ' A' ' 18' ' ' LEU . 46.9 Cg_endo -80.45 173.56 12.23 Favored 'Trans proline' 0 C--N 1.318 -1.04 0 O-C-N 123.278 1.146 . . . . 0.0 110.099 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.544 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 41.0 t -166.84 61.29 0.09 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.5 -0.75 . . . . 0.0 110.501 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.544 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 68.27 -77.47 0.05 OUTLIER 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.127 -0.983 . . . . 0.0 110.041 -179.341 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -50.66 -45.28 57.87 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.194 -0.941 . . . . 0.0 110.893 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -60.84 -29.7 69.66 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 120.201 -0.599 . . . . 0.0 109.801 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.729 HD21 ' HB2' ' A' ' 13' ' ' PRO . 35.4 mt -80.68 -36.54 32.2 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.542 -0.724 . . . . 0.0 110.219 -179.666 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.499 ' CE2' ' CE2' ' A' ' 23' ' ' TYR . 18.1 t80 -69.41 -52.3 28.25 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.592 -0.692 . . . . 0.0 110.35 -179.588 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 4.4 t -64.43 -29.81 70.85 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.521 -0.737 . . . . 0.0 109.909 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.3 m -70.01 -15.32 63.0 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.6 -0.688 . . . . 0.0 111.536 -179.301 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.2 -17.64 4.25 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.034 -1.041 . . . . 0.0 112.466 -179.02 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.499 ' CE2' ' CE2' ' A' ' 19' ' ' PHE . 12.9 m-85 -91.27 15.11 12.63 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 120.949 -1.094 . . . . 0.0 111.551 -179.378 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.507 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 17.4 mtt180 -91.92 -42.36 0.37 Allowed Pre-proline 0 N--CA 1.489 1.485 0 O-C-N 121.278 -0.889 . . . . 0.0 112.476 179.429 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.581 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.2 Cg_endo -68.08 -16.19 44.37 Favored 'Trans proline' 0 N--CA 1.49 1.298 0 O-C-N 122.759 0.873 . . . . 0.0 110.386 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -73.16 -51.78 16.59 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 177.694 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 40.3 mm -52.54 -29.07 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 CA-C-O 121.304 0.573 . . . . 0.0 110.495 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.581 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 6.4 mmmm -75.19 -32.68 61.28 Favored 'General case' 0 N--CA 1.496 1.845 0 C-N-CA 120.091 -0.643 . . . . 0.0 110.214 -177.359 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.9 t -62.59 -25.82 68.28 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.576 -0.702 . . . . 0.0 110.422 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -118.2 -19.39 9.02 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.539 -0.726 . . . . 0.0 111.14 -179.626 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.755 ' HB3' HD23 ' A' ' 34' ' ' LEU . 34.1 m80 -124.4 95.71 42.78 Favored Pre-proline 0 N--CA 1.498 1.97 0 O-C-N 121.294 -0.878 . . . . 0.0 109.706 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -75.57 -33.95 3.7 Favored 'Trans proline' 0 C--N 1.316 -1.163 0 O-C-N 123.472 1.249 . . . . 0.0 110.248 -179.872 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.411 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -77.03 -18.36 78.75 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.755 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -57.21 83.78 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.491 -1.005 . . . . 0.0 111.297 -179.287 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.411 ' N ' ' O ' ' A' ' 33' ' ' GLY . 63.9 m -75.14 171.01 14.9 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.487 -0.758 . . . . 0.0 109.848 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.0 mm -53.1 -27.57 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 121.343 -0.848 . . . . 0.0 110.303 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -61.22 -67.07 2.29 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.207 -1.557 . . . . 0.0 109.207 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.454 ' HB3' HD13 ' A' ' 34' ' ' LEU . 7.5 t70 -71.87 -28.55 63.61 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.529 -0.983 . . . . 0.0 110.679 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 86.8 m -65.89 -33.79 76.65 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.36 -0.838 . . . . 0.0 110.159 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.63 -39.35 67.28 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.56 -0.712 . . . . 0.0 110.276 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -91.51 -12.11 35.48 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.6 -0.687 . . . . 0.0 111.597 -179.577 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.404 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 14.0 tptt -77.61 -59.29 2.84 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.042 -1.036 . . . . 0.0 109.731 179.499 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 34.5 mt -47.28 -28.32 1.91 Allowed 'General case' 0 N--CA 1.504 2.242 0 O-C-N 121.554 -0.716 . . . . 0.0 111.416 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -64.28 -35.07 91.5 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.2 -1.56 . . . . 0.0 109.2 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -50.83 -36.08 35.66 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.535 -0.979 . . . . 0.0 111.037 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 34.0 mtt -86.62 -40.98 14.63 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.522 -0.736 . . . . 0.0 110.237 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' TRP . . . . . 0.442 ' CH2' ' HG2' ' A' ' 55' ' ' LYS . 73.1 t-105 -55.34 -22.52 19.55 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.551 -0.718 . . . . 0.0 111.028 -179.566 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 66.6 p -93.55 -33.3 13.8 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.286 -0.884 . . . . 0.0 110.166 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -63.42 -36.72 84.68 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.561 -0.712 . . . . 0.0 110.015 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -63.04 152.66 36.34 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.583 -0.698 . . . . 0.0 110.194 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 9.3 t -101.26 -152.61 0.43 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.685 -0.634 . . . . 0.0 109.423 179.654 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -83.51 55.44 3.2 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.397 -0.814 . . . . 0.0 110.023 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 39.6 mttt -132.24 -48.92 0.92 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.415 -0.803 . . . . 0.0 110.324 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -67.86 -28.1 67.25 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.532 -0.73 . . . . 0.0 110.774 -179.547 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.442 ' HG2' ' CH2' ' A' ' 47' ' ' TRP . 18.7 mtmt -79.79 -36.74 36.58 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.372 -0.83 . . . . 0.0 110.572 -179.639 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -44.22 -53.37 14.01 Favored Pre-proline 0 N--CA 1.507 2.385 0 O-C-N 121.505 -0.747 . . . . 0.0 112.33 -178.893 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -77.2 -37.33 1.07 Allowed 'Trans proline' 0 C--N 1.315 -1.226 0 O-C-N 123.129 1.068 . . . . 0.0 111.258 -179.561 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.48 -5.27 58.6 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.454 -0.779 . . . . 0.0 112.026 -178.462 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.96 -24.1 21.37 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.992 -1.068 . . . . 0.0 111.072 -179.328 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -78.47 -22.09 48.07 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.325 -0.859 . . . . 0.0 110.626 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 73.8 tttt -64.7 -42.35 95.35 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.365 -0.834 . . . . 0.0 109.803 179.719 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.551 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -80.86 -15.14 57.14 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.558 -0.714 . . . . 0.0 110.068 179.106 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.34 -35.38 75.52 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.379 -0.826 . . . . 0.0 110.029 179.738 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -72.62 -62.81 1.31 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.454 -0.779 . . . . 0.0 109.783 179.648 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.484 HD22 ' HG3' ' A' ' 13' ' ' PRO . 5.0 mp -51.22 -24.05 3.97 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.443 -0.786 . . . . 0.0 111.25 -179.736 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 10.9 tttt -70.36 -52.54 21.84 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.395 -0.816 . . . . 0.0 109.506 179.47 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -62.19 -50.33 72.25 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.609 -0.682 . . . . 0.0 109.543 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -58.45 -20.62 46.47 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.557 -0.715 . . . . 0.0 110.548 179.59 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.511 ' O ' HG22 ' A' ' 73' ' ' ILE . 23.4 t80 -86.82 -58.31 2.65 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.449 -0.782 . . . . 0.0 110.026 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -69.37 -32.67 71.86 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.629 -0.669 . . . . 0.0 111.868 -178.695 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.0 mmtm -85.47 -14.34 46.4 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.267 -0.895 . . . . 0.0 111.823 -178.793 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -107.31 -20.69 13.2 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.143 -0.973 . . . . 0.0 111.34 -179.288 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.511 HG22 ' O ' ' A' ' 69' ' ' TYR . 2.7 tp . . . . . 0 N--CA 1.497 1.883 0 O-C-N 121.3 -0.875 . . . . 0.0 110.825 -179.781 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo . . . . . 0 N--CA 1.484 0.938 0 N-CA-C 110.425 -0.644 . . . . 0.0 110.425 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.48 -166.91 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.586 -0.696 . . . . 0.0 109.917 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -60.94 146.19 87.82 Favored Pre-proline 0 N--CA 1.496 1.872 0 O-C-N 121.509 -0.744 . . . . 0.0 110.085 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.429 ' HD3' ' CZ ' ' A' ' 69' ' ' TYR . 47.0 Cg_endo -74.21 124.41 8.99 Favored 'Trans proline' 0 C--N 1.317 -1.13 0 O-C-N 123.299 1.157 . . . . 0.0 110.159 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.725 ' HB2' HD21 ' A' ' 18' ' ' LEU . 47.2 Cg_endo -81.43 -179.93 5.33 Favored 'Trans proline' 0 C--N 1.318 -1.055 0 O-C-N 123.286 1.15 . . . . 0.0 110.079 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.555 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 38.1 t -168.93 62.16 0.06 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.461 -0.775 . . . . 0.0 110.811 -179.766 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.644 ' HB2' ' HA ' ' A' ' 59' ' ' GLU . . . 69.6 -77.65 0.05 Allowed 'General case' 0 N--CA 1.503 2.203 0 O-C-N 120.945 -1.097 . . . . 0.0 110.533 -179.783 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.443 ' CE2' ' CD1' ' A' ' 47' ' ' TRP . 3.3 t80 -49.49 -46.93 48.83 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.12 -0.987 . . . . 0.0 111.114 -179.578 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -60.31 -28.29 68.0 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.551 -0.718 . . . . 0.0 110.281 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.725 HD21 ' HB2' ' A' ' 13' ' ' PRO . 23.7 mt -83.99 -35.63 23.77 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.352 -0.843 . . . . 0.0 110.532 -179.37 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.485 ' CE1' ' CE1' ' A' ' 23' ' ' TYR . 59.0 t80 -71.93 -52.68 16.01 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.531 -0.731 . . . . 0.0 110.718 -179.214 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.556 ' SG ' HD13 ' A' ' 43' ' ' LEU . 36.4 t -56.78 -55.16 37.88 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.395 -0.816 . . . . 0.0 110.658 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 9.2 t -55.35 -23.99 27.01 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.502 -0.749 . . . . 0.0 110.989 -179.717 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -98.97 -21.19 16.38 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.4 -0.812 . . . . 0.0 111.288 -179.494 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.485 ' CE1' ' CE1' ' A' ' 19' ' ' PHE . 5.6 m-85 -100.11 15.93 25.75 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.349 -0.845 . . . . 0.0 111.352 -179.364 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.506 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 0.5 OUTLIER -92.25 -42.92 0.36 Allowed Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.314 -0.867 . . . . 0.0 112.744 179.663 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.603 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.2 Cg_endo -67.36 -17.94 49.64 Favored 'Trans proline' 0 N--CA 1.491 1.344 0 O-C-N 122.798 0.893 . . . . 0.0 110.493 -178.837 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? -71.78 -49.34 39.72 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 178.014 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 26.4 mm -56.06 -30.13 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 CA-C-O 121.257 0.551 . . . . 0.0 110.628 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.603 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 6.0 mmmm -73.84 -34.98 64.75 Favored 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 120.058 -0.657 . . . . 0.0 110.259 -177.236 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.9 t -62.76 -24.19 67.58 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.472 -0.767 . . . . 0.0 110.647 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -118.33 -16.57 9.62 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.415 -0.803 . . . . 0.0 111.194 -179.536 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.707 ' HB3' HD23 ' A' ' 34' ' ' LEU . 41.6 m80 -127.33 95.24 36.5 Favored Pre-proline 0 N--CA 1.498 1.949 0 O-C-N 121.351 -0.843 . . . . 0.0 109.578 179.594 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -74.95 -35.91 2.91 Favored 'Trans proline' 0 C--N 1.315 -1.231 0 O-C-N 123.492 1.259 . . . . 0.0 110.342 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.408 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -74.9 -19.07 80.1 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 110.099 -1.2 . . . . 0.0 110.099 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.707 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -57.2 83.81 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.584 -0.951 . . . . 0.0 111.312 -179.374 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.408 ' N ' ' O ' ' A' ' 33' ' ' GLY . 46.7 t -72.71 175.99 5.95 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.422 -0.799 . . . . 0.0 109.542 179.701 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 43.0 mm -56.48 -29.82 29.81 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 O-C-N 121.362 -0.836 . . . . 0.0 110.122 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.31 -64.91 3.83 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.445 ' HB3' HD13 ' A' ' 34' ' ' LEU . 0.6 OUTLIER -71.65 -31.81 67.24 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.66 -0.906 . . . . 0.0 110.564 179.803 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.5 m -67.09 -32.2 73.19 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.387 -0.821 . . . . 0.0 109.901 179.479 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.09 -35.34 69.2 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.621 -0.674 . . . . 0.0 109.914 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -97.92 -12.68 21.79 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.602 -0.686 . . . . 0.0 111.764 -179.422 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.431 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 6.1 tptt -85.16 5.18 31.07 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.044 -1.035 . . . . 0.0 110.528 179.377 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.556 HD13 ' SG ' ' A' ' 20' ' ' CYS . 18.3 mt -101.8 -33.51 9.79 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.029 -1.044 . . . . 0.0 109.316 179.168 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -66.25 -30.31 76.52 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.391 -1.484 . . . . 0.0 109.391 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.53 -41.39 63.44 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.38 -1.071 . . . . 0.0 110.679 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 11.6 mmt -87.03 -42.78 12.82 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.59 -0.694 . . . . 0.0 109.999 179.676 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' TRP . . . . . 0.443 ' CD1' ' CE2' ' A' ' 16' ' ' PHE . 72.9 t-105 -55.74 -23.76 31.13 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.505 -0.747 . . . . 0.0 110.723 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.4 t -85.79 -35.68 20.56 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.366 -0.834 . . . . 0.0 109.997 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -63.45 -33.67 76.08 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.66 -0.65 . . . . 0.0 109.839 179.793 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 89.8 mm-40 -63.32 151.26 41.23 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.676 -0.64 . . . . 0.0 110.094 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 88.6 p -103.06 -153.02 0.46 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.733 -0.605 . . . . 0.0 109.578 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -82.7 56.4 3.36 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.342 -0.849 . . . . 0.0 110.05 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 15.3 tttt -133.74 -51.18 0.85 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.448 -0.783 . . . . 0.0 110.204 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -67.78 -26.19 65.98 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.542 -0.724 . . . . 0.0 110.616 -179.705 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.423 ' O ' ' N ' ' A' ' 59' ' ' GLU . 10.9 ttmt -82.7 -36.88 25.49 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.563 -0.711 . . . . 0.0 110.668 -179.797 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -43.42 -52.53 13.08 Favored Pre-proline 0 N--CA 1.508 2.466 0 O-C-N 121.455 -0.778 . . . . 0.0 112.47 -178.893 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -78.34 -37.45 0.74 Allowed 'Trans proline' 0 C--N 1.315 -1.218 0 O-C-N 123.129 1.068 . . . . 0.0 111.848 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -84.66 -10.38 57.37 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.345 -0.847 . . . . 0.0 112.409 -177.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.644 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -85.46 -26.9 26.05 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.064 -1.022 . . . . 0.0 110.933 -179.036 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -75.4 -18.26 59.98 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.435 -0.791 . . . . 0.0 110.947 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 59.2 tttt -65.02 -43.67 91.68 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.278 -0.888 . . . . 0.0 110.204 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.551 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -76.38 -12.84 60.12 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.494 -0.754 . . . . 0.0 110.328 179.393 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.96 -40.83 94.85 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.31 -0.869 . . . . 0.0 110.42 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -69.87 -62.39 1.4 Allowed 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.237 -0.914 . . . . 0.0 109.705 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.6 mp -46.29 -24.27 0.45 Allowed 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.606 -0.684 . . . . 0.0 112.142 -179.522 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.5 tptt -71.33 -45.39 63.07 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.295 -0.878 . . . . 0.0 109.517 179.023 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -66.1 -57.39 7.78 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.71 -0.619 . . . . 0.0 109.873 179.689 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 59.1 mttt -54.83 -25.47 28.65 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.56 -0.713 . . . . 0.0 110.71 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.603 ' O ' HG22 ' A' ' 73' ' ' ILE . 46.0 t80 -78.12 -66.19 0.88 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.517 -0.74 . . . . 0.0 109.611 179.514 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -58.58 -22.56 56.3 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.728 -0.608 . . . . 0.0 111.288 -179.267 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 39.2 mttt -93.79 -18.84 21.61 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.288 -0.883 . . . . 0.0 111.574 -179.069 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -110.04 -27.06 9.38 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.249 -0.907 . . . . 0.0 111.02 -179.376 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.603 HG22 ' O ' ' A' ' 69' ' ' TYR . 4.7 tp . . . . . 0 N--CA 1.495 1.814 0 O-C-N 121.389 -0.819 . . . . 0.0 110.459 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo . . . . . 0 N--CA 1.485 1.011 0 N-CA-C 110.727 -0.528 . . . . 0.0 110.727 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.26 -165.14 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.593 -0.692 . . . . 0.0 110.432 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 7.5 mpt_? -56.83 148.56 47.67 Favored Pre-proline 0 N--CA 1.498 1.953 0 O-C-N 121.455 -0.778 . . . . 0.0 110.732 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.425 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.5 Cg_endo -79.26 126.65 7.05 Favored 'Trans proline' 0 C--N 1.317 -1.1 0 O-C-N 123.387 1.204 . . . . 0.0 110.069 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.56 ' HB2' HD21 ' A' ' 18' ' ' LEU . 49.2 Cg_endo -81.68 178.45 6.56 Favored 'Trans proline' 0 C--N 1.318 -1.067 0 O-C-N 123.266 1.14 . . . . 0.0 110.379 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.532 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 14.7 t -160.23 63.33 0.33 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.502 -0.748 . . . . 0.0 110.526 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.532 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 67.19 -76.42 0.05 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.092 -1.005 . . . . 0.0 109.914 -179.37 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.419 ' CD1' ' CD1' ' A' ' 47' ' ' TRP . 18.6 t80 -51.58 -42.54 61.97 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.326 -0.858 . . . . 0.0 110.814 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -62.62 -29.16 70.4 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.696 -0.627 . . . . 0.0 109.357 179.382 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.56 HD21 ' HB2' ' A' ' 13' ' ' PRO . 45.0 mt -81.36 -40.35 23.66 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.67 -0.644 . . . . 0.0 110.276 -179.658 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -63.4 -49.74 72.58 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.485 -0.759 . . . . 0.0 109.865 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.594 ' HA ' HD22 ' A' ' 43' ' ' LEU . 9.0 t -60.85 -27.52 68.16 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.621 -0.674 . . . . 0.0 109.743 179.422 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 10.6 t -102.9 20.81 16.75 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.587 -0.696 . . . . 0.0 110.875 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -142.26 -12.01 0.83 Allowed 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.19 -0.944 . . . . 0.0 112.099 179.589 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -119.23 24.38 10.78 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.854 -1.154 . . . . 0.0 110.862 -179.434 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.572 ' HG2' HD11 ' A' ' 43' ' ' LEU . 8.0 mtt180 -85.45 -45.93 0.63 Allowed Pre-proline 0 N--CA 1.489 1.485 0 O-C-N 121.512 -0.742 . . . . 0.0 112.126 179.699 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.558 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.7 Cg_endo -66.91 -14.76 44.94 Favored 'Trans proline' 0 N--CA 1.49 1.281 0 O-C-N 122.925 0.961 . . . . 0.0 110.675 -179.11 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.84 -53.07 11.04 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 177.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 27.1 mm -52.03 -31.73 14.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 CA-C-O 121.417 0.627 . . . . 0.0 110.48 179.616 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.558 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.4 mmmm -72.71 -37.28 67.85 Favored 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.225 -177.39 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 26.4 t -58.64 -25.09 62.37 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.495 -0.753 . . . . 0.0 110.764 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -117.52 -21.58 8.53 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.531 -0.73 . . . . 0.0 110.96 -179.59 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.706 ' HB3' HD23 ' A' ' 34' ' ' LEU . 41.0 m80 -121.7 96.59 47.2 Favored Pre-proline 0 N--CA 1.496 1.857 0 O-C-N 121.247 -0.908 . . . . 0.0 109.783 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -75.23 -37.9 1.73 Allowed 'Trans proline' 0 C--N 1.315 -1.195 0 O-C-N 123.446 1.235 . . . . 0.0 110.433 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.32 -9.41 85.78 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 110.452 -1.059 . . . . 0.0 110.452 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.706 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -64.52 82.34 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.163 -1.198 . . . . 0.0 110.33 -179.882 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.6 t -76.49 173.06 11.97 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.503 -0.748 . . . . 0.0 109.703 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 40.0 mm -50.94 -29.72 8.03 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.186 0 O-C-N 121.271 -0.893 . . . . 0.0 110.6 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.87 -75.29 0.29 Allowed Glycine 0 N--CA 1.492 2.389 0 N-CA-C 109.069 -1.612 . . . . 0.0 109.069 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.439 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 29.3 t70 -66.2 -18.84 65.6 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.701 -0.882 . . . . 0.0 111.039 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 36.3 m -73.95 -45.58 49.43 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.243 -0.91 . . . . 0.0 109.954 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -52.32 -44.83 65.33 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.442 -0.787 . . . . 0.0 110.15 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.401 ' CD ' ' HA ' ' A' ' 38' ' ' ASP . 0.5 OUTLIER -80.32 -11.19 59.74 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.76 -0.587 . . . . 0.0 111.243 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.439 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -82.0 2.47 30.76 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 120.93 -1.106 . . . . 0.0 110.815 179.111 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.594 HD22 ' HA ' ' A' ' 20' ' ' CYS . 9.4 mt -106.34 -30.35 9.2 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.204 -0.935 . . . . 0.0 109.599 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -78.99 -42.11 12.99 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 108.854 -1.698 . . . . 0.0 108.854 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -55.11 -42.89 73.52 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.533 -0.98 . . . . 0.0 110.401 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 17.6 mmt -74.18 -50.5 18.98 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.571 -0.706 . . . . 0.0 109.535 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' TRP . . . . . 0.419 ' CD1' ' CD1' ' A' ' 16' ' ' PHE . 69.2 t-105 -49.61 -52.95 26.85 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.642 -0.661 . . . . 0.0 111.047 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 45.0 t -59.92 -35.48 74.99 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.407 -0.808 . . . . 0.0 110.326 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -63.58 -40.27 96.52 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.567 -0.708 . . . . 0.0 109.934 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 89.3 mm-40 -57.52 155.2 9.9 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.576 -0.702 . . . . 0.0 110.556 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 21.7 t -99.87 -150.67 0.38 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.722 -0.612 . . . . 0.0 109.511 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -89.65 47.46 1.47 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.281 -0.887 . . . . 0.0 110.275 179.724 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 62.0 mttt -126.8 -50.71 1.47 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.551 -0.718 . . . . 0.0 110.069 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -64.16 -24.74 67.79 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.67 -0.644 . . . . 0.0 110.405 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 66.1 tttt -81.96 -35.16 29.3 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.467 -0.771 . . . . 0.0 110.432 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -44.44 -52.22 17.89 Favored Pre-proline 0 N--CA 1.506 2.343 0 O-C-N 121.513 -0.742 . . . . 0.0 112.022 -179.04 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -78.96 -37.73 0.54 Allowed 'Trans proline' 0 C--N 1.315 -1.204 0 O-C-N 123.188 1.099 . . . . 0.0 110.958 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -84.53 4.29 32.64 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.38 -0.825 . . . . 0.0 112.043 -178.325 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.01 -23.89 14.77 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.072 -1.017 . . . . 0.0 110.446 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -76.36 -23.76 54.16 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.394 -0.816 . . . . 0.0 110.251 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 50.6 tttm -61.44 -39.82 92.19 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.421 -0.799 . . . . 0.0 109.856 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.489 ' HB1' ' O ' ' A' ' 13' ' ' PRO . . . -78.1 -13.06 60.01 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.6 -0.687 . . . . 0.0 110.365 179.348 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.35 1.75 35.58 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.397 -0.814 . . . . 0.0 110.291 178.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 26.3 mmtm -104.35 -30.36 10.15 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.147 -0.971 . . . . 0.0 109.735 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.476 ' N ' HD12 ' A' ' 65' ' ' LEU . 7.1 mp -86.48 1.51 51.22 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.894 -0.504 . . . . 0.0 110.592 179.102 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.5 tptt -94.38 -34.28 12.84 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.156 -0.965 . . . . 0.0 109.428 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -82.93 -11.59 58.05 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.751 -0.593 . . . . 0.0 110.394 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -105.04 -28.78 10.84 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.439 -0.788 . . . . 0.0 109.467 179.111 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.513 ' HE1' HD13 ' A' ' 73' ' ' ILE . 19.3 t80 -75.76 -54.41 6.98 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.6 -0.688 . . . . 0.0 109.59 179.575 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -68.08 -14.68 63.16 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.719 -0.613 . . . . 0.0 111.306 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 60.8 mttt -101.33 -30.53 11.44 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.256 -0.903 . . . . 0.0 110.709 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -92.48 -31.31 15.3 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.483 -0.76 . . . . 0.0 110.852 -179.439 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.513 HD13 ' HE1' ' A' ' 69' ' ' TYR . 3.7 tp . . . . . 0 N--CA 1.498 1.931 0 O-C-N 121.398 -0.814 . . . . 0.0 110.953 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.466 ' HB2' ' CG ' ' A' ' 69' ' ' TYR . 45.1 Cg_endo . . . . . 0 N--CA 1.483 0.896 0 N-CA-C 110.775 -0.51 . . . . 0.0 110.775 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.6 pttt -67.06 -153.92 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.575 -0.703 . . . . 0.0 109.615 179.51 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -57.75 138.21 82.61 Favored Pre-proline 0 N--CA 1.499 2.01 0 O-C-N 121.269 -0.895 . . . . 0.0 110.145 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -74.56 134.37 18.53 Favored 'Trans proline' 0 C--N 1.318 -1.078 0 O-C-N 123.246 1.129 . . . . 0.0 110.082 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.656 ' HB2' HD21 ' A' ' 18' ' ' LEU . 50.8 Cg_endo -80.56 179.7 5.88 Favored 'Trans proline' 0 C--N 1.318 -1.07 0 O-C-N 123.208 1.11 . . . . 0.0 110.164 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.541 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -170.0 61.65 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.398 -0.814 . . . . 0.0 110.827 -179.877 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.657 ' HB2' ' HA ' ' A' ' 59' ' ' GLU . . . 68.13 -78.71 0.04 OUTLIER 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.072 -1.018 . . . . 0.0 110.473 -179.76 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.417 ' CE2' ' CD1' ' A' ' 47' ' ' TRP . 3.9 t80 -48.65 -49.36 37.73 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.163 -0.961 . . . . 0.0 111.231 -179.463 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -57.15 -31.07 64.99 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.575 -0.703 . . . . 0.0 110.14 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.656 HD21 ' HB2' ' A' ' 13' ' ' PRO . 34.2 mt -78.57 -31.63 47.39 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.534 -0.729 . . . . 0.0 110.181 -179.779 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.502 ' CZ ' ' CZ ' ' A' ' 23' ' ' TYR . 52.1 t80 -76.79 -55.03 5.85 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.607 -0.683 . . . . 0.0 110.731 -179.306 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.8 t -57.7 -52.9 63.56 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.435 -0.791 . . . . 0.0 110.526 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 8.0 t -55.71 -24.19 33.24 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.5 -0.75 . . . . 0.0 110.855 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -98.72 -24.85 14.88 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.426 -0.796 . . . . 0.0 111.001 -179.524 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.658 ' HB3' HD22 ' A' ' 43' ' ' LEU . 2.2 m-85 -88.22 -36.4 16.78 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.378 -0.826 . . . . 0.0 110.685 -179.57 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.54 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 6.8 mtt180 -48.43 -51.38 51.74 Favored Pre-proline 0 N--CA 1.496 1.861 0 O-C-N 121.44 -0.788 . . . . 0.0 111.992 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.577 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.4 Cg_endo -60.11 -28.69 87.51 Favored 'Trans proline' 0 N--CA 1.495 1.566 0 O-C-N 123.21 1.111 . . . . 0.0 109.977 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.3 tmtt? -67.8 -44.68 76.76 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 178.022 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.635 HG13 HD21 ' A' ' 43' ' ' LEU . 46.4 mm -59.54 -23.37 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 CA-C-N 116.152 -0.477 . . . . 0.0 109.877 179.456 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.577 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.9 mmmm -83.56 -38.55 21.54 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.458 -0.777 . . . . 0.0 110.058 -177.693 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.7 t -57.43 -26.62 61.45 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.354 -0.841 . . . . 0.0 110.097 179.614 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -109.19 -48.05 3.32 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.611 -0.681 . . . . 0.0 109.857 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.826 ' HB3' HD23 ' A' ' 34' ' ' LEU . 14.2 m80 -103.31 103.58 35.93 Favored Pre-proline 0 N--CA 1.497 1.884 0 O-C-N 121.642 -0.661 . . . . 0.0 109.685 -179.456 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -81.38 -40.99 0.15 Allowed 'Trans proline' 0 C--N 1.314 -1.287 0 O-C-N 123.367 1.193 . . . . 0.0 109.975 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.08 -23.26 69.52 Favored Glycine 0 N--CA 1.488 2.146 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 179.12 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.826 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -51.79 91.76 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.529 -0.983 . . . . 0.0 110.909 179.976 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 68.7 m -74.35 175.41 7.69 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.583 -0.698 . . . . 0.0 109.755 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.508 ' H ' HD12 ' A' ' 36' ' ' ILE . 2.5 mp -59.65 -31.81 47.85 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.348 -0.845 . . . . 0.0 109.584 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.15 -61.41 7.36 Favored Glycine 0 N--CA 1.495 2.607 0 N-CA-C 109.02 -1.632 . . . . 0.0 109.02 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.678 ' HB3' HD13 ' A' ' 34' ' ' LEU . 16.5 t0 -71.36 -35.92 71.3 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.694 -0.886 . . . . 0.0 110.091 179.163 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.407 ' HB ' ' HA ' ' A' ' 36' ' ' ILE . 80.5 m -64.6 -29.9 70.92 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.138 -0.976 . . . . 0.0 109.82 179.157 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.56 -37.9 59.62 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.641 -0.662 . . . . 0.0 110.245 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.411 ' HG2' ' HA ' ' A' ' 38' ' ' ASP . 2.3 ptpt -95.87 -13.71 23.75 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.525 -0.734 . . . . 0.0 111.922 -178.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -86.04 4.49 37.77 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 120.974 -1.079 . . . . 0.0 110.626 179.7 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.658 HD22 ' HB3' ' A' ' 23' ' ' TYR . 80.1 mt -106.77 -34.27 7.33 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.262 -0.899 . . . . 0.0 109.488 179.467 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -64.57 -32.7 85.08 Favored Glycine 0 N--CA 1.493 2.476 0 N-CA-C 109.79 -1.324 . . . . 0.0 109.79 -179.686 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -51.18 -33.95 29.48 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.403 -1.057 . . . . 0.0 110.794 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 39.2 mtt -87.43 -41.05 13.85 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.604 -0.685 . . . . 0.0 109.888 179.64 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' TRP . . . . . 0.417 ' CD1' ' CE2' ' A' ' 16' ' ' PHE . 71.7 t-105 -56.19 -23.89 38.23 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.55 -0.718 . . . . 0.0 110.858 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 21.9 t -85.28 -36.08 21.1 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.48 -0.763 . . . . 0.0 110.066 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -63.03 -33.02 74.53 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.633 -0.667 . . . . 0.0 109.828 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 -64.81 149.64 49.0 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.645 -0.659 . . . . 0.0 110.12 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.6 m -104.44 -153.22 0.48 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.669 -0.644 . . . . 0.0 109.526 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.88 58.29 3.33 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.376 -0.827 . . . . 0.0 109.915 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 26.7 tttt -136.24 -50.79 0.7 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.399 -0.813 . . . . 0.0 110.297 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -69.81 -27.95 65.31 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.557 -0.715 . . . . 0.0 110.726 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.419 ' O ' ' N ' ' A' ' 59' ' ' GLU . 32.6 ttpt -80.0 -37.71 33.65 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.444 -0.785 . . . . 0.0 110.695 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -44.14 -53.01 14.56 Favored Pre-proline 0 N--CA 1.508 2.439 0 O-C-N 121.472 -0.768 . . . . 0.0 112.513 -178.824 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -77.66 -37.43 0.92 Allowed 'Trans proline' 0 C--N 1.315 -1.2 0 O-C-N 123.078 1.041 . . . . 0.0 111.744 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -81.86 -14.86 55.67 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.395 -0.815 . . . . 0.0 112.089 -178.111 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.657 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -82.84 -24.97 33.04 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.202 -0.936 . . . . 0.0 111.086 -178.934 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -79.83 -20.59 45.7 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.451 -0.781 . . . . 0.0 110.845 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 43.1 tttm -63.04 -48.39 78.9 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.409 -0.807 . . . . 0.0 110.195 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.65 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -81.12 -13.36 58.76 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.447 -0.783 . . . . 0.0 110.316 179.294 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.87 -28.14 69.83 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.321 -0.862 . . . . 0.0 109.154 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -81.75 -66.06 0.94 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.577 -0.702 . . . . 0.0 109.17 178.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.559 ' H ' HD12 ' A' ' 65' ' ' LEU . 3.1 mp -48.32 -22.56 0.7 Allowed 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.602 -0.687 . . . . 0.0 112.117 -179.356 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 23.9 tptt -65.49 -45.46 83.54 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.14 -0.975 . . . . 0.0 109.851 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -66.66 -54.51 22.42 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.662 -0.649 . . . . 0.0 110.349 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 68.9 mttt -56.4 -29.93 62.12 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.487 -0.758 . . . . 0.0 110.478 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.538 ' O ' HG22 ' A' ' 73' ' ' ILE . 3.8 m-85 -75.72 -70.07 0.45 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.576 -0.703 . . . . 0.0 109.834 179.652 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -49.53 -29.26 6.56 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.662 -0.649 . . . . 0.0 111.342 -179.53 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.8 ttmm -84.47 -58.04 2.9 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.529 -0.732 . . . . 0.0 110.47 -179.693 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -64.11 -30.23 71.31 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.624 -0.673 . . . . 0.0 111.112 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.538 HG22 ' O ' ' A' ' 69' ' ' TYR . 9.7 tp . . . . . 0 N--CA 1.496 1.829 0 O-C-N 121.351 -0.843 . . . . 0.0 110.442 -179.485 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo . . . . . 0 N--CA 1.484 0.938 0 N-CA-C 110.458 -0.631 . . . . 0.0 110.458 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.5 pttt -60.12 -162.44 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.664 -0.648 . . . . 0.0 110.337 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.68 144.59 98.8 Favored Pre-proline 0 N--CA 1.495 1.821 0 O-C-N 121.421 -0.799 . . . . 0.0 110.069 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.405 ' HG3' ' CE2' ' A' ' 69' ' ' TYR . 49.3 Cg_endo -75.24 131.0 13.54 Favored 'Trans proline' 0 C--N 1.317 -1.082 0 O-C-N 123.296 1.156 . . . . 0.0 109.802 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.674 ' CB ' HD21 ' A' ' 18' ' ' LEU . 48.9 Cg_endo -81.26 -176.75 3.27 Favored 'Trans proline' 0 C--N 1.317 -1.115 0 O-C-N 123.197 1.104 . . . . 0.0 110.172 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.535 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 76.4 p -165.48 59.21 0.11 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.513 -0.742 . . . . 0.0 110.807 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.535 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 68.52 -77.09 0.05 Allowed 'General case' 0 N--CA 1.504 2.258 0 O-C-N 121.12 -0.987 . . . . 0.0 110.662 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -46.99 -51.6 16.74 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.299 -0.876 . . . . 0.0 111.47 -179.391 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -57.55 -36.95 72.31 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.497 -0.752 . . . . 0.0 109.945 179.572 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.674 HD21 ' CB ' ' A' ' 13' ' ' PRO . 36.1 mt -70.08 -38.63 75.75 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.619 -0.676 . . . . 0.0 110.347 -179.751 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.492 ' CE1' ' CE1' ' A' ' 23' ' ' TYR . 63.1 t80 -71.94 -53.05 14.3 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.517 -0.739 . . . . 0.0 110.621 -179.507 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 34.6 t -56.83 -53.82 53.46 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.368 -0.833 . . . . 0.0 110.657 -179.715 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 11.8 t -56.22 -29.01 60.39 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.534 -0.729 . . . . 0.0 110.822 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -90.82 -27.75 18.65 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.468 -0.77 . . . . 0.0 110.798 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.492 ' CE1' ' CE1' ' A' ' 19' ' ' PHE . 9.1 m-85 -94.74 14.69 20.43 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.511 -0.743 . . . . 0.0 111.287 -179.433 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.527 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 4.2 mtp180 -88.59 -43.82 0.46 Allowed Pre-proline 0 N--CA 1.488 1.446 0 O-C-N 121.253 -0.904 . . . . 0.0 112.53 179.741 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.566 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 37.8 Cg_endo -65.66 -17.41 56.67 Favored 'Trans proline' 0 N--CA 1.491 1.365 0 O-C-N 122.865 0.929 . . . . 0.0 110.563 -178.775 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.8 tmtt? -72.02 -50.43 28.64 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 177.765 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 24.5 mm -54.86 -33.79 29.23 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 CA-C-O 121.224 0.535 . . . . 0.0 110.631 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.566 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 6.2 mmmm -71.01 -38.35 72.64 Favored 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 120.121 -0.632 . . . . 0.0 110.321 -177.073 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.6 t -58.65 -24.47 61.22 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.515 -0.741 . . . . 0.0 110.797 -179.531 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -117.29 -23.04 7.99 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.435 -0.79 . . . . 0.0 110.978 -179.565 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.747 ' HB3' HD23 ' A' ' 34' ' ' LEU . 43.0 m80 -120.56 96.58 48.91 Favored Pre-proline 0 N--CA 1.495 1.82 0 O-C-N 121.342 -0.848 . . . . 0.0 109.709 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -75.59 -29.07 7.68 Favored 'Trans proline' 0 C--N 1.315 -1.226 0 O-C-N 123.416 1.219 . . . . 0.0 110.54 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -85.04 -12.2 74.55 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 110.571 -1.012 . . . . 0.0 110.571 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.747 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -61.56 83.67 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.257 -1.143 . . . . 0.0 110.658 -179.543 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 71.5 p -72.52 171.1 13.0 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.512 -0.742 . . . . 0.0 109.847 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.586 ' H ' HD12 ' A' ' 36' ' ' ILE . 2.7 mp -53.6 -28.6 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.122 0 O-C-N 121.281 -0.887 . . . . 0.0 109.944 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.49 -71.13 0.83 Allowed Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.242 -1.543 . . . . 0.0 109.242 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.486 ' HB3' HD13 ' A' ' 34' ' ' LEU . 15.0 t70 -66.53 -27.41 67.74 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.698 -0.883 . . . . 0.0 110.456 179.551 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.433 ' HB ' ' HA ' ' A' ' 36' ' ' ILE . 33.2 m -67.38 -27.72 67.34 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.494 -0.754 . . . . 0.0 109.893 179.404 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.38 -47.37 23.52 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.574 -0.704 . . . . 0.0 109.685 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.69 -17.1 52.18 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.605 -0.684 . . . . 0.0 111.377 -179.64 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.413 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 11.0 tptt -76.66 -59.15 2.9 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.111 -0.993 . . . . 0.0 109.885 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.42 HD12 ' O ' ' A' ' 39' ' ' THR . 54.7 mt -47.03 -27.42 1.32 Allowed 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.648 -0.657 . . . . 0.0 111.544 -179.578 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.91 -36.2 91.79 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.182 -1.567 . . . . 0.0 109.182 179.542 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -51.01 -37.36 44.65 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.508 -0.995 . . . . 0.0 111.074 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 65.0 mtt -82.47 -42.8 18.03 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.598 -0.689 . . . . 0.0 110.318 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 69.9 t-105 -49.37 -32.93 12.43 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.523 -0.736 . . . . 0.0 111.585 -179.199 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.3 t -93.02 -24.06 18.47 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.306 -0.872 . . . . 0.0 110.592 -179.796 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -64.02 -43.3 96.02 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.413 -0.805 . . . . 0.0 109.993 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 52.2 mm-40 -61.83 157.62 17.74 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.719 -0.613 . . . . 0.0 110.329 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.3 t -87.23 -147.7 0.14 Allowed 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.493 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -83.58 54.11 2.75 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.181 -0.949 . . . . 0.0 110.125 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.0 tttt -129.62 -37.08 1.6 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.465 -0.772 . . . . 0.0 110.596 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -58.61 -38.62 78.4 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.304 -0.873 . . . . 0.0 110.791 -179.576 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -92.92 24.13 3.84 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.35 -0.844 . . . . 0.0 111.458 -179.197 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.454 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 4.4 mm-40 -98.05 -56.89 0.18 Allowed Pre-proline 0 N--CA 1.498 1.959 0 O-C-N 121.219 -0.926 . . . . 0.0 110.539 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.454 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.7 Cg_endo -83.23 -32.16 0.55 Allowed 'Trans proline' 0 N--CA 1.482 0.84 0 O-C-N 122.817 0.904 . . . . 0.0 110.666 179.76 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -82.09 -0.85 46.47 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.493 -0.754 . . . . 0.0 111.769 -178.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.42 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -92.54 -24.52 18.73 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.084 -1.01 . . . . 0.0 110.814 -179.577 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -79.26 -23.91 43.34 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.443 -0.785 . . . . 0.0 110.332 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -61.66 -44.83 96.21 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.432 -0.792 . . . . 0.0 109.92 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.517 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -70.22 -11.43 60.89 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.598 -0.689 . . . . 0.0 110.482 179.467 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -88.57 7.45 33.19 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.262 -0.899 . . . . 0.0 110.315 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 58.9 mmtt -107.02 -34.39 7.19 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.222 -0.923 . . . . 0.0 109.111 178.238 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.413 ' N ' HD12 ' A' ' 65' ' ' LEU . 6.2 mp -81.04 -4.12 54.14 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.984 -0.448 . . . . 0.0 110.342 178.969 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.9 tppt? -80.82 -31.53 35.54 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.264 -0.898 . . . . 0.0 109.301 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -69.23 -63.26 1.1 Allowed 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 119.876 -0.73 . . . . 0.0 109.603 179.499 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -55.2 -24.21 26.04 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.531 -0.731 . . . . 0.0 111.107 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.514 ' O ' HG22 ' A' ' 73' ' ' ILE . 29.5 t80 -79.18 -69.56 0.57 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.306 -0.871 . . . . 0.0 110.29 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -62.9 -14.06 41.93 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.551 -0.718 . . . . 0.0 111.768 -179.275 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.7 tttt -98.24 -27.02 14.34 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.104 -0.998 . . . . 0.0 110.893 -179.553 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -104.39 -24.56 13.05 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.434 -0.791 . . . . 0.0 111.079 -179.41 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.514 HG22 ' O ' ' A' ' 69' ' ' TYR . 3.2 tp . . . . . 0 N--CA 1.497 1.882 0 O-C-N 121.407 -0.808 . . . . 0.0 110.421 -179.543 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo . . . . . 0 N--CA 1.484 0.94 0 N-CA-C 110.443 -0.637 . . . . 0.0 110.443 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.6 pttm -65.6 -155.49 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.599 -0.688 . . . . 0.0 109.658 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -55.44 145.88 46.06 Favored Pre-proline 0 N--CA 1.499 2.015 0 O-C-N 121.291 -0.881 . . . . 0.0 110.365 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -73.57 126.28 10.75 Favored 'Trans proline' 0 C--N 1.316 -1.162 0 O-C-N 123.378 1.199 . . . . 0.0 110.319 -179.679 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.476 ' C ' ' HB1' ' A' ' 62' ' ' ALA . 48.8 Cg_endo -81.57 173.44 11.41 Favored 'Trans proline' 0 C--N 1.318 -1.043 0 O-C-N 123.239 1.126 . . . . 0.0 109.799 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.579 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 33.5 t -171.83 64.57 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.429 -0.794 . . . . 0.0 111.001 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.579 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 71.32 -74.26 0.09 Allowed 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.124 -0.985 . . . . 0.0 110.876 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -46.67 -52.87 12.83 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.274 -0.891 . . . . 0.0 111.556 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -58.31 -39.24 78.84 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.575 -0.703 . . . . 0.0 109.865 179.509 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.586 HD11 ' HB2' ' A' ' 62' ' ' ALA . 48.4 mt -64.59 -42.94 95.26 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.667 -0.646 . . . . 0.0 109.814 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.501 ' CE1' ' CE1' ' A' ' 23' ' ' TYR . 80.9 t80 -68.71 -51.73 38.38 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.647 -0.658 . . . . 0.0 110.268 -179.827 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.3 m -55.7 -56.05 24.97 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.545 -0.722 . . . . 0.0 110.69 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 84.8 p -55.87 -30.78 62.07 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.48 -0.762 . . . . 0.0 110.831 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -87.54 -27.31 22.68 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.464 -0.773 . . . . 0.0 110.909 -179.567 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.501 ' CE1' ' CE1' ' A' ' 19' ' ' PHE . 9.6 m-85 -98.87 14.85 27.46 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.458 -0.776 . . . . 0.0 111.369 -179.5 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.516 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 14.2 mtp180 -87.91 -45.01 0.49 Allowed Pre-proline 0 N--CA 1.488 1.437 0 O-C-N 121.151 -0.968 . . . . 0.0 112.505 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.562 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.0 Cg_endo -65.47 -17.61 57.88 Favored 'Trans proline' 0 N--CA 1.491 1.353 0 O-C-N 122.802 0.896 . . . . 0.0 110.539 -178.895 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.1 tmtm? -71.71 -49.8 36.08 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 177.922 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 23.7 mm -55.49 -34.14 34.1 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 CA-C-O 121.322 0.582 . . . . 0.0 110.566 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.562 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.7 mmmm -70.98 -38.6 72.75 Favored 'General case' 0 N--CA 1.497 1.886 0 C-N-CA 120.167 -0.613 . . . . 0.0 110.299 -176.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.9 t -59.91 -23.52 63.57 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.461 -0.775 . . . . 0.0 110.816 -179.564 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -117.52 -21.04 8.78 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.484 -0.76 . . . . 0.0 111.116 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.753 ' HB3' HD23 ' A' ' 34' ' ' LEU . 48.5 m80 -121.96 96.45 46.79 Favored Pre-proline 0 N--CA 1.495 1.824 0 O-C-N 121.348 -0.845 . . . . 0.0 109.784 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -75.38 -28.75 8.29 Favored 'Trans proline' 0 C--N 1.315 -1.185 0 O-C-N 123.416 1.219 . . . . 0.0 110.455 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -84.14 -13.83 73.32 Favored Glycine 0 N--CA 1.488 2.127 0 N-CA-C 110.504 -1.038 . . . . 0.0 110.504 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.753 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -61.08 82.8 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.334 -1.097 . . . . 0.0 110.892 -179.522 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 33.4 t -75.05 171.54 13.93 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.506 -0.746 . . . . 0.0 109.78 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 40.8 mm -52.12 -27.73 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.175 0 O-C-N 121.284 -0.885 . . . . 0.0 110.369 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -61.42 -71.63 0.77 Allowed Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.227 -1.549 . . . . 0.0 109.227 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.423 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 8.2 t70 -67.33 -26.04 66.3 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.628 -0.925 . . . . 0.0 110.765 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 56.2 m -68.46 -28.79 67.36 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.458 -0.777 . . . . 0.0 109.926 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.58 -47.13 34.25 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.536 -0.728 . . . . 0.0 109.747 179.572 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -81.49 -14.71 56.67 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.573 -0.704 . . . . 0.0 111.366 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 6.9 tptt -76.4 -58.82 3.06 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.085 -1.009 . . . . 0.0 109.727 179.686 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.409 HD11 ' CG ' ' A' ' 24' ' ' ARG . 45.0 mt -48.28 -27.09 2.29 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.493 -0.754 . . . . 0.0 111.287 -179.7 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.92 -38.73 96.5 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 109.17 -1.572 . . . . 0.0 109.17 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -51.7 -39.34 58.14 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.524 -0.986 . . . . 0.0 110.852 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.0 mmt -72.91 -45.63 57.07 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.617 -0.677 . . . . 0.0 109.516 179.567 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 51.7 t-105 -52.14 -58.16 7.41 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.671 -0.643 . . . . 0.0 110.771 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 9.0 t -59.35 -32.6 70.26 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.453 -0.779 . . . . 0.0 110.305 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -63.68 -42.33 98.04 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.574 -0.704 . . . . 0.0 109.945 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -64.43 154.93 34.21 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.651 -0.655 . . . . 0.0 110.404 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 76.2 p -99.31 -150.15 0.37 Allowed 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.94 57.41 3.06 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.203 -0.935 . . . . 0.0 110.15 179.656 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 22.5 tttt -134.99 -43.25 0.73 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.352 -0.842 . . . . 0.0 110.212 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -63.41 -32.29 73.69 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.487 -0.758 . . . . 0.0 110.56 -179.679 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.2 ttpt -91.83 22.97 3.86 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.332 -0.855 . . . . 0.0 111.325 -179.225 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.46 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 8.0 mm-40 -96.95 -59.98 0.15 Allowed Pre-proline 0 N--CA 1.497 1.881 0 O-C-N 121.103 -0.998 . . . . 0.0 110.843 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.46 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.4 Cg_endo -80.45 -30.29 2.04 Favored 'Trans proline' 0 N--CA 1.486 1.047 0 O-C-N 122.871 0.932 . . . . 0.0 110.897 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.542 ' O ' HD12 ' A' ' 18' ' ' LEU . 3.2 m-85 -82.49 -8.92 59.6 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.492 -0.755 . . . . 0.0 112.01 -178.587 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.57 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -84.3 -25.37 29.34 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.095 -1.003 . . . . 0.0 111.113 -179.331 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -79.09 -21.94 45.96 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.461 -0.774 . . . . 0.0 110.791 -179.874 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 44.9 tttt -66.0 -44.05 85.92 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.336 -0.853 . . . . 0.0 109.858 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.586 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -79.9 -15.13 57.96 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.534 -0.728 . . . . 0.0 110.134 179.411 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.02 -31.33 69.85 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.269 -0.894 . . . . 0.0 109.42 179.427 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -74.1 -62.75 1.4 Allowed 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 178.909 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.459 HD22 ' HG3' ' A' ' 13' ' ' PRO . 0.8 OUTLIER -43.61 -25.36 0.16 Allowed 'General case' 0 N--CA 1.506 2.336 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -179.297 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -65.02 -44.22 89.89 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.223 -0.923 . . . . 0.0 109.169 178.78 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -66.24 -57.4 7.65 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.755 -0.59 . . . . 0.0 109.787 179.608 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.7 mptm? -51.31 -31.31 21.12 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.397 -0.815 . . . . 0.0 110.718 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.55 ' O ' HG22 ' A' ' 73' ' ' ILE . 34.8 t80 -75.62 -64.37 1.09 Allowed 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 179.095 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -59.67 -17.81 37.03 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.881 -0.512 . . . . 0.0 111.322 -179.668 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.4 mmmt -99.47 -23.75 15.01 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.169 -0.957 . . . . 0.0 111.45 -179.147 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -103.95 -28.66 11.43 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.27 -0.894 . . . . 0.0 110.983 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.55 HG22 ' O ' ' A' ' 69' ' ' TYR . 3.1 tp . . . . . 0 N--CA 1.495 1.809 0 O-C-N 121.427 -0.796 . . . . 0.0 110.186 -179.655 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo . . . . . 0 N--CA 1.485 0.972 0 N-CA-C 110.218 -0.724 . . . . 0.0 110.218 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.53 -155.0 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.63 -0.669 . . . . 0.0 110.323 -179.715 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -61.0 133.92 92.67 Favored Pre-proline 0 N--CA 1.497 1.899 0 O-C-N 121.492 -0.755 . . . . 0.0 110.153 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.44 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.8 Cg_endo -76.82 137.72 18.08 Favored 'Trans proline' 0 C--N 1.319 -0.992 0 O-C-N 123.192 1.101 . . . . 0.0 109.847 179.4 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.674 ' CG ' HD21 ' A' ' 18' ' ' LEU . 50.3 Cg_endo -79.29 -169.41 0.79 Allowed 'Trans proline' 0 C--N 1.316 -1.177 0 O-C-N 123.174 1.092 . . . . 0.0 110.154 -179.745 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.509 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 66.5 p -163.0 63.67 0.19 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.439 -0.788 . . . . 0.0 110.92 -179.728 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.509 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 66.49 -78.06 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.002 -1.061 . . . . 0.0 110.518 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -48.47 -48.19 37.9 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.351 -0.843 . . . . 0.0 111.447 -179.487 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -59.78 -33.99 72.42 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.583 -0.698 . . . . 0.0 109.737 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.674 HD21 ' CG ' ' A' ' 13' ' ' PRO . 42.4 mt -72.29 -33.03 67.12 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.707 -0.621 . . . . 0.0 109.488 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.492 ' CZ ' ' CZ ' ' A' ' 23' ' ' TYR . 22.9 t80 -73.3 -52.48 13.76 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.78 -0.575 . . . . 0.0 110.489 -179.758 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 17.0 p -60.81 -31.79 71.18 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.477 -0.764 . . . . 0.0 110.38 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 91.8 p -71.14 -23.86 62.16 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.781 -0.574 . . . . 0.0 112.111 -178.451 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.9 -24.71 9.39 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.022 -1.049 . . . . 0.0 112.384 -178.611 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.492 ' CZ ' ' CZ ' ' A' ' 19' ' ' PHE . 4.9 m-85 -80.33 -36.93 33.51 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 120.925 -1.109 . . . . 0.0 111.099 -179.207 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.556 ' HG2' HD11 ' A' ' 43' ' ' LEU . 10.3 mtp180 -48.0 -52.91 36.85 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.319 -0.863 . . . . 0.0 112.198 -179.61 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.562 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.2 Cg_endo -59.67 -27.7 85.57 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 O-C-N 123.274 1.144 . . . . 0.0 110.261 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.8 tmtm? -69.63 -45.95 67.33 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 177.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.2 mm -57.77 -29.67 35.72 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.28 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.562 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.4 mmmm -73.09 -35.49 66.63 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 119.968 -0.693 . . . . 0.0 110.571 -177.183 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 28.9 t -66.27 -22.6 66.31 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.445 -0.784 . . . . 0.0 110.62 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -116.19 -16.06 11.01 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.528 -0.733 . . . . 0.0 111.142 -179.614 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.692 ' HB3' HD23 ' A' ' 34' ' ' LEU . 44.6 m80 -129.83 94.75 30.76 Favored Pre-proline 0 N--CA 1.497 1.889 0 O-C-N 121.306 -0.871 . . . . 0.0 109.238 179.46 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -74.72 -36.09 3.03 Favored 'Trans proline' 0 C--N 1.316 -1.148 0 O-C-N 123.514 1.27 . . . . 0.0 110.479 -179.633 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -75.34 -19.17 79.71 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 110.051 -1.22 . . . . 0.0 110.051 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.692 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -55.11 86.28 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.522 -0.987 . . . . 0.0 111.378 -179.385 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.404 ' N ' ' O ' ' A' ' 33' ' ' GLY . 42.8 t -80.34 171.24 15.32 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.549 -0.719 . . . . 0.0 109.471 179.552 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.44 ' O ' ' HB2' ' A' ' 40' ' ' ALA . 43.3 mm -53.33 -26.2 11.92 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 O-C-N 121.326 -0.859 . . . . 0.0 110.347 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -61.08 -71.77 0.74 Allowed Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.238 -1.545 . . . . 0.0 109.238 179.619 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.429 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 16.4 t70 -69.32 -28.22 66.06 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.688 -0.889 . . . . 0.0 110.502 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.433 ' OG1' HD12 ' A' ' 34' ' ' LEU . 86.6 m -68.68 -32.27 71.98 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.413 -0.804 . . . . 0.0 109.769 179.437 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.44 ' HB2' ' O ' ' A' ' 36' ' ' ILE . . . -69.89 -39.61 76.14 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 120.073 -0.651 . . . . 0.0 109.484 179.693 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -91.51 -15.12 29.24 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.644 -0.66 . . . . 0.0 111.493 -179.399 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.429 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 30.7 tptt -83.29 1.14 42.5 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.022 -1.049 . . . . 0.0 110.526 179.378 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.556 HD11 ' HG2' ' A' ' 24' ' ' ARG . 25.7 mt -97.45 -35.1 10.77 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.12 -0.987 . . . . 0.0 108.958 178.982 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.35 -31.98 71.75 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 108.841 -1.704 . . . . 0.0 108.841 179.33 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -55.35 -47.63 75.45 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.595 -0.944 . . . . 0.0 110.179 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 16.2 mtp -70.61 -48.98 52.43 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 70.0 t-105 -52.92 -58.42 7.01 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.708 -0.62 . . . . 0.0 110.555 179.735 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 46.6 t -60.76 -34.34 74.31 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.472 -0.767 . . . . 0.0 110.26 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -58.02 -39.11 77.52 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.603 -0.686 . . . . 0.0 110.26 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 57.5 mm-40 -67.54 164.96 17.83 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.592 -0.692 . . . . 0.0 110.075 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.1 m -150.09 107.2 3.58 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.544 -0.723 . . . . 0.0 110.17 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 53.01 47.1 25.41 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.347 -0.845 . . . . 0.0 110.655 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.9 mtpt -149.26 -64.76 0.23 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.556 -0.715 . . . . 0.0 109.86 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -59.78 -31.28 69.53 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.5 -0.75 . . . . 0.0 110.562 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.4 tttm -96.05 22.36 7.64 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.427 -0.796 . . . . 0.0 111.191 -179.447 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.436 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 1.3 mm-40 -99.1 -55.02 0.18 Allowed Pre-proline 0 N--CA 1.496 1.842 0 O-C-N 121.195 -0.941 . . . . 0.0 110.61 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.436 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.0 Cg_endo -83.73 -36.76 0.18 Allowed 'Trans proline' 0 C--N 1.321 -0.873 0 O-C-N 122.925 0.961 . . . . 0.0 110.825 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -80.6 5.33 15.76 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.539 -0.725 . . . . 0.0 111.787 -179.306 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.492 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -97.8 -20.35 17.59 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.079 -1.013 . . . . 0.0 110.619 179.943 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -77.67 -24.33 49.38 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.441 -0.787 . . . . 0.0 110.364 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.429 ' HD3' HD13 ' A' ' 18' ' ' LEU . 26.4 tttp -58.81 -45.36 90.09 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.409 -0.807 . . . . 0.0 110.027 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.7 -10.08 59.24 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.596 -0.69 . . . . 0.0 110.58 179.416 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -86.31 2.97 45.35 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.253 -0.905 . . . . 0.0 110.503 179.027 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 24.4 mmtp -105.12 -32.86 8.49 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.231 -0.918 . . . . 0.0 109.462 179.536 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.8 mp -80.83 4.25 19.8 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.909 -0.494 . . . . 0.0 111.039 179.553 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -97.29 -26.76 14.79 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.141 -0.974 . . . . 0.0 109.926 179.503 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -84.71 -14.52 48.13 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.521 -0.737 . . . . 0.0 110.62 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.4 mmtt -103.57 -29.19 11.28 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.309 -0.869 . . . . 0.0 109.711 179.474 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.548 ' O ' HG22 ' A' ' 73' ' ' ILE . 11.6 t80 -75.26 -53.34 8.95 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.63 -0.669 . . . . 0.0 109.628 179.71 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -63.99 -13.34 45.63 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.618 -0.676 . . . . 0.0 111.494 -179.478 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.4 mmtm -108.1 -32.42 7.53 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.129 -0.982 . . . . 0.0 110.901 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -89.69 -36.39 15.25 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.443 -0.785 . . . . 0.0 111.281 -179.079 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.548 HG22 ' O ' ' A' ' 69' ' ' TYR . 3.7 tp . . . . . 0 N--CA 1.497 1.898 0 O-C-N 121.27 -0.894 . . . . 0.0 110.864 -179.316 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.432 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 53.3 Cg_endo . . . . . 0 N--CA 1.482 0.807 0 N-CA-C 110.282 -0.699 . . . . 0.0 110.282 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -110.0 26.34 10.77 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.465 -0.772 . . . . 0.0 110.98 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.5 ttm180 -159.19 94.61 1.77 Allowed Pre-proline 0 N--CA 1.493 1.681 0 O-C-N 121.734 -0.604 . . . . 0.0 110.488 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -76.98 114.05 3.74 Favored 'Trans proline' 0 C--N 1.317 -1.127 0 O-C-N 123.491 1.259 . . . . 0.0 110.491 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.736 ' CB ' HD21 ' A' ' 18' ' ' LEU . 47.2 Cg_endo -81.04 164.65 19.8 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 O-C-N 123.282 1.149 . . . . 0.0 110.251 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.544 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 94.6 p -157.06 53.9 0.51 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.43 -0.794 . . . . 0.0 110.806 -179.677 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.636 ' HB2' ' HA ' ' A' ' 59' ' ' GLU . . . 68.12 -76.57 0.05 Allowed 'General case' 0 N--CA 1.503 2.221 0 O-C-N 121.135 -0.978 . . . . 0.0 109.993 -179.613 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -48.16 -50.62 28.21 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.315 -0.866 . . . . 0.0 111.227 -179.734 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -57.52 -40.09 77.97 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.596 -0.69 . . . . 0.0 109.528 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.736 HD21 ' CB ' ' A' ' 13' ' ' PRO . 49.3 mt -64.43 -44.26 91.74 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.757 -0.589 . . . . 0.0 110.242 179.904 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -66.3 -51.81 53.59 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.573 -0.705 . . . . 0.0 110.359 -179.538 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.483 ' SG ' HD13 ' A' ' 43' ' ' LEU . 48.1 t -66.77 -21.39 66.06 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.579 -0.7 . . . . 0.0 110.299 179.582 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.9 m -73.57 -20.63 60.57 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.383 -0.823 . . . . 0.0 111.728 -179.07 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -127.15 -14.28 5.48 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.017 -1.052 . . . . 0.0 112.972 -178.456 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -88.69 16.02 7.33 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 120.774 -1.204 . . . . 0.0 111.73 -178.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.531 ' HG2' HD11 ' A' ' 43' ' ' LEU . 33.2 mtp180 -92.16 -44.27 0.35 Allowed Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.197 -0.939 . . . . 0.0 112.543 179.615 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.572 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.1 Cg_endo -66.82 -15.15 46.4 Favored 'Trans proline' 0 N--CA 1.49 1.307 0 O-C-N 122.917 0.956 . . . . 0.0 110.382 -179.299 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.76 -54.28 8.42 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 177.531 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 38.2 mm -51.2 -26.02 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.985 0 O-C-N 121.89 -0.507 . . . . 0.0 110.738 179.381 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.572 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 6.8 mmmm -78.22 -31.71 49.46 Favored 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 119.84 -0.744 . . . . 0.0 110.014 -177.853 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 15.1 t -67.09 -21.96 65.84 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.563 -0.711 . . . . 0.0 110.525 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -119.54 -13.67 9.18 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.384 -0.822 . . . . 0.0 111.282 -179.705 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.766 ' HB3' HD23 ' A' ' 34' ' ' LEU . 38.1 m80 -130.63 94.75 28.38 Favored Pre-proline 0 N--CA 1.497 1.899 0 O-C-N 121.19 -0.944 . . . . 0.0 109.502 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -75.25 -35.45 2.96 Favored 'Trans proline' 0 C--N 1.316 -1.173 0 O-C-N 123.575 1.303 . . . . 0.0 110.061 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.15 -15.33 81.5 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 179.594 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.766 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.3 OUTLIER -56.62 87.78 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.327 -1.102 . . . . 0.0 110.887 -179.611 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 80.1 p -79.91 169.19 18.25 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.594 -0.691 . . . . 0.0 109.56 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 36.9 mm -50.01 -27.02 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.237 0 O-C-N 121.449 -0.782 . . . . 0.0 110.379 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.452 ' O ' ' HD3' ' A' ' 41' ' ' LYS . . . -58.95 -68.78 1.52 Allowed Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.135 -1.586 . . . . 0.0 109.135 179.554 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -78.09 -15.97 58.41 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.719 -0.871 . . . . 0.0 111.876 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.6 ' HA ' HD12 ' A' ' 34' ' ' LEU . 51.2 m -61.49 -40.88 96.18 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.023 -1.048 . . . . 0.0 109.277 179.545 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.58 -37.69 87.4 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.32 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.452 ' HD3' ' O ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -70.15 -31.72 69.35 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.789 -0.57 . . . . 0.0 110.133 -179.481 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.51 -11.75 60.55 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.26 -0.9 . . . . 0.0 110.515 179.683 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.531 HD11 ' HG2' ' A' ' 24' ' ' ARG . 77.2 mt -97.04 -27.87 14.41 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.301 -0.874 . . . . 0.0 110.172 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -89.63 -46.34 4.32 Favored Glycine 0 N--CA 1.493 2.472 0 N-CA-C 109.629 -1.389 . . . . 0.0 109.629 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -51.43 -31.9 24.62 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.388 -1.066 . . . . 0.0 110.825 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 75.7 mtp -87.77 -41.47 13.27 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.563 -0.711 . . . . 0.0 109.817 179.582 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -57.2 -22.2 38.99 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.609 -0.682 . . . . 0.0 110.804 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -94.04 -35.67 12.48 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.381 -0.825 . . . . 0.0 110.131 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -61.38 -34.23 74.98 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.524 -0.735 . . . . 0.0 109.968 179.808 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -58.04 150.2 21.52 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.572 -0.705 . . . . 0.0 110.507 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 17.1 t -89.43 -151.63 0.23 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.616 -0.678 . . . . 0.0 109.588 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -84.01 54.66 3.0 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.249 -0.907 . . . . 0.0 110.181 179.796 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.4 mttp -136.87 -41.59 0.6 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.473 -0.767 . . . . 0.0 110.435 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -62.31 -37.45 85.63 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.522 -0.736 . . . . 0.0 110.388 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -96.28 20.41 10.45 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.371 -0.83 . . . . 0.0 110.918 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.469 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 3.7 mt-30 -88.33 -59.03 0.26 Allowed Pre-proline 0 N--CA 1.496 1.867 0 O-C-N 121.165 -0.959 . . . . 0.0 109.759 179.571 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.469 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 57.3 Cg_endo -81.58 -23.89 4.63 Favored 'Trans proline' 0 C--N 1.32 -0.971 0 O-C-N 122.99 0.995 . . . . 0.0 110.353 179.013 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -81.56 -20.31 40.19 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.59 -0.694 . . . . 0.0 111.827 -178.332 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.636 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -82.37 -22.06 35.63 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.145 -0.972 . . . . 0.0 110.79 -179.564 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -84.02 -24.09 30.65 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.379 -0.825 . . . . 0.0 110.422 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -62.39 -47.29 84.78 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.44 -0.787 . . . . 0.0 109.778 179.782 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.643 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -74.53 -9.44 58.58 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.595 -0.691 . . . . 0.0 110.916 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.64 -0.61 55.58 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.3 -0.875 . . . . 0.0 110.283 179.015 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 47.7 mmtt -105.48 -29.18 10.37 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.21 -0.931 . . . . 0.0 109.943 179.461 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.2 mp -86.85 -14.23 42.66 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.963 -0.461 . . . . 0.0 110.031 178.753 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.8 tptt -76.3 -30.35 57.7 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.284 -0.885 . . . . 0.0 109.469 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -67.42 -59.72 3.16 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.651 -0.655 . . . . 0.0 109.484 179.542 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.9 mmpt? -60.25 -25.71 65.88 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.641 -0.662 . . . . 0.0 110.511 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.633 ' O ' HG22 ' A' ' 73' ' ' ILE . 21.4 t80 -71.5 -65.14 0.79 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.37 -0.831 . . . . 0.0 109.255 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -61.29 -17.5 53.86 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.836 -0.54 . . . . 0.0 111.082 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -98.62 -20.83 16.78 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.283 -0.885 . . . . 0.0 111.568 -179.098 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -106.36 -32.69 8.03 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.23 -0.919 . . . . 0.0 111.064 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.633 HG22 ' O ' ' A' ' 69' ' ' TYR . 8.4 tp . . . . . 0 N--CA 1.495 1.816 0 O-C-N 121.419 -0.801 . . . . 0.0 110.372 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo . . . . . 0 N--CA 1.485 0.973 0 N-CA-C 110.008 -0.805 . . . . 0.0 110.008 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 35.87 -156.49 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.324 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 178.596 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -108.43 153.92 41.78 Favored Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.583 -0.698 . . . . 0.0 109.483 179.429 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -73.15 113.96 3.91 Favored 'Trans proline' 0 C--N 1.316 -1.155 0 O-C-N 123.316 1.166 . . . . 0.0 110.803 -179.621 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.739 ' HB2' HD21 ' A' ' 18' ' ' LEU . 49.9 Cg_endo -82.98 173.18 10.34 Favored 'Trans proline' 0 C--N 1.318 -1.045 0 O-C-N 123.37 1.194 . . . . 0.0 110.122 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.513 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 42.2 t -165.4 63.33 0.12 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.492 -0.755 . . . . 0.0 110.616 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.513 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 66.64 -77.25 0.04 OUTLIER 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.114 -0.991 . . . . 0.0 110.361 -179.78 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -47.7 -49.49 27.66 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.302 -0.874 . . . . 0.0 111.401 -179.429 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -59.07 -35.86 74.08 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.616 -0.677 . . . . 0.0 109.945 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.739 HD21 ' HB2' ' A' ' 13' ' ' PRO . 23.0 mt -74.27 -32.62 62.99 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.624 -0.673 . . . . 0.0 110.323 -179.599 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.422 ' CE1' ' CZ ' ' A' ' 23' ' ' TYR . 68.1 t80 -79.65 -55.26 5.15 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.498 -0.751 . . . . 0.0 110.647 -179.363 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.9 t -57.15 -54.58 45.13 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.526 -0.734 . . . . 0.0 110.686 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.1 t -55.74 -22.49 24.13 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.438 -0.788 . . . . 0.0 110.982 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 41.1 mm-40 -100.93 -25.1 14.2 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.406 -0.809 . . . . 0.0 110.936 -179.53 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.435 ' O ' HD21 ' A' ' 43' ' ' LEU . 10.9 m-85 -96.71 12.43 31.94 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.395 -0.815 . . . . 0.0 111.522 -179.376 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.524 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 50.9 mtt180 -87.04 -45.02 0.53 Allowed Pre-proline 0 N--CA 1.489 1.482 0 O-C-N 121.226 -0.921 . . . . 0.0 112.164 179.538 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.591 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.1 Cg_endo -66.71 -15.67 48.11 Favored 'Trans proline' 0 N--CA 1.49 1.308 0 O-C-N 122.89 0.942 . . . . 0.0 110.484 -179.231 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -72.88 -50.19 25.32 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 177.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 28.0 mm -54.62 -32.96 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 CA-C-O 121.377 0.608 . . . . 0.0 110.288 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.591 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.0 mmmm -72.3 -36.59 68.98 Favored 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.3 -177.149 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.8 t -60.02 -25.76 65.56 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.551 -0.718 . . . . 0.0 110.661 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -115.35 -22.73 9.22 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.545 -0.722 . . . . 0.0 110.766 -179.638 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.756 ' HB3' HD23 ' A' ' 34' ' ' LEU . 39.2 m80 -121.41 96.07 48.01 Favored Pre-proline 0 N--CA 1.496 1.865 0 O-C-N 121.485 -0.76 . . . . 0.0 109.596 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -75.21 -31.17 6.16 Favored 'Trans proline' 0 C--N 1.315 -1.221 0 O-C-N 123.393 1.207 . . . . 0.0 110.344 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.409 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -80.38 -16.37 76.23 Favored Glycine 0 N--CA 1.489 2.193 0 N-CA-C 110.298 -1.121 . . . . 0.0 110.298 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.756 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -59.16 82.64 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.408 -1.054 . . . . 0.0 111.222 -179.356 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.409 ' N ' ' O ' ' A' ' 33' ' ' GLY . 71.8 m -69.55 172.43 7.34 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.479 -0.763 . . . . 0.0 109.701 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.556 ' H ' HD12 ' A' ' 36' ' ' ILE . 2.5 mp -56.15 -28.39 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.108 0 O-C-N 121.273 -0.892 . . . . 0.0 109.735 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.79 -65.34 3.39 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.235 -1.546 . . . . 0.0 109.235 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.591 ' HB3' HD13 ' A' ' 34' ' ' LEU . 7.9 t0 -70.02 -30.82 68.22 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.604 -0.939 . . . . 0.0 110.466 179.642 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.442 ' HB ' ' HA ' ' A' ' 36' ' ' ILE . 54.7 m -63.97 -30.66 71.72 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.494 -0.754 . . . . 0.0 109.96 179.669 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.78 -43.29 47.19 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.562 -0.711 . . . . 0.0 110.118 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.419 ' HG2' ' HA ' ' A' ' 38' ' ' ASP . 0.5 OUTLIER -87.72 -10.02 52.38 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.62 -0.675 . . . . 0.0 111.695 -179.525 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.42 -60.99 2.11 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.05 -1.031 . . . . 0.0 109.683 179.571 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.435 HD21 ' O ' ' A' ' 23' ' ' TYR . 21.8 mt -49.23 -25.66 2.43 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.518 -0.739 . . . . 0.0 111.378 -179.719 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -66.28 -36.89 92.34 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 109.365 -1.494 . . . . 0.0 109.365 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -51.92 -34.61 42.35 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.474 -1.015 . . . . 0.0 111.016 -179.723 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 7.6 mtt -85.14 -43.01 14.23 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.495 -0.753 . . . . 0.0 109.998 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' TRP . . . . . 0.444 ' CH2' ' HG2' ' A' ' 55' ' ' LYS . 64.4 t-105 -51.19 -36.69 42.58 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.528 -0.733 . . . . 0.0 111.174 -179.532 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 6.9 t -85.53 -27.8 25.34 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.438 -0.789 . . . . 0.0 110.117 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -58.63 -39.04 79.39 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.479 -0.763 . . . . 0.0 110.113 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.28 167.33 16.58 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.58 -0.7 . . . . 0.0 109.749 179.523 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.4 m -146.57 101.39 3.46 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.608 -0.683 . . . . 0.0 110.498 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 51.51 48.55 22.71 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.409 -0.807 . . . . 0.0 110.969 179.724 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 14.1 tttp -141.6 -65.57 0.42 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.553 -0.717 . . . . 0.0 110.236 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -64.48 -24.88 67.77 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.524 -0.735 . . . . 0.0 110.721 -179.708 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.444 ' HG2' ' CH2' ' A' ' 47' ' ' TRP . 39.9 mtpt -80.45 -35.14 35.34 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.476 -0.765 . . . . 0.0 110.759 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -46.4 -53.22 24.88 Favored Pre-proline 0 N--CA 1.505 2.303 0 O-C-N 121.51 -0.744 . . . . 0.0 112.021 -179.097 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -77.62 -39.98 0.47 Allowed 'Trans proline' 0 C--N 1.314 -1.257 0 O-C-N 123.171 1.09 . . . . 0.0 110.956 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -80.21 5.33 14.86 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.453 -0.779 . . . . 0.0 112.07 -178.404 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.32 -18.68 16.68 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.876 -1.14 . . . . 0.0 110.727 179.466 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -79.86 -28.12 40.02 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.261 -0.9 . . . . 0.0 110.224 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.4 ' CG ' HD13 ' A' ' 18' ' ' LEU . 45.6 tttm -60.25 -41.24 92.77 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.544 -0.722 . . . . 0.0 110.097 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.443 ' HB2' ' H ' ' A' ' 15' ' ' ALA . . . -69.05 -10.93 60.03 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.596 -0.69 . . . . 0.0 110.817 179.591 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -90.27 6.17 44.04 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.122 -0.986 . . . . 0.0 110.634 179.295 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -106.2 -36.94 6.73 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.254 -0.903 . . . . 0.0 109.028 178.792 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.739 HD22 ' HG3' ' A' ' 13' ' ' PRO . 6.8 mp -76.85 -0.08 22.75 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.912 -0.493 . . . . 0.0 111.07 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 19.1 tttm -91.3 -22.83 20.35 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.062 -1.024 . . . . 0.0 110.005 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -84.02 -16.16 44.94 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.475 -0.765 . . . . 0.0 110.522 179.55 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -102.2 -27.57 12.8 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.307 -0.871 . . . . 0.0 109.981 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.544 ' O ' HG22 ' A' ' 73' ' ' ILE . 17.0 t80 -78.05 -51.05 10.92 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.62 -0.675 . . . . 0.0 109.799 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -60.67 -15.53 29.68 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.783 -0.573 . . . . 0.0 111.419 -179.48 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -107.3 -30.47 8.7 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.092 -1.005 . . . . 0.0 110.056 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -86.14 -31.27 21.92 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.559 -0.713 . . . . 0.0 110.488 -179.731 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.544 HG22 ' O ' ' A' ' 69' ' ' TYR . 6.0 tp . . . . . 0 N--CA 1.495 1.793 0 O-C-N 121.539 -0.725 . . . . 0.0 109.993 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo . . . . . 0 N--CA 1.484 0.925 0 N-CA-C 110.27 -0.704 . . . . 0.0 110.27 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.31 -165.98 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.522 -0.736 . . . . 0.0 109.993 179.823 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -70.57 145.8 93.08 Favored Pre-proline 0 N--CA 1.496 1.874 0 O-C-N 121.429 -0.795 . . . . 0.0 110.207 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.438 ' HD3' ' CZ ' ' A' ' 69' ' ' TYR . 47.8 Cg_endo -76.25 128.85 10.8 Favored 'Trans proline' 0 C--N 1.318 -1.04 0 O-C-N 123.342 1.18 . . . . 0.0 109.993 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.589 ' CB ' HD21 ' A' ' 18' ' ' LEU . 49.1 Cg_endo -81.65 -175.82 2.77 Favored 'Trans proline' 0 C--N 1.318 -1.048 0 O-C-N 123.24 1.126 . . . . 0.0 110.181 -179.842 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.558 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 33.6 t -168.74 56.77 0.05 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.53 -0.731 . . . . 0.0 110.628 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.558 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 70.32 -76.92 0.06 Allowed 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.15 -0.969 . . . . 0.0 110.198 -179.515 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -49.19 -49.81 40.98 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.228 -0.92 . . . . 0.0 111.058 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -57.88 -37.72 74.47 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.604 -0.685 . . . . 0.0 109.457 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.773 HD11 ' HB2' ' A' ' 62' ' ' ALA . 56.3 mt -67.06 -45.48 77.24 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.725 -0.609 . . . . 0.0 109.992 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.405 ' HB2' ' CZ3' ' A' ' 47' ' ' TRP . 46.4 t80 -63.58 -50.17 70.5 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.541 -0.724 . . . . 0.0 109.728 179.826 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.9 t -62.87 -29.38 70.71 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 120.05 -0.66 . . . . 0.0 109.597 179.309 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.404 ' HG ' ' HA ' ' A' ' 18' ' ' LEU . 65.4 p -95.26 14.74 21.29 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.627 -0.671 . . . . 0.0 111.034 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -139.51 -5.02 1.41 Allowed 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.137 -0.977 . . . . 0.0 111.965 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -121.19 -29.22 4.56 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.902 -1.124 . . . . 0.0 110.895 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.746 ' HG2' HD11 ' A' ' 43' ' ' LEU . 5.9 mtt180 -47.64 -53.28 31.75 Favored Pre-proline 0 N--CA 1.498 1.944 0 O-C-N 121.284 -0.885 . . . . 0.0 112.491 -179.506 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.533 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 35.3 Cg_endo -58.61 -27.74 83.79 Favored 'Trans proline' 0 N--CA 1.495 1.611 0 O-C-N 123.188 1.099 . . . . 0.0 110.202 -179.594 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -69.23 -45.73 69.11 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 177.505 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.9 mm -60.4 -17.46 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.847 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.533 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 8.2 mmmm -86.89 -27.37 23.46 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.078 -1.014 . . . . 0.0 110.39 -177.931 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 6.6 t -70.11 -14.32 62.6 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.425 -0.797 . . . . 0.0 110.992 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -133.26 2.47 3.57 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.14 -0.975 . . . . 0.0 111.784 -179.551 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.634 ' HB3' HD23 ' A' ' 34' ' ' LEU . 31.5 m80 -142.39 93.46 7.1 Favored Pre-proline 0 N--CA 1.498 1.927 0 O-C-N 121.073 -1.017 . . . . 0.0 109.298 179.029 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -75.0 -33.98 4.18 Favored 'Trans proline' 0 C--N 1.315 -1.204 0 O-C-N 123.52 1.274 . . . . 0.0 110.29 -179.539 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.407 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -72.48 -30.93 63.73 Favored Glycine 0 N--CA 1.487 2.076 0 N-CA-C 109.304 -1.518 . . . . 0.0 109.304 179.686 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.634 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.3 OUTLIER -46.01 90.65 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.76 -0.847 . . . . 0.0 111.925 -179.487 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.407 ' N ' ' O ' ' A' ' 33' ' ' GLY . 22.8 t -88.72 170.94 10.35 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.558 -0.714 . . . . 0.0 109.596 179.728 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.618 ' H ' HD12 ' A' ' 36' ' ' ILE . 3.2 mp -53.12 -24.63 8.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.073 0 O-C-N 121.372 -0.83 . . . . 0.0 110.26 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.3 -66.4 2.62 Favored Glycine 0 N--CA 1.493 2.467 0 N-CA-C 108.958 -1.657 . . . . 0.0 108.958 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.45 ' HA ' ' HG2' ' A' ' 41' ' ' LYS . 6.1 t70 -75.16 -28.29 60.04 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.755 -0.85 . . . . 0.0 110.216 179.486 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.559 ' O ' HD12 ' A' ' 43' ' ' LEU . 88.3 m -68.87 -28.51 66.78 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.573 -0.704 . . . . 0.0 110.347 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -79.6 -25.37 41.51 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.453 -0.78 . . . . 0.0 109.975 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.45 ' HG2' ' HA ' ' A' ' 38' ' ' ASP . 3.3 ptpt -105.17 -11.94 16.33 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.617 -0.677 . . . . 0.0 111.014 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 9.4 tptt -84.77 -10.76 56.9 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.026 -1.046 . . . . 0.0 110.483 179.355 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.746 HD11 ' HG2' ' A' ' 24' ' ' ARG . 28.8 mt -90.16 -31.99 16.83 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.331 -0.856 . . . . 0.0 109.294 179.096 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.53 -32.3 71.3 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 108.717 -1.753 . . . . 0.0 108.717 179.119 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -55.96 -40.05 72.67 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.62 -0.929 . . . . 0.0 110.576 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 9.2 mmt -78.73 -46.09 19.74 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.568 -0.708 . . . . 0.0 110.209 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' TRP . . . . . 0.551 ' CZ2' ' HB1' ' A' ' 15' ' ' ALA . 67.1 t-105 -59.95 -17.3 36.89 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.543 -0.723 . . . . 0.0 111.245 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.6 t -103.48 -37.72 7.47 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.226 -0.921 . . . . 0.0 111.575 -179.095 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -75.12 -32.89 61.51 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.284 -0.885 . . . . 0.0 111.745 -178.843 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.401 ' CB ' ' HB2' ' A' ' 54' ' ' ASP . 13.5 mm-40 -59.27 156.78 11.86 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.21 -0.931 . . . . 0.0 110.919 -179.031 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 77.2 p -77.87 -137.8 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 179.161 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -90.5 36.1 0.89 Allowed 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.854 -1.154 . . . . 0.0 110.795 179.78 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 11.6 mptt -116.11 -35.56 4.35 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.359 -0.838 . . . . 0.0 109.67 179.483 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.401 ' HB2' ' CB ' ' A' ' 50' ' ' GLN . 1.3 t70 -92.92 53.66 2.04 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 108.485 -0.932 . . . . 0.0 108.485 178.399 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.433 ' HG2' ' CE2' ' A' ' 47' ' ' TRP . 0.0 OUTLIER -173.01 -65.18 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 179.696 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.406 ' CB ' ' CD ' ' A' ' 57' ' ' PRO . 2.2 mp0 -40.2 -58.05 2.53 Favored Pre-proline 0 N--CA 1.506 2.346 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -179.253 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.406 ' CD ' ' CB ' ' A' ' 56' ' ' GLN . 42.4 Cg_endo -67.37 -32.38 32.6 Favored 'Trans proline' 0 N--CA 1.488 1.16 0 O-C-N 123.072 1.038 . . . . 0.0 110.833 -179.285 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.53 ' O ' HD12 ' A' ' 18' ' ' LEU . 13.6 m-85 -82.99 -14.18 54.53 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.5 -0.75 . . . . 0.0 110.69 179.578 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.437 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 29.0 mm-40 -77.9 -64.03 1.25 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.348 -0.845 . . . . 0.0 110.132 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -53.05 -23.52 7.84 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.548 -0.72 . . . . 0.0 111.366 -179.486 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 66.4 tttt -63.08 -48.73 77.37 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.465 -0.772 . . . . 0.0 110.13 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.773 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -78.05 -16.31 58.16 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.559 -0.713 . . . . 0.0 110.176 179.187 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.7 -35.08 77.0 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.428 -0.795 . . . . 0.0 110.454 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 67.5 mmtt -74.58 -63.41 1.25 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.322 -0.861 . . . . 0.0 110.102 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.459 ' H ' HD12 ' A' ' 65' ' ' LEU . 4.0 mp -45.59 -26.59 0.62 Allowed 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.599 -0.688 . . . . 0.0 111.882 -179.406 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 32.4 tptt -65.68 -45.08 84.21 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.324 -0.86 . . . . 0.0 109.507 179.175 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -66.17 -55.16 17.73 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.665 -0.647 . . . . 0.0 110.121 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -55.0 -31.49 61.06 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.466 -0.771 . . . . 0.0 110.485 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.545 ' O ' HG22 ' A' ' 73' ' ' ILE . 76.5 t80 -75.92 -68.64 0.56 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.538 -0.726 . . . . 0.0 109.674 179.621 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -48.73 -28.45 3.62 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.687 -0.633 . . . . 0.0 111.284 -179.612 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.2 mmmt -86.22 -57.72 2.91 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.6 -0.687 . . . . 0.0 110.545 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -62.88 -30.92 71.9 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.504 -0.747 . . . . 0.0 110.968 -179.371 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.545 HG22 ' O ' ' A' ' 69' ' ' TYR . 2.7 tp . . . . . 0 N--CA 1.495 1.807 0 O-C-N 121.419 -0.8 . . . . 0.0 110.496 -179.475 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo . . . . . 0 N--CA 1.484 0.935 0 N-CA-C 110.561 -0.592 . . . . 0.0 110.561 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -166.2 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.484 -0.76 . . . . 0.0 110.018 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.72 141.24 92.69 Favored Pre-proline 0 N--CA 1.497 1.913 0 O-C-N 121.509 -0.745 . . . . 0.0 109.938 179.943 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -74.37 132.56 16.46 Favored 'Trans proline' 0 C--N 1.317 -1.099 0 O-C-N 123.309 1.163 . . . . 0.0 109.972 179.786 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.473 ' CB ' HD21 ' A' ' 18' ' ' LEU . 49.5 Cg_endo -81.12 -173.15 1.72 Allowed 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.184 1.097 . . . . 0.0 110.004 -179.737 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.555 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 31.1 t -167.98 59.41 0.07 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.41 -0.806 . . . . 0.0 110.549 -179.898 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.555 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 69.43 -75.76 0.07 Allowed 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.256 -0.902 . . . . 0.0 110.303 -179.527 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -47.3 -52.53 16.05 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.323 -0.861 . . . . 0.0 111.439 -179.388 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -58.1 -39.98 80.01 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.578 -0.701 . . . . 0.0 109.656 179.666 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.477 HD11 ' HB2' ' A' ' 62' ' ' ALA . 51.4 mt -62.32 -45.41 93.33 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.646 -0.659 . . . . 0.0 109.84 179.833 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.497 ' CZ ' ' CE2' ' A' ' 23' ' ' TYR . 43.0 t80 -68.48 -51.62 41.39 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.757 -0.59 . . . . 0.0 110.421 -179.649 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.6 m -56.4 -54.98 39.21 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.523 -0.735 . . . . 0.0 110.813 -179.613 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 88.7 p -57.42 -30.09 64.68 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.466 -0.771 . . . . 0.0 110.856 -179.666 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 -89.95 -23.55 21.52 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.475 -0.766 . . . . 0.0 111.302 -179.29 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.497 ' CE2' ' CZ ' ' A' ' 19' ' ' PHE . 9.0 m-85 -96.02 -34.25 11.83 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.352 -0.842 . . . . 0.0 110.927 -179.423 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.518 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 29.8 mtt-85 -48.28 -53.02 37.72 Favored Pre-proline 0 N--CA 1.498 1.959 0 O-C-N 121.376 -0.828 . . . . 0.0 112.109 -179.881 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.587 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.1 Cg_endo -59.38 -28.61 88.03 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 O-C-N 123.218 1.115 . . . . 0.0 110.155 179.968 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.0 tmtt? -68.89 -45.2 71.54 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 177.918 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 47.4 mm -58.93 -27.4 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.233 179.755 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.587 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.6 mmmm -75.66 -35.23 60.46 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 119.789 -0.765 . . . . 0.0 110.214 -177.53 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 13.4 t -64.94 -21.39 66.82 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.444 -0.785 . . . . 0.0 110.591 179.932 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -121.42 -10.36 8.89 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.307 -0.871 . . . . 0.0 111.415 -179.56 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.716 ' HB3' HD23 ' A' ' 34' ' ' LEU . 41.4 m80 -134.36 94.2 17.98 Favored Pre-proline 0 N--CA 1.497 1.911 0 O-C-N 121.227 -0.92 . . . . 0.0 109.449 179.175 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -74.95 -32.63 5.29 Favored 'Trans proline' 0 C--N 1.315 -1.198 0 O-C-N 123.531 1.28 . . . . 0.0 110.193 -179.679 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.411 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -76.36 -23.11 71.69 Favored Glycine 0 N--CA 1.488 2.118 0 N-CA-C 109.767 -1.333 . . . . 0.0 109.767 179.674 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.716 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.6 OUTLIER -54.78 86.01 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.696 -0.885 . . . . 0.0 111.37 -179.548 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.411 ' N ' ' O ' ' A' ' 33' ' ' GLY . 75.7 m -77.6 172.09 13.92 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.466 -0.771 . . . . 0.0 109.523 179.573 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.2 mm -52.74 -30.02 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.133 0 O-C-N 121.31 -0.868 . . . . 0.0 110.322 -179.934 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.98 -66.64 2.55 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.197 -1.561 . . . . 0.0 109.197 179.7 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.409 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 1.2 m-20 -69.87 -31.41 69.22 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.622 -0.928 . . . . 0.0 110.381 179.639 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 91.1 m -65.26 -31.35 72.46 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.403 -0.81 . . . . 0.0 110.0 179.514 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.89 -42.63 48.55 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.551 -0.718 . . . . 0.0 110.303 179.973 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.4 ' HG2' ' HA ' ' A' ' 38' ' ' ASP . 0.6 OUTLIER -88.2 -12.58 43.41 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.522 -0.736 . . . . 0.0 111.853 -179.284 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.409 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 9.7 tptt -77.73 -58.86 3.04 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 120.941 -1.099 . . . . 0.0 109.869 179.694 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.414 HD22 ' HB3' ' A' ' 23' ' ' TYR . 39.9 mt -48.11 -28.27 2.81 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 121.528 -0.732 . . . . 0.0 111.184 -179.579 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -64.56 -37.58 94.59 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.236 -1.545 . . . . 0.0 109.236 179.6 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -49.42 -34.98 17.81 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.551 -0.97 . . . . 0.0 111.225 -179.639 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 7.9 mmt -89.63 -36.64 15.16 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.578 -0.701 . . . . 0.0 110.112 179.763 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 47' ' ' TRP . . . . . 0.439 ' CZ2' ' HG2' ' A' ' 55' ' ' LYS . 73.6 t-105 -65.27 -12.29 50.06 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.603 -0.686 . . . . 0.0 111.254 -179.596 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 27.8 t -99.94 -42.7 6.67 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.109 -0.994 . . . . 0.0 110.781 -179.684 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -66.13 -29.21 69.47 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.441 -0.787 . . . . 0.0 110.493 -179.696 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -58.37 150.36 22.39 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.506 -0.746 . . . . 0.0 110.309 179.902 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.4 t -94.13 -154.08 0.4 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.612 -0.68 . . . . 0.0 109.684 179.75 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -86.19 52.32 2.46 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.361 -0.837 . . . . 0.0 110.028 179.624 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 22.4 mttp -127.63 -46.89 1.42 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.544 -0.722 . . . . 0.0 110.302 -179.855 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -67.97 -31.32 70.96 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.577 -0.702 . . . . 0.0 111.214 -179.203 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.439 ' HG2' ' CZ2' ' A' ' 47' ' ' TRP . 34.3 mtpt -80.43 -37.64 31.65 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.344 -0.847 . . . . 0.0 111.127 -179.198 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -43.46 -56.12 7.37 Favored Pre-proline 0 N--CA 1.509 2.476 0 O-C-N 121.451 -0.781 . . . . 0.0 112.7 -178.443 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -76.2 -35.92 2.12 Favored 'Trans proline' 0 C--N 1.315 -1.203 0 O-C-N 123.049 1.026 . . . . 0.0 111.417 -179.35 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -82.04 -8.85 59.69 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.39 -0.819 . . . . 0.0 112.132 -178.314 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.07 -23.76 22.46 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.021 -1.049 . . . . 0.0 111.201 -179.193 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -78.98 -20.79 48.27 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.376 -0.828 . . . . 0.0 110.804 -179.823 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 22.1 tttp -60.43 -50.04 75.18 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.365 -0.834 . . . . 0.0 110.301 179.997 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.477 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -77.48 -10.84 59.71 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 119.839 -0.744 . . . . 0.0 110.429 179.493 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.9 -25.73 67.29 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.286 -0.884 . . . . 0.0 109.469 179.277 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -79.57 -64.8 1.1 Allowed 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.835 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.54 ' H ' HD12 ' A' ' 65' ' ' LEU . 2.8 mp -42.07 -20.52 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.279 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 -178.914 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 57.2 tttt -70.39 -32.83 70.64 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.646 -1.284 . . . . 0.0 109.067 178.491 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -85.99 -5.3 59.25 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.703 -0.623 . . . . 0.0 110.751 179.451 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.2 tptt -102.4 -37.77 7.89 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.251 -0.906 . . . . 0.0 108.952 179.234 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.628 ' CZ ' HD13 ' A' ' 73' ' ' ILE . 19.0 t80 -75.7 -56.58 4.55 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 179.149 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -57.22 -20.28 26.21 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.839 -0.538 . . . . 0.0 111.236 -179.674 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.0 mttt -98.9 -23.64 15.26 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.226 -0.921 . . . . 0.0 111.07 -179.379 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -103.3 -31.35 10.1 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.428 -0.795 . . . . 0.0 111.125 -179.216 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.628 HD13 ' CZ ' ' A' ' 69' ' ' TYR . 2.5 tp . . . . . 0 N--CA 1.497 1.88 0 O-C-N 121.43 -0.794 . . . . 0.0 110.539 -179.422 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.429 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 48.0 Cg_endo . . . . . 0 N--CA 1.484 0.948 0 N-CA-C 110.521 -0.607 . . . . 0.0 110.521 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.4 pttm -144.18 31.37 1.24 Allowed 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.646 -0.659 . . . . 0.0 110.451 -179.966 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 43.1 mtt180 -147.17 68.78 11.49 Favored Pre-proline 0 N--CA 1.493 1.711 0 C-N-CA 120.444 -0.502 . . . . 0.0 110.183 -179.807 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -77.31 123.6 6.69 Favored 'Trans proline' 0 C--N 1.316 -1.149 0 O-C-N 123.264 1.139 . . . . 0.0 110.452 -179.932 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.766 ' HG3' HD22 ' A' ' 65' ' ' LEU . 48.2 Cg_endo -81.52 176.44 8.58 Favored 'Trans proline' 0 C--N 1.318 -1.053 0 O-C-N 123.26 1.137 . . . . 0.0 109.835 179.793 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.539 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 52.4 p -167.48 56.54 0.07 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.379 -0.826 . . . . 0.0 111.043 -179.753 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.539 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 68.94 -79.81 0.04 OUTLIER 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.143 -0.973 . . . . 0.0 110.807 -179.905 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -47.36 -51.04 20.77 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.117 -0.989 . . . . 0.0 111.412 -179.33 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -54.97 -27.73 46.14 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.523 -0.735 . . . . 0.0 110.28 179.743 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.68 HD11 ' HB2' ' A' ' 62' ' ' ALA . 21.3 mt -85.17 -24.63 27.84 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.523 -0.735 . . . . 0.0 110.386 -179.925 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.496 ' CE1' ' CE1' ' A' ' 23' ' ' TYR . 80.5 t80 -81.27 -57.45 3.49 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.469 -0.769 . . . . 0.0 110.756 -179.267 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.7 t -60.18 -48.8 80.19 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.502 -0.749 . . . . 0.0 110.403 -179.717 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 30.7 t -57.43 -21.5 37.13 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.636 -0.665 . . . . 0.0 110.881 -179.768 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -107.67 -13.61 15.0 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.35 -0.843 . . . . 0.0 111.442 -179.489 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.507 ' HB3' HD22 ' A' ' 43' ' ' LEU . 2.6 m-85 -94.69 -37.76 11.14 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.173 -0.955 . . . . 0.0 110.602 -179.592 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.527 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 5.9 mtt180 -46.88 -51.77 37.04 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.437 -0.789 . . . . 0.0 112.265 -179.625 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.539 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.5 Cg_endo -60.2 -26.52 82.77 Favored 'Trans proline' 0 N--CA 1.493 1.486 0 O-C-N 123.24 1.126 . . . . 0.0 110.089 179.779 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.0 tmtt? -69.65 -47.37 63.57 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 177.494 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.665 HG13 HD21 ' A' ' 43' ' ' LEU . 46.4 mm -57.97 -18.67 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.607 179.543 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.539 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 7.1 mmmm -85.24 -28.58 25.29 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.189 -0.944 . . . . 0.0 110.293 -177.843 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.1 t -68.55 -18.74 64.41 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.507 -0.745 . . . . 0.0 110.846 -179.979 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -127.59 -1.59 6.14 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.313 -0.867 . . . . 0.0 111.611 -179.598 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.679 ' HB3' HD23 ' A' ' 34' ' ' LEU . 26.7 m80 -140.71 93.58 8.49 Favored Pre-proline 0 N--CA 1.497 1.925 0 O-C-N 121.135 -0.978 . . . . 0.0 109.057 179.035 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -74.68 -37.32 2.32 Favored 'Trans proline' 0 C--N 1.316 -1.155 0 O-C-N 123.511 1.269 . . . . 0.0 110.384 -179.467 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.68 -26.73 73.56 Favored Glycine 0 N--CA 1.488 2.159 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 179.571 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.679 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.3 OUTLIER -48.2 90.87 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.616 -0.932 . . . . 0.0 111.704 -179.501 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.1 p -76.71 -179.67 5.49 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.533 -0.729 . . . . 0.0 109.475 179.595 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.487 ' N ' HD12 ' A' ' 36' ' ' ILE . 2.0 mp -60.54 -33.91 56.29 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 O-C-N 121.37 -0.831 . . . . 0.0 109.297 179.822 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.09 -54.61 36.6 Favored Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.024 -1.631 . . . . 0.0 109.024 179.483 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.6 ' CB ' HD13 ' A' ' 34' ' ' LEU . 23.8 m-20 -73.39 -36.9 66.1 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.763 -0.845 . . . . 0.0 110.031 179.017 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.481 ' O ' HD12 ' A' ' 43' ' ' LEU . 87.9 m -65.3 -25.13 67.49 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.238 -0.914 . . . . 0.0 110.263 179.265 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -84.43 -33.02 23.79 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.418 -0.802 . . . . 0.0 110.328 -179.942 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.429 ' HG2' ' HA ' ' A' ' 38' ' ' ASP . 3.0 ptpt -100.06 -14.7 18.5 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.442 -0.786 . . . . 0.0 111.79 -179.179 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -85.06 -5.21 59.35 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.921 -1.112 . . . . 0.0 110.547 179.338 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.665 HD21 HG13 ' A' ' 27' ' ' ILE . 86.4 mt -96.83 -38.74 9.74 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.283 -0.886 . . . . 0.0 109.237 179.337 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -59.22 -32.76 72.59 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 109.863 -1.295 . . . . 0.0 109.863 -179.943 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -55.36 -37.22 67.21 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.513 -0.992 . . . . 0.0 110.419 -179.992 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 14.3 mtt -76.14 -44.42 38.47 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.621 -0.674 . . . . 0.0 109.598 179.408 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 70.7 t-105 -54.64 -22.69 14.34 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.621 -0.674 . . . . 0.0 110.897 -179.955 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.1 t -88.82 -31.49 18.3 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.282 -0.886 . . . . 0.0 110.117 179.94 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -90.88 -4.8 56.27 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.533 -0.73 . . . . 0.0 110.995 179.674 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.414 ' HB2' ' CB ' ' A' ' 54' ' ' ASP . 4.4 pp0? -59.03 -167.35 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.217 -0.927 . . . . 0.0 110.621 179.928 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.2 t -156.75 -147.07 0.18 Allowed 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 179.897 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.88 -3.82 31.2 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.135 -0.978 . . . . 0.0 111.035 179.684 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.4 mtmt -90.89 -38.78 12.69 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.92 -1.113 . . . . 0.0 110.901 -179.524 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.414 ' CB ' ' HB2' ' A' ' 50' ' ' GLN . 0.8 OUTLIER -87.91 49.87 1.88 Allowed 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.339 -0.851 . . . . 0.0 110.777 -179.366 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.417 ' O ' ' N ' ' A' ' 59' ' ' GLU . 17.6 mtmt -159.82 -59.81 0.06 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.581 -0.699 . . . . 0.0 109.697 178.673 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.407 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 5.0 mm100 -41.15 -52.29 7.29 Favored Pre-proline 0 N--CA 1.506 2.352 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -179.097 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.407 ' HD2' ' N ' ' A' ' 56' ' ' GLN . 52.8 Cg_endo -75.29 -36.03 2.61 Favored 'Trans proline' 0 N--CA 1.489 1.213 0 O-C-N 123.129 1.068 . . . . 0.0 112.182 -179.208 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.409 ' O ' HD12 ' A' ' 18' ' ' LEU . 8.0 m-85 -87.68 -17.85 30.87 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 121.221 -0.925 . . . . 0.0 111.848 -178.611 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.417 ' N ' ' O ' ' A' ' 55' ' ' LYS . 0.2 OUTLIER -85.35 -30.9 23.3 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.25 -0.907 . . . . 0.0 110.018 -179.417 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.412 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 5.7 pt20 -77.71 -24.74 49.11 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.748 -0.595 . . . . 0.0 110.159 179.494 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 73.1 tttt -62.91 -43.1 99.71 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.46 -0.775 . . . . 0.0 109.858 179.728 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.68 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -78.94 -16.38 57.04 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.515 -0.741 . . . . 0.0 109.943 178.987 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.412 ' HB3' ' O ' ' A' ' 60' ' ' GLN . . . -58.25 -42.75 87.08 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.404 -0.81 . . . . 0.0 110.449 179.954 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -70.08 -62.27 1.45 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.306 -0.871 . . . . 0.0 110.055 -179.989 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.766 HD22 ' HG3' ' A' ' 13' ' ' PRO . 4.3 mp -45.69 -27.15 0.75 Allowed 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.688 -0.632 . . . . 0.0 111.815 -179.419 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.1 tptt -64.25 -51.85 61.56 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.42 -0.8 . . . . 0.0 109.421 179.142 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -60.82 -52.0 66.94 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.647 -0.658 . . . . 0.0 109.846 179.499 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 69.5 mttt -56.19 -26.11 49.5 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.527 -0.733 . . . . 0.0 110.536 179.926 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.495 ' O ' HG22 ' A' ' 73' ' ' ILE . 32.8 t80 -81.92 -63.37 1.4 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.396 -0.815 . . . . 0.0 109.538 179.468 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.435 ' C ' HG22 ' A' ' 73' ' ' ILE . 9.6 mt-10 -55.21 -23.87 24.36 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.475 -0.766 . . . . 0.0 110.682 179.718 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 25.3 ttmt -89.42 -59.86 2.1 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.452 -0.78 . . . . 0.0 110.426 -179.924 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -56.28 -23.09 34.29 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.529 -0.732 . . . . 0.0 111.084 -179.403 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.495 HG22 ' O ' ' A' ' 69' ' ' TYR . 7.1 tp . . . . . 0 N--CA 1.496 1.858 0 O-C-N 121.342 -0.849 . . . . 0.0 109.88 179.764 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo . . . . . 0 N--CA 1.485 0.978 0 N-CA-C 110.286 -0.698 . . . . 0.0 110.286 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.53 -164.78 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.631 -0.668 . . . . 0.0 110.438 -179.779 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.4 mpt_? -60.6 142.27 91.5 Favored Pre-proline 0 N--CA 1.496 1.854 0 O-C-N 121.618 -0.677 . . . . 0.0 110.124 -179.989 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -75.13 131.55 14.28 Favored 'Trans proline' 0 C--N 1.318 -1.076 0 O-C-N 123.324 1.171 . . . . 0.0 110.053 179.876 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.626 ' CB ' HD21 ' A' ' 18' ' ' LEU . 48.7 Cg_endo -81.72 -177.08 3.36 Favored 'Trans proline' 0 C--N 1.318 -1.075 0 O-C-N 123.195 1.103 . . . . 0.0 110.21 -179.815 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.534 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 24.7 t -166.31 65.2 0.1 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.513 -0.742 . . . . 0.0 110.527 -179.846 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.534 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 66.91 -76.59 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.057 -1.027 . . . . 0.0 110.043 -179.388 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -48.8 -46.81 42.23 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.354 -0.841 . . . . 0.0 111.274 -179.812 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -60.38 -32.75 71.6 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.597 -0.689 . . . . 0.0 110.118 179.784 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.626 HD21 ' CB ' ' A' ' 13' ' ' PRO . 22.2 mt -79.4 -30.43 42.42 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.571 -0.706 . . . . 0.0 110.433 -179.496 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.498 ' CE2' ' CE1' ' A' ' 23' ' ' TYR . 31.0 t80 -77.41 -54.43 6.45 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.562 -0.711 . . . . 0.0 110.685 -179.392 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.716 ' SG ' HD13 ' A' ' 43' ' ' LEU . 45.3 t -57.91 -50.38 73.53 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.578 -0.702 . . . . 0.0 110.675 -179.539 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 99.5 p -59.01 -24.48 62.83 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.553 -0.717 . . . . 0.0 110.944 -179.688 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -99.36 -25.62 14.41 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.398 -0.813 . . . . 0.0 111.305 -179.251 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.498 ' CE1' ' CE2' ' A' ' 19' ' ' PHE . 4.6 m-85 -86.5 -34.41 20.03 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.345 -0.847 . . . . 0.0 111.123 -179.281 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.479 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 4.0 mtt180 -46.6 -54.45 18.95 Favored Pre-proline 0 N--CA 1.499 1.995 0 O-C-N 121.384 -0.823 . . . . 0.0 112.251 -179.59 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.55 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 37.0 Cg_endo -61.09 -25.73 81.65 Favored 'Trans proline' 0 N--CA 1.494 1.507 0 O-C-N 123.305 1.161 . . . . 0.0 110.194 179.895 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -69.87 -46.6 65.16 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.179 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 35.9 mm -57.67 -29.61 35.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 CA-C-O 121.171 0.51 . . . . 0.0 110.402 179.873 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.55 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.5 mmmm -74.04 -36.28 64.39 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 120.01 -0.676 . . . . 0.0 110.204 -177.068 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.4 t -67.51 -19.15 65.28 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.458 -0.776 . . . . 0.0 110.48 179.7 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -118.65 -12.28 9.75 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.333 -0.854 . . . . 0.0 111.356 -179.628 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.684 ' HB3' HD23 ' A' ' 34' ' ' LEU . 42.3 m80 -133.54 94.25 19.86 Favored Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 121.152 -0.967 . . . . 0.0 109.737 179.515 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -75.65 -33.73 3.78 Favored 'Trans proline' 0 C--N 1.316 -1.155 0 O-C-N 123.592 1.312 . . . . 0.0 110.109 -179.841 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.43 -21.15 75.88 Favored Glycine 0 N--CA 1.489 2.198 0 N-CA-C 109.845 -1.302 . . . . 0.0 109.845 179.643 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.684 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.2 OUTLIER -50.18 91.11 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.497 -1.002 . . . . 0.0 111.373 -179.691 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 50.6 p -77.35 165.49 24.38 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.53 -0.731 . . . . 0.0 109.757 179.707 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.584 ' H ' HD12 ' A' ' 36' ' ' ILE . 2.4 mp -52.12 -27.38 9.62 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 O-C-N 121.432 -0.793 . . . . 0.0 110.171 -179.953 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.15 -61.44 6.65 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.054 -1.618 . . . . 0.0 109.054 179.607 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.445 ' HA ' ' HB2' ' A' ' 41' ' ' LYS . 32.8 t0 -76.86 -25.26 52.91 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.735 -0.862 . . . . 0.0 110.584 179.865 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.623 ' HA ' HD12 ' A' ' 34' ' ' LEU . 49.3 m -52.93 -45.55 67.7 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 120.867 -1.146 . . . . 0.0 110.072 179.451 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.637 ' HA ' HD12 ' A' ' 43' ' ' LEU . . . -76.15 -44.04 40.08 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 178.475 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.445 ' HB2' ' HA ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -57.74 -30.3 65.46 Favored 'General case' 0 N--CA 1.497 1.924 0 CA-C-O 121.378 0.609 . . . . 0.0 110.034 179.272 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.422 ' N ' ' O ' ' A' ' 38' ' ' ASP . 2.7 tptt -88.19 -3.02 58.93 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.636 -0.665 . . . . 0.0 110.964 -179.583 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.716 HD13 ' SG ' ' A' ' 20' ' ' CYS . 9.9 mt -90.17 -42.79 10.85 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.261 -0.9 . . . . 0.0 109.064 179.322 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -70.7 -32.24 67.25 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 108.762 -1.735 . . . . 0.0 108.762 179.264 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -58.58 -54.28 48.84 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.65 -0.912 . . . . 0.0 109.835 179.522 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 58.4 mtt -65.86 -54.59 24.69 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.643 -0.661 . . . . 0.0 109.438 179.206 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 68.2 t-105 -51.21 -56.45 12.78 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.605 -0.684 . . . . 0.0 110.787 -179.858 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 35.1 t -61.41 -34.34 75.2 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.436 -0.79 . . . . 0.0 110.252 -179.972 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -61.71 -39.84 92.92 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.578 -0.701 . . . . 0.0 110.114 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 31.4 mm-40 -57.97 155.69 10.38 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.62 -0.675 . . . . 0.0 110.614 -179.906 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.0 t -92.75 -149.58 0.26 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.69 -0.631 . . . . 0.0 109.41 179.527 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.04 50.33 1.99 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.211 -0.931 . . . . 0.0 110.312 179.726 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.59 -42.91 1.28 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.445 -0.784 . . . . 0.0 110.044 179.944 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -60.08 -29.79 68.8 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.454 -0.779 . . . . 0.0 110.584 -179.671 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 44.2 tttt -95.3 22.7 6.55 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.283 -0.886 . . . . 0.0 111.214 -179.368 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.436 ' HB2' ' HD3' ' A' ' 57' ' ' PRO . 10.0 mp0 -100.36 -61.09 0.1 OUTLIER Pre-proline 0 N--CA 1.497 1.876 0 O-C-N 121.349 -0.844 . . . . 0.0 111.047 179.683 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.436 ' HD3' ' HB2' ' A' ' 56' ' ' GLN . 55.5 Cg_endo -76.96 -36.76 1.33 Allowed 'Trans proline' 0 N--CA 1.485 0.987 0 O-C-N 122.618 0.799 . . . . 0.0 110.7 179.884 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -79.79 3.6 19.02 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.407 -0.808 . . . . 0.0 111.916 -178.929 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.416 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -98.31 -18.86 18.12 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.075 -1.016 . . . . 0.0 110.882 179.983 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -77.64 -24.39 49.5 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.286 -0.884 . . . . 0.0 110.363 179.817 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.441 ' HD3' HD13 ' A' ' 18' ' ' LEU . 55.0 tttt -59.82 -40.02 87.04 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.462 -0.774 . . . . 0.0 109.718 179.456 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.401 ' CB ' ' HA ' ' A' ' 14' ' ' SER . . . -69.42 -10.71 59.2 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.626 -0.671 . . . . 0.0 110.537 179.312 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.85 6.78 33.78 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.163 -0.961 . . . . 0.0 110.439 179.218 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 38.1 mmtt -105.78 -35.04 7.48 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.255 -0.903 . . . . 0.0 109.078 178.86 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.1 mp -78.38 -0.0 27.38 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.936 -0.478 . . . . 0.0 110.888 179.44 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 59.5 tttt -89.3 -26.16 21.28 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.168 -0.958 . . . . 0.0 109.805 179.292 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -83.27 -15.77 48.96 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.573 -0.704 . . . . 0.0 110.478 179.425 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 32.8 mtpt -101.48 -27.17 13.27 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.307 -0.87 . . . . 0.0 109.992 179.688 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.442 ' O ' HG22 ' A' ' 73' ' ' ILE . 23.0 t80 -77.68 -51.47 10.55 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.557 -0.714 . . . . 0.0 109.642 179.627 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -70.51 -6.82 38.95 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.685 -0.634 . . . . 0.0 111.589 -179.632 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 47.8 mttt -110.66 -33.9 6.43 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.077 -1.014 . . . . 0.0 110.174 179.868 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -87.34 -29.88 21.23 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.556 -0.715 . . . . 0.0 110.833 -179.47 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.442 HG22 ' O ' ' A' ' 69' ' ' TYR . 3.2 tp . . . . . 0 N--CA 1.498 1.927 0 O-C-N 121.401 -0.812 . . . . 0.0 110.436 -179.69 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo . . . . . 0 N--CA 1.484 0.939 0 N-CA-C 110.628 -0.566 . . . . 0.0 110.628 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.56 -163.08 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.803 -0.56 . . . . 0.0 110.302 -179.821 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 7.1 mpt_? -55.22 154.62 10.62 Favored Pre-proline 0 N--CA 1.5 2.045 0 O-C-N 121.37 -0.831 . . . . 0.0 110.768 -179.889 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -73.74 121.9 7.38 Favored 'Trans proline' 0 C--N 1.317 -1.122 0 O-C-N 123.541 1.285 . . . . 0.0 110.01 179.795 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.76 ' HB2' HD21 ' A' ' 18' ' ' LEU . 47.8 Cg_endo -82.23 162.48 17.62 Favored 'Trans proline' 0 C--N 1.317 -1.099 0 O-C-N 123.208 1.11 . . . . 0.0 110.353 -179.614 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.535 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 0.9 OUTLIER -162.75 65.76 0.21 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.554 -0.716 . . . . 0.0 110.223 -179.758 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.535 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 66.83 -76.58 0.05 OUTLIER 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.171 -0.956 . . . . 0.0 109.926 -179.35 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.439 ' CD1' ' CD1' ' A' ' 47' ' ' TRP . 11.7 t80 -51.64 -42.16 61.85 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.206 -0.934 . . . . 0.0 110.807 179.878 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -65.16 -26.34 68.13 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 120.085 -0.646 . . . . 0.0 109.824 179.716 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.76 HD21 ' HB2' ' A' ' 13' ' ' PRO . 35.9 mt -84.03 -39.2 19.92 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.5 -0.75 . . . . 0.0 110.064 -179.736 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -67.16 -49.77 63.56 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.557 -0.715 . . . . 0.0 110.223 -179.862 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 9.0 t -67.2 -28.29 67.96 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.62 -0.675 . . . . 0.0 109.964 179.561 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 42.0 t -87.57 4.23 44.46 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.491 -0.756 . . . . 0.0 111.632 -179.415 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 50.8 mm-40 -141.51 2.58 1.64 Allowed 'General case' 0 N--CA 1.499 1.997 0 O-C-N 120.974 -1.079 . . . . 0.0 112.367 -179.568 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 33.9 m-85 -122.27 22.2 10.17 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 120.826 -1.171 . . . . 0.0 111.129 -179.671 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.507 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 15.3 mtp180 -87.82 -45.49 0.49 Allowed Pre-proline 0 N--CA 1.489 1.49 0 O-C-N 121.361 -0.837 . . . . 0.0 112.403 179.815 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.582 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.4 Cg_endo -66.83 -14.68 44.71 Favored 'Trans proline' 0 N--CA 1.492 1.393 0 O-C-N 122.917 0.956 . . . . 0.0 110.686 -179.035 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -74.25 -52.58 11.92 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 177.837 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 30.2 mm -52.46 -31.26 15.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 CA-C-O 121.297 0.57 . . . . 0.0 110.454 179.649 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.582 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.9 mmmm -72.54 -33.45 66.84 Favored 'General case' 0 N--CA 1.496 1.855 0 C-N-CA 120.123 -0.631 . . . . 0.0 110.176 -177.303 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.7 t -62.03 -25.98 67.98 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.589 -0.694 . . . . 0.0 110.508 -179.922 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -115.7 -24.55 8.19 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.551 -0.718 . . . . 0.0 110.79 -179.669 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.768 ' HB3' HD23 ' A' ' 34' ' ' LEU . 38.3 m80 -119.3 96.75 50.13 Favored Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.476 -0.765 . . . . 0.0 109.543 -179.889 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -75.33 -28.79 8.36 Favored 'Trans proline' 0 C--N 1.313 -1.293 0 O-C-N 123.444 1.234 . . . . 0.0 110.49 -179.813 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -83.88 -13.94 73.81 Favored Glycine 0 N--CA 1.488 2.129 0 N-CA-C 110.506 -1.037 . . . . 0.0 110.506 -179.947 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.768 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -61.71 79.56 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.413 -1.051 . . . . 0.0 111.273 -179.333 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.404 ' N ' ' O ' ' A' ' 33' ' ' GLY . 79.5 p -69.48 174.79 4.55 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.394 -0.816 . . . . 0.0 109.581 179.847 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 40.3 mm -54.33 -29.9 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 O-C-N 121.308 -0.87 . . . . 0.0 110.15 179.895 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.7 -65.91 3.1 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 179.906 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.463 ' HB3' HD13 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -69.83 -29.72 67.05 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.622 -0.928 . . . . 0.0 110.757 179.857 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 73.7 m -64.65 -31.0 72.02 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.393 -0.817 . . . . 0.0 110.133 179.707 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.38 -43.78 48.41 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.584 -0.698 . . . . 0.0 110.158 -179.983 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.23 -12.06 47.87 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.596 -0.69 . . . . 0.0 111.822 -179.403 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 9.4 tptt -77.59 -59.64 2.7 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.987 -1.071 . . . . 0.0 109.797 179.529 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 43.8 mt -48.95 -26.08 2.3 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.413 -0.805 . . . . 0.0 111.336 -179.729 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.1 -37.87 82.79 Favored Glycine 0 N--CA 1.492 2.425 0 N-CA-C 109.277 -1.529 . . . . 0.0 109.277 179.673 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -50.9 -35.04 30.94 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.462 -1.022 . . . . 0.0 110.919 -179.839 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 22.8 mmt -81.84 -42.85 19.05 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.66 -0.65 . . . . 0.0 109.591 179.587 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 47' ' ' TRP . . . . . 0.439 ' CD1' ' CD1' ' A' ' 16' ' ' PHE . 45.4 t-105 -51.86 -52.66 47.93 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.526 -0.734 . . . . 0.0 110.788 -179.862 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.9 t -68.17 -32.1 72.11 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.381 -0.824 . . . . 0.0 110.506 -179.572 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -58.68 -38.84 79.1 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.516 -0.74 . . . . 0.0 110.252 -179.86 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -73.63 172.09 12.04 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.514 -0.741 . . . . 0.0 109.944 179.668 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 88.6 p -164.17 110.86 1.07 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.486 -0.758 . . . . 0.0 110.507 -179.918 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 51.6 35.34 14.49 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.429 -0.794 . . . . 0.0 111.054 179.611 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 70.8 mttt -135.39 -73.51 0.46 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.547 -0.721 . . . . 0.0 110.302 179.961 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -66.87 -20.67 65.96 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.511 -0.743 . . . . 0.0 110.687 -179.937 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.437 ' HG2' ' CH2' ' A' ' 47' ' ' TRP . 50.3 mttt -82.99 -35.27 26.0 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.368 -0.833 . . . . 0.0 110.678 -179.763 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -45.78 -51.55 29.26 Favored Pre-proline 0 N--CA 1.507 2.395 0 O-C-N 121.569 -0.707 . . . . 0.0 111.759 -179.176 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -79.09 -39.29 0.35 Allowed 'Trans proline' 0 C--N 1.314 -1.239 0 O-C-N 123.186 1.098 . . . . 0.0 110.747 179.889 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -81.51 4.68 20.38 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.605 -0.684 . . . . 0.0 112.104 -178.657 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.84 -20.35 17.56 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 120.996 -1.065 . . . . 0.0 110.358 179.387 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -77.72 -26.35 49.97 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.442 -0.786 . . . . 0.0 110.085 179.598 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 50.4 tttt -61.89 -40.38 95.24 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.571 -0.706 . . . . 0.0 110.092 179.855 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.636 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -79.34 -14.0 59.27 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.482 -0.761 . . . . 0.0 110.539 179.606 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -81.16 0.34 36.84 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.313 -0.867 . . . . 0.0 110.299 179.159 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 24.0 mmtp -105.72 -29.81 9.84 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.164 -0.96 . . . . 0.0 109.93 179.4 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.9 mp -87.15 -2.47 58.65 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.882 -0.511 . . . . 0.0 110.361 178.834 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.5 tptt -83.98 -35.64 23.79 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.299 -0.876 . . . . 0.0 108.771 178.916 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -66.95 -59.57 3.38 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 119.939 -0.704 . . . . 0.0 109.324 179.323 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -58.85 -20.3 49.56 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.607 -0.683 . . . . 0.0 111.02 -179.888 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.462 ' O ' HG22 ' A' ' 73' ' ' ILE . 32.6 t80 -77.5 -61.25 2.05 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.158 -0.964 . . . . 0.0 109.579 179.471 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -64.2 -12.49 41.03 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.613 -0.679 . . . . 0.0 111.334 -179.955 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.1 mmtm -102.49 -29.31 11.67 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.131 -0.981 . . . . 0.0 110.516 -179.949 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -99.78 -26.96 13.87 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.528 -0.732 . . . . 0.0 110.95 -179.612 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.462 HG22 ' O ' ' A' ' 69' ' ' TYR . 4.3 tp . . . . . 0 N--CA 1.497 1.886 0 O-C-N 121.276 -0.89 . . . . 0.0 109.907 179.891 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo . . . . . 0 N--CA 1.481 0.776 0 N-CA-C 110.123 -0.761 . . . . 0.0 110.123 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.35 -166.43 0.09 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.616 -0.678 . . . . 0.0 110.326 -179.706 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -58.37 146.34 72.06 Favored Pre-proline 0 N--CA 1.497 1.883 0 O-C-N 121.551 -0.718 . . . . 0.0 110.408 -179.92 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -74.35 125.3 9.57 Favored 'Trans proline' 0 C--N 1.317 -1.113 0 O-C-N 123.433 1.228 . . . . 0.0 110.009 179.783 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.729 ' HB2' HD21 ' A' ' 18' ' ' LEU . 49.4 Cg_endo -82.21 174.81 9.67 Favored 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.232 1.122 . . . . 0.0 110.181 -179.731 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.535 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 0.6 OUTLIER -169.59 69.07 0.06 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.556 -0.715 . . . . 0.0 110.495 -179.956 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.535 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 67.11 -77.64 0.04 OUTLIER 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.045 -1.035 . . . . 0.0 110.574 -179.794 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -47.79 -47.87 30.69 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.237 -0.914 . . . . 0.0 111.508 -179.34 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -61.83 -29.92 70.49 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.621 -0.674 . . . . 0.0 109.87 179.812 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.729 HD21 ' HB2' ' A' ' 13' ' ' PRO . 18.2 mt -83.16 -29.9 28.26 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.479 -0.763 . . . . 0.0 109.989 -179.82 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.498 ' CE2' ' CE1' ' A' ' 23' ' ' TYR . 55.8 t80 -77.56 -54.58 6.24 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.542 -0.724 . . . . 0.0 110.481 -179.463 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.444 ' SG ' HD13 ' A' ' 43' ' ' LEU . 7.7 t -58.43 -50.93 71.93 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.535 -0.728 . . . . 0.0 110.646 -179.704 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.1 t -58.23 -21.67 48.95 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.518 -0.739 . . . . 0.0 110.916 -179.798 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -101.63 -23.63 14.23 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.343 -0.848 . . . . 0.0 111.003 -179.662 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.498 ' CE1' ' CE2' ' A' ' 19' ' ' PHE . 2.4 m-85 -86.7 -33.87 19.9 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.479 -0.763 . . . . 0.0 110.681 -179.61 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.53 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 4.4 mtt-85 -48.35 -52.23 44.46 Favored Pre-proline 0 N--CA 1.498 1.93 0 O-C-N 121.318 -0.864 . . . . 0.0 111.85 179.903 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.571 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.2 Cg_endo -60.28 -27.9 85.8 Favored 'Trans proline' 0 N--CA 1.492 1.431 0 O-C-N 123.218 1.115 . . . . 0.0 109.933 179.797 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.8 tmtm? -69.64 -46.64 65.73 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 177.872 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.601 HG13 HD21 ' A' ' 43' ' ' LEU . 44.5 mm -56.42 -31.2 32.76 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.032 179.711 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.571 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 4.7 mmmm -72.95 -37.58 67.07 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 120.079 -0.649 . . . . 0.0 110.449 -177.552 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.4 t -60.56 -24.43 65.4 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.501 -0.749 . . . . 0.0 110.649 -179.633 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -117.62 -17.03 10.04 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.49 -0.756 . . . . 0.0 111.158 -179.625 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.716 ' HB3' HD23 ' A' ' 34' ' ' LEU . 39.8 m80 -127.77 95.15 35.54 Favored Pre-proline 0 N--CA 1.496 1.865 0 O-C-N 121.297 -0.877 . . . . 0.0 109.528 179.736 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -75.1 -36.14 2.66 Favored 'Trans proline' 0 C--N 1.315 -1.197 0 O-C-N 123.54 1.284 . . . . 0.0 110.307 -179.736 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.402 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -75.58 -18.46 79.77 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 179.771 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.824 HD13 ' HB3' ' A' ' 38' ' ' ASP . 0.3 OUTLIER -53.79 88.14 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.465 -1.021 . . . . 0.0 111.375 -179.507 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.402 ' N ' ' O ' ' A' ' 33' ' ' GLY . 45.2 t -70.88 175.91 4.7 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.517 -0.739 . . . . 0.0 109.741 179.722 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.463 ' N ' HD12 ' A' ' 36' ' ' ILE . 2.1 mp -59.64 -34.23 54.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.306 -0.871 . . . . 0.0 109.513 179.953 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.13 -58.83 12.53 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 109.104 -1.598 . . . . 0.0 109.104 179.63 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.824 ' HB3' HD13 ' A' ' 34' ' ' LEU . 6.5 t70 -70.21 -37.76 75.13 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.742 -0.858 . . . . 0.0 110.063 179.107 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.9 m -61.78 -31.08 71.26 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.159 -0.963 . . . . 0.0 110.107 179.268 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.94 -43.03 46.84 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.568 -0.708 . . . . 0.0 110.398 -179.845 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.42 ' HG2' ' HA ' ' A' ' 38' ' ' ASP . 2.3 ptpt -89.44 -12.97 38.69 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.595 -0.691 . . . . 0.0 111.979 -178.925 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.472 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -88.98 5.7 42.98 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 120.892 -1.13 . . . . 0.0 110.602 179.721 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.601 HD21 HG13 ' A' ' 27' ' ' ILE . 91.0 mt -107.92 -31.23 8.08 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.133 -0.979 . . . . 0.0 109.546 179.486 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.56 -31.9 82.34 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -61.76 -53.84 50.51 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.564 -0.963 . . . . 0.0 109.895 179.918 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 23.6 mtt -64.19 -23.55 67.36 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.589 -0.694 . . . . 0.0 110.345 179.803 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 77.0 t-105 -78.08 -38.92 43.12 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.46 -0.775 . . . . 0.0 110.121 179.794 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.9 m -80.14 -25.07 40.01 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.514 -0.741 . . . . 0.0 110.58 -179.899 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -70.21 -43.86 69.8 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.42 -0.8 . . . . 0.0 109.774 179.72 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 16.3 mm-40 -56.27 154.39 8.14 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.514 -0.742 . . . . 0.0 110.579 -179.92 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.4 m -93.52 -149.76 0.27 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.653 -0.654 . . . . 0.0 109.571 179.698 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -92.26 41.81 1.08 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.262 -0.899 . . . . 0.0 110.259 179.685 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -119.46 -49.06 2.38 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.529 -0.732 . . . . 0.0 110.109 179.899 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -61.62 -27.5 68.7 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.584 -0.698 . . . . 0.0 110.533 -179.831 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.8 ttpt -82.92 -34.38 26.61 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.434 -0.791 . . . . 0.0 110.638 -179.747 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -43.33 -53.09 11.84 Favored Pre-proline 0 N--CA 1.507 2.407 0 O-C-N 121.472 -0.768 . . . . 0.0 112.317 -178.861 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -79.12 -36.44 0.71 Allowed 'Trans proline' 0 C--N 1.315 -1.19 0 O-C-N 123.14 1.074 . . . . 0.0 111.273 179.999 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -85.21 0.02 53.16 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.454 -0.779 . . . . 0.0 112.319 -178.065 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.84 -25.41 15.04 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 120.938 -1.101 . . . . 0.0 110.699 -179.384 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.462 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 3.9 pt20 -73.99 -21.56 59.95 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.468 -0.77 . . . . 0.0 110.644 179.94 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.428 ' CG ' HD13 ' A' ' 18' ' ' LEU . 31.7 tttt -60.32 -43.11 96.67 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.49 -0.756 . . . . 0.0 110.233 179.877 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.23 -12.32 59.93 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.4 -0.813 . . . . 0.0 110.131 179.153 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' A' ' 60' ' ' GLN . . . -58.38 -38.99 78.42 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.244 -0.91 . . . . 0.0 109.229 179.223 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.6 ttpt -67.52 -61.47 1.88 Allowed 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 178.513 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.57 HD22 ' HG3' ' A' ' 13' ' ' PRO . 0.7 OUTLIER -44.74 -23.63 0.14 Allowed 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.798 -0.564 . . . . 0.0 112.328 -179.582 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 58.9 tttt -71.89 -44.43 63.76 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.256 -0.902 . . . . 0.0 108.658 178.241 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -82.26 -9.93 59.31 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.738 -0.601 . . . . 0.0 110.058 178.597 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.94 -32.56 11.6 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.309 -0.869 . . . . 0.0 109.153 179.267 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.463 ' O ' HG22 ' A' ' 73' ' ' ILE . 58.8 t80 -77.28 -51.13 11.42 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.131 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -70.91 -8.31 51.99 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.606 -0.684 . . . . 0.0 111.113 179.837 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.7 ttmm -108.87 -34.35 6.67 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.063 -1.023 . . . . 0.0 110.596 -179.907 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -82.24 -31.11 30.36 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.466 -0.772 . . . . 0.0 110.502 -179.853 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.463 HG22 ' O ' ' A' ' 69' ' ' TYR . 4.4 tp . . . . . 0 N--CA 1.496 1.863 0 O-C-N 121.517 -0.739 . . . . 0.0 110.447 179.964 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo . . . . . 0 N--CA 1.486 1.033 0 N-CA-C 110.722 -0.53 . . . . 0.0 110.722 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.7 pttt -59.47 -160.38 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.644 -0.66 . . . . 0.0 110.452 -179.724 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -57.05 149.35 45.96 Favored Pre-proline 0 N--CA 1.499 1.995 0 O-C-N 121.282 -0.886 . . . . 0.0 110.786 -179.884 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.408 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.6 Cg_endo -76.41 124.37 7.68 Favored 'Trans proline' 0 C--N 1.317 -1.114 0 O-C-N 123.455 1.24 . . . . 0.0 109.651 179.31 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.513 ' C ' ' HB1' ' A' ' 62' ' ' ALA . 47.6 Cg_endo -81.2 177.08 8.17 Favored 'Trans proline' 0 C--N 1.316 -1.139 0 O-C-N 123.261 1.137 . . . . 0.0 110.158 -179.644 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.566 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 8.9 t -167.77 60.13 0.07 Allowed 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.458 -0.776 . . . . 0.0 110.684 -179.766 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.593 ' HB2' ' HA ' ' A' ' 59' ' ' GLU . . . 70.14 -74.79 0.08 Allowed 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.199 -0.938 . . . . 0.0 110.1 -179.469 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -48.76 -50.42 33.97 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.347 -0.846 . . . . 0.0 111.241 -179.643 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -58.91 -40.96 86.11 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.593 -0.692 . . . . 0.0 109.477 179.431 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.743 HD11 ' HB2' ' A' ' 62' ' ' ALA . 53.2 mt -61.67 -46.61 89.01 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.681 -0.637 . . . . 0.0 109.884 179.732 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.499 ' CE2' ' CE2' ' A' ' 23' ' ' TYR . 23.6 t80 -65.88 -50.43 64.56 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.715 -0.616 . . . . 0.0 110.252 -179.891 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.3 m -65.71 -29.1 69.59 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.673 -0.642 . . . . 0.0 110.057 179.981 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.7 m -67.85 -23.68 65.18 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.559 -0.713 . . . . 0.0 110.75 -179.749 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -110.2 -27.76 8.97 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.38 -0.825 . . . . 0.0 111.42 -179.104 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.499 ' CE2' ' CE2' ' A' ' 19' ' ' PHE . 7.2 m-85 -81.6 -37.23 27.96 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.18 -0.95 . . . . 0.0 110.849 -179.238 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.534 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 11.2 mtt85 -48.76 -51.75 51.27 Favored Pre-proline 0 N--CA 1.495 1.802 0 O-C-N 121.305 -0.872 . . . . 0.0 111.823 -179.974 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.534 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 36.0 Cg_endo -59.71 -27.62 85.39 Favored 'Trans proline' 0 N--CA 1.492 1.421 0 O-C-N 123.137 1.072 . . . . 0.0 109.821 179.455 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.88 -48.09 48.23 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 177.349 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.643 HG13 HD21 ' A' ' 43' ' ' LEU . 41.6 mm -54.71 -33.02 26.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.479 179.826 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.553 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER -68.23 -31.26 70.63 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.569 -0.707 . . . . 0.0 110.399 -177.579 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.9 t -82.11 -17.86 45.02 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.505 -0.747 . . . . 0.0 111.195 -179.853 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -114.72 -15.94 11.85 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.179 -0.951 . . . . 0.0 111.362 -179.485 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.567 ' HB3' ' CB ' ' A' ' 34' ' ' LEU . 25.0 m80 -117.26 91.92 38.43 Favored Pre-proline 0 N--CA 1.499 1.977 0 O-C-N 121.27 -0.894 . . . . 0.0 109.634 -179.702 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -77.43 -71.74 0.01 OUTLIER 'Trans proline' 0 N--CA 1.484 0.969 0 O-C-N 123.378 1.199 . . . . 0.0 111.689 -179.199 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -56.26 -21.93 34.89 Favored Glycine 0 N--CA 1.499 2.867 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 -179.752 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.786 ' O ' HD23 ' A' ' 34' ' ' LEU . 7.8 tt -53.41 92.85 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.48 -1.012 . . . . 0.0 110.845 179.506 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 18.8 m -57.7 175.53 0.18 Allowed 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.461 -0.774 . . . . 0.0 110.116 -179.386 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.414 HD13 ' HA ' ' A' ' 36' ' ' ILE . 14.7 mm -56.19 -61.32 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 O-C-N 121.351 -0.843 . . . . 0.0 110.312 -179.897 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.444 ' O ' ' HE2' ' A' ' 41' ' ' LYS . . . -48.59 -38.19 21.15 Favored Glycine 0 N--CA 1.497 2.701 0 N-CA-C 110.319 -1.112 . . . . 0.0 110.319 -179.12 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.42 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 33.4 m-20 -65.39 -36.5 84.15 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.558 -0.966 . . . . 0.0 109.737 178.755 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.599 ' CA ' HD21 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -60.95 -36.43 79.36 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.571 -0.705 . . . . 0.0 110.678 179.743 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.98 -49.64 17.12 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.526 -0.734 . . . . 0.0 110.242 -179.713 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.444 ' HE2' ' O ' ' A' ' 37' ' ' GLY . 0.9 OUTLIER -74.71 -13.41 60.61 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.602 -0.686 . . . . 0.0 111.294 -179.621 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.42 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 5.4 tptt -84.63 -59.73 2.28 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 120.933 -1.104 . . . . 0.0 109.836 179.339 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.643 HD21 HG13 ' A' ' 27' ' ' ILE . 16.3 mt -49.15 -29.25 5.17 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.541 -0.724 . . . . 0.0 111.043 -179.819 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.27 -38.58 96.69 Favored Glycine 0 N--CA 1.493 2.444 0 N-CA-C 109.425 -1.47 . . . . 0.0 109.425 179.934 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -50.56 -33.89 23.57 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.445 -1.032 . . . . 0.0 111.041 -179.708 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 31.9 mtt -86.69 -41.31 14.29 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.536 -0.728 . . . . 0.0 110.495 -179.793 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 72.3 t-105 -55.55 -21.21 16.05 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.502 -0.749 . . . . 0.0 111.136 -179.421 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.6 t -93.01 -33.46 14.12 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.324 -0.86 . . . . 0.0 110.239 -179.979 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -63.27 -36.32 83.28 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.637 -0.665 . . . . 0.0 110.067 179.891 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -62.56 150.68 39.82 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.587 -0.696 . . . . 0.0 110.201 179.949 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 83.9 p -98.22 -152.08 0.39 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.611 -0.681 . . . . 0.0 109.588 179.677 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -82.58 56.57 3.38 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.305 -0.872 . . . . 0.0 110.053 179.794 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -134.98 -46.03 0.72 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.444 -0.785 . . . . 0.0 110.198 179.932 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -63.72 -31.14 72.22 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.545 -0.722 . . . . 0.0 110.457 -179.708 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.401 ' O ' ' HB3' ' A' ' 59' ' ' GLU . 19.8 ttpt -99.09 22.75 9.92 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.46 -0.775 . . . . 0.0 110.824 -179.73 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.453 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 4.9 mt-30 -93.44 -59.79 0.2 Allowed Pre-proline 0 N--CA 1.495 1.807 0 O-C-N 121.146 -0.971 . . . . 0.0 110.787 -179.659 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.453 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.5 Cg_endo -79.28 -27.3 4.44 Favored 'Trans proline' 0 N--CA 1.486 1.071 0 O-C-N 122.953 0.975 . . . . 0.0 111.468 -179.58 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.432 ' CE2' ' HB3' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -84.48 -21.12 30.74 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.354 -0.841 . . . . 0.0 111.914 -178.163 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.593 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.2 OUTLIER -69.61 -27.08 64.77 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.245 -0.909 . . . . 0.0 111.033 -179.287 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -78.14 -20.03 52.87 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.42 -0.8 . . . . 0.0 110.508 179.923 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 58.1 tttt -64.05 -46.38 84.63 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.462 -0.773 . . . . 0.0 109.803 179.717 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.743 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -77.5 -13.14 59.99 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.555 -0.715 . . . . 0.0 110.532 179.578 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -78.21 -3.0 40.49 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.325 -0.86 . . . . 0.0 110.081 178.832 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 26.2 mmtm -105.25 -25.31 12.49 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.108 -0.995 . . . . 0.0 110.068 179.507 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.2 mp -88.8 -16.21 32.66 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.749 -0.595 . . . . 0.0 109.926 178.704 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.5 tptt -74.7 -35.89 62.72 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.46 -0.775 . . . . 0.0 109.482 179.397 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -67.2 -57.48 6.65 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.686 -0.634 . . . . 0.0 109.829 179.776 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -58.28 -26.72 63.32 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.601 -0.687 . . . . 0.0 110.593 -179.955 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.631 ' HE1' HD13 ' A' ' 73' ' ' ILE . 37.0 t80 -73.63 -68.25 0.52 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.473 -0.767 . . . . 0.0 109.445 179.503 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -55.34 -21.15 13.95 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.798 -0.564 . . . . 0.0 111.211 -179.772 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -95.46 -19.1 20.14 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.423 -0.798 . . . . 0.0 111.316 -179.485 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -109.73 -31.93 7.27 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.242 -0.911 . . . . 0.0 110.907 -179.537 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.631 HD13 ' HE1' ' A' ' 69' ' ' TYR . 2.5 tp . . . . . 0 N--CA 1.495 1.823 0 C-N-CA 119.822 -0.751 . . . . 0.0 110.024 -179.733 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo . . . . . 0 N--CA 1.485 1.0 0 N-CA-C 110.517 -0.609 . . . . 0.0 110.517 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.7 pttt -67.97 -160.17 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.541 -0.725 . . . . 0.0 109.751 179.815 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -60.44 141.03 91.86 Favored Pre-proline 0 N--CA 1.497 1.898 0 O-C-N 121.359 -0.838 . . . . 0.0 109.88 179.769 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.411 ' HD3' ' CZ ' ' A' ' 69' ' ' TYR . 46.8 Cg_endo -73.77 129.87 14.0 Favored 'Trans proline' 0 C--N 1.317 -1.094 0 O-C-N 123.248 1.131 . . . . 0.0 110.193 -179.897 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.612 ' HB2' HD21 ' A' ' 18' ' ' LEU . 49.1 Cg_endo -81.26 -179.59 5.13 Favored 'Trans proline' 0 C--N 1.318 -1.051 0 O-C-N 123.271 1.143 . . . . 0.0 110.08 -179.94 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.557 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 32.2 t -170.01 62.51 0.05 OUTLIER 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.505 -0.747 . . . . 0.0 110.828 -179.928 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.557 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 70.88 -75.98 0.07 Allowed 'General case' 0 N--CA 1.505 2.308 0 O-C-N 121.043 -1.035 . . . . 0.0 110.504 -179.601 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -50.78 -45.83 59.31 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.23 -0.919 . . . . 0.0 110.952 -179.823 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -61.45 -34.35 75.27 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 120.183 -0.607 . . . . 0.0 109.71 179.622 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.612 HD21 ' HB2' ' A' ' 13' ' ' PRO . 29.8 mt -76.44 -40.16 51.38 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.486 -0.759 . . . . 0.0 110.404 -179.539 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.494 ' CE2' ' CZ ' ' A' ' 23' ' ' TYR . 32.0 t80 -66.45 -51.18 59.61 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.554 -0.716 . . . . 0.0 110.586 -179.43 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 2.2 t -65.7 -28.94 69.44 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.453 -0.78 . . . . 0.0 110.051 179.707 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.9 m -70.06 -15.87 63.06 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.647 -0.658 . . . . 0.0 111.54 -179.273 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -125.65 -25.72 3.64 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.068 -1.02 . . . . 0.0 112.133 -179.116 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.494 ' CZ ' ' CE2' ' A' ' 19' ' ' PHE . 10.6 m-85 -76.95 -38.47 53.25 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.165 -0.959 . . . . 0.0 110.798 -179.448 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.491 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 2.1 mtt180 -48.08 -53.33 33.86 Favored Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 121.359 -0.838 . . . . 0.0 112.415 -179.527 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.534 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.2 Cg_endo -59.61 -27.66 85.49 Favored 'Trans proline' 0 N--CA 1.494 1.517 0 O-C-N 123.221 1.116 . . . . 0.0 110.185 -179.624 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.0 tmtm? -70.46 -46.78 63.16 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 177.542 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.655 HG13 HD21 ' A' ' 43' ' ' LEU . 46.1 mm -57.71 -21.68 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.632 179.724 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.535 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 4.9 mmmm -81.06 -26.96 35.91 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.141 -0.974 . . . . 0.0 110.426 -177.573 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.8 t -86.28 -3.23 58.94 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.482 -0.761 . . . . 0.0 111.119 179.627 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -132.51 -2.01 3.45 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.062 -1.024 . . . . 0.0 112.018 -179.464 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.59 ' CB ' HD13 ' A' ' 34' ' ' LEU . 54.4 m80 -126.33 95.65 38.15 Favored Pre-proline 0 N--CA 1.499 2.015 0 O-C-N 120.915 -1.116 . . . . 0.0 109.779 179.924 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -78.34 -75.41 0.01 OUTLIER 'Trans proline' 0 N--CA 1.485 0.979 0 O-C-N 123.43 1.226 . . . . 0.0 111.708 -179.301 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -51.35 -28.71 20.91 Favored Glycine 0 N--CA 1.503 3.113 0 N-CA-C 110.343 -1.103 . . . . 0.0 110.343 -179.483 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.746 ' O ' HD23 ' A' ' 34' ' ' LEU . 7.8 tt -46.59 96.04 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.792 -0.828 . . . . 0.0 111.455 179.844 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 44.8 m -66.52 178.3 1.3 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.675 -0.64 . . . . 0.0 109.863 -179.77 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.403 ' HA ' HD13 ' A' ' 36' ' ' ILE . 13.8 mm -58.72 -61.44 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.053 0 O-C-N 121.46 -0.775 . . . . 0.0 110.201 179.908 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.457 ' O ' ' HE2' ' A' ' 41' ' ' LYS . . . -46.9 -38.34 10.18 Favored Glycine 0 N--CA 1.498 2.777 0 N-CA-C 110.617 -0.993 . . . . 0.0 110.617 -178.806 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.462 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 1.6 m-20 -68.57 -33.44 74.09 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.585 -0.95 . . . . 0.0 110.055 178.917 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.536 HG23 HD21 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -67.34 -38.63 85.14 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.333 -0.854 . . . . 0.0 110.776 179.69 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.2 -38.36 78.58 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.65 -0.656 . . . . 0.0 110.121 -179.226 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.457 ' HE2' ' O ' ' A' ' 37' ' ' GLY . 1.2 ptpm? -89.72 -13.8 36.06 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 119.988 -0.685 . . . . 0.0 111.167 -179.69 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 3.4 tptt -87.66 -9.33 54.5 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.006 -1.058 . . . . 0.0 110.556 179.015 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.655 HD21 HG13 ' A' ' 27' ' ' ILE . 22.4 mt -95.11 -32.82 12.91 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.39 -0.819 . . . . 0.0 109.287 179.362 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.91 -35.42 72.36 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 108.605 -1.798 . . . . 0.0 108.605 179.178 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -57.13 -39.26 74.8 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.633 -0.922 . . . . 0.0 110.363 179.881 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 30.5 mtt -77.69 -48.69 16.12 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.54 -0.725 . . . . 0.0 110.355 179.991 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 68.8 t-105 -58.3 -25.46 61.87 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.539 -0.726 . . . . 0.0 110.659 -179.712 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 62.5 p -85.9 -37.26 19.3 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.394 -0.816 . . . . 0.0 110.054 179.963 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -63.92 -31.95 73.31 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.523 -0.736 . . . . 0.0 109.967 179.873 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 89.4 mm-40 -62.28 148.73 44.06 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.58 -0.7 . . . . 0.0 110.134 179.889 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.8 m -101.41 -153.01 0.44 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.58 -0.7 . . . . 0.0 109.621 179.724 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -82.52 56.34 3.27 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.344 -0.847 . . . . 0.0 110.119 179.753 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 17.6 tptt -132.25 -49.29 0.93 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.449 -0.782 . . . . 0.0 110.133 -179.994 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -66.8 -35.7 80.68 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.57 -0.706 . . . . 0.0 110.46 -179.948 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.419 ' O ' ' N ' ' A' ' 59' ' ' GLU . 17.6 tttt -71.59 -37.78 70.96 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.552 -0.718 . . . . 0.0 110.864 -179.669 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.402 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 5.0 mm-40 -43.53 -57.19 5.9 Favored Pre-proline 0 N--CA 1.507 2.406 0 O-C-N 121.318 -0.864 . . . . 0.0 112.751 -178.674 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.402 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.0 Cg_endo -77.19 -36.21 1.44 Allowed 'Trans proline' 0 N--CA 1.489 1.255 0 O-C-N 123.071 1.037 . . . . 0.0 111.903 -179.52 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -83.46 -12.28 56.53 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.352 -0.843 . . . . 0.0 112.561 -177.645 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.419 ' N ' ' O ' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -82.72 -27.47 31.13 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.033 -1.042 . . . . 0.0 111.112 -179.165 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -74.01 -20.04 60.45 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.343 -0.848 . . . . 0.0 110.751 -179.987 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 43.5 tttm -65.8 -42.08 91.11 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.286 -0.883 . . . . 0.0 109.962 179.796 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.566 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -81.34 -16.79 51.29 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.599 -0.688 . . . . 0.0 110.224 179.385 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.27 -36.86 78.77 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.343 -0.848 . . . . 0.0 110.306 179.89 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -70.82 -62.34 1.43 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.239 -0.913 . . . . 0.0 110.003 179.858 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.436 ' H ' HD12 ' A' ' 65' ' ' LEU . 4.7 mp -46.88 -24.15 0.55 Allowed 'General case' 0 N--CA 1.505 2.291 0 O-C-N 121.555 -0.716 . . . . 0.0 112.157 -179.453 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.8 tptm -68.23 -48.14 65.95 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.299 -0.876 . . . . 0.0 109.506 179.189 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -65.0 -55.49 18.7 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.735 -0.603 . . . . 0.0 109.953 179.718 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 60.3 mttm -56.67 -26.89 57.56 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.467 -0.771 . . . . 0.0 110.481 179.888 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.449 ' O ' HG22 ' A' ' 73' ' ' ILE . 50.1 t80 -75.91 -67.99 0.62 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.499 -0.751 . . . . 0.0 109.296 179.385 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -51.36 -24.34 4.66 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.662 -0.648 . . . . 0.0 111.478 -179.548 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 46.8 mttp -92.62 -62.53 1.38 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.439 -0.788 . . . . 0.0 110.917 -179.44 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -58.1 -31.04 66.74 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.609 -0.682 . . . . 0.0 111.135 -179.078 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.449 HG22 ' O ' ' A' ' 69' ' ' TYR . 4.6 tp . . . . . 0 N--CA 1.497 1.882 0 O-C-N 121.342 -0.849 . . . . 0.0 110.457 -179.474 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.424 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 53.7 Cg_endo . . . . . 0 N--CA 1.484 0.928 0 CA-C-O 120.756 0.232 . . . . 0.0 112.123 . . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.5 mtpt -43.3 139.91 1.78 Allowed 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.396 -0.815 . . . . 0.0 112.872 -179.065 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.7 tpt180 49.79 99.82 0.04 OUTLIER Pre-proline 0 N--CA 1.497 1.923 0 O-C-N 121.795 -0.566 . . . . 0.0 112.156 178.911 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.408 ' HB3' ' CD2' ' A' ' 69' ' ' TYR . 47.1 Cg_endo -75.79 132.21 14.17 Favored 'Trans proline' 0 C--N 1.318 -1.028 0 O-C-N 123.248 1.131 . . . . 0.0 109.321 178.581 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.55 ' HG3' HD22 ' A' ' 65' ' ' LEU . 50.1 Cg_endo -80.06 155.88 23.02 Favored 'Trans proline' 0 C--N 1.316 -1.152 0 O-C-N 123.161 1.085 . . . . 0.0 110.196 -179.576 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.573 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 7.6 t -158.73 51.43 0.39 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.515 -0.741 . . . . 0.0 110.961 -179.584 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.573 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 71.58 -73.83 0.09 Allowed 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.348 -0.845 . . . . 0.0 110.403 -179.518 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -46.71 -53.72 11.16 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.327 -0.858 . . . . 0.0 111.442 -179.561 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -55.61 -40.93 72.75 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.518 -0.739 . . . . 0.0 109.965 179.512 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.503 HD11 ' HB2' ' A' ' 62' ' ' ALA . 56.4 mt -62.09 -41.41 98.16 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.719 -0.613 . . . . 0.0 109.834 179.819 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -75.19 -53.89 8.05 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.592 -0.692 . . . . 0.0 110.232 -179.996 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 3.7 m -55.44 -55.96 25.7 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.435 -0.791 . . . . 0.0 110.434 -179.976 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 62.9 p -53.6 -29.92 39.97 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.467 -0.771 . . . . 0.0 110.521 179.994 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -88.56 -32.51 18.1 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.618 -0.677 . . . . 0.0 110.74 -179.781 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -94.63 13.61 23.7 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.451 -0.781 . . . . 0.0 111.513 -179.446 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.551 ' CG ' HD11 ' A' ' 43' ' ' LEU . 8.5 mtt180 -88.37 -42.92 0.47 Allowed Pre-proline 0 N--CA 1.488 1.434 0 O-C-N 121.192 -0.942 . . . . 0.0 112.367 179.471 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.58 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.1 Cg_endo -67.04 -16.95 50.68 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 O-C-N 122.711 0.848 . . . . 0.0 110.427 -179.203 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.41 -50.78 23.91 Favored 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 177.859 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 39.0 mm -52.93 -32.7 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 CA-C-O 121.49 0.662 . . . . 0.0 110.281 179.641 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.58 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.6 mmmm -72.37 -37.43 68.77 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.252 -177.215 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.0 t -59.91 -24.57 64.43 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.377 -0.827 . . . . 0.0 110.619 -179.699 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -116.37 -21.83 9.08 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.455 -0.778 . . . . 0.0 110.903 -179.609 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.775 ' HB3' HD23 ' A' ' 34' ' ' LEU . 43.7 m80 -121.71 96.32 47.34 Favored Pre-proline 0 N--CA 1.495 1.788 0 O-C-N 121.342 -0.849 . . . . 0.0 109.682 179.93 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -74.98 -33.27 4.74 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.366 1.193 . . . . 0.0 110.361 -179.817 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -79.48 -11.8 84.46 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 110.35 -1.1 . . . . 0.0 110.35 179.805 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.775 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -62.46 81.64 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.287 -1.125 . . . . 0.0 110.753 -179.668 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.1 t -74.89 177.9 5.94 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.425 -0.797 . . . . 0.0 109.721 179.721 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 37.3 mm -51.33 -37.25 18.21 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.207 0 O-C-N 121.234 -0.916 . . . . 0.0 110.586 -179.899 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -55.57 -68.94 1.43 Allowed Glycine 0 N--CA 1.494 2.502 0 N-CA-C 109.328 -1.509 . . . . 0.0 109.328 179.824 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.533 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 1.9 m-20 -66.19 -29.65 69.97 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.786 -0.832 . . . . 0.0 110.724 179.475 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 75.1 m -66.58 -29.26 69.27 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.164 -0.96 . . . . 0.0 110.291 179.648 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.11 -45.05 59.27 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.553 -0.717 . . . . 0.0 109.948 179.848 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -82.92 -17.72 42.66 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.668 -0.645 . . . . 0.0 112.213 -178.897 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.533 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -82.18 3.18 28.25 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 120.762 -1.211 . . . . 0.0 110.818 179.665 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.551 HD11 ' CG ' ' A' ' 24' ' ' ARG . 34.1 mt -105.79 -29.44 10.04 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.268 -0.895 . . . . 0.0 109.632 179.502 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.09 -37.8 82.85 Favored Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -179.79 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -50.16 -36.02 28.46 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.428 -1.043 . . . . 0.0 110.906 -179.644 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 64.2 mtm -87.27 -39.24 15.58 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.518 -0.739 . . . . 0.0 109.946 179.614 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 67.3 t-105 -55.56 -31.07 61.85 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.605 -0.684 . . . . 0.0 110.994 -179.643 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.2 t -87.35 -32.84 19.4 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.276 -0.89 . . . . 0.0 110.229 -179.802 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -63.66 -37.06 85.92 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.509 -0.744 . . . . 0.0 109.915 179.869 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.0 mm-40 -59.7 149.68 29.99 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.628 -0.67 . . . . 0.0 110.336 179.919 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 85.6 p -92.83 -152.15 0.31 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.688 -0.633 . . . . 0.0 109.613 179.679 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -83.67 55.55 3.27 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.313 -0.867 . . . . 0.0 110.151 179.82 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -135.95 -43.61 0.65 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.453 -0.779 . . . . 0.0 110.255 -179.936 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -62.49 -33.85 75.7 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.457 -0.777 . . . . 0.0 110.336 -179.904 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -96.87 22.35 8.41 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.442 -0.786 . . . . 0.0 111.092 -179.556 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.464 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 2.6 mm100 -92.19 -57.46 0.24 Allowed Pre-proline 0 N--CA 1.496 1.852 0 O-C-N 121.072 -1.017 . . . . 0.0 110.278 179.889 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.464 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 57.5 Cg_endo -82.96 -26.35 2.42 Favored 'Trans proline' 0 N--CA 1.484 0.945 0 O-C-N 122.929 0.963 . . . . 0.0 110.748 179.568 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -83.21 -18.54 38.92 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.456 -0.777 . . . . 0.0 111.955 -178.149 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.436 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.3 OUTLIER -77.2 -26.14 52.48 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.175 -0.953 . . . . 0.0 110.944 -179.288 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -79.45 -21.31 45.64 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.501 -0.75 . . . . 0.0 110.648 179.947 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 62.2 tttt -65.9 -44.33 85.57 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.455 -0.778 . . . . 0.0 109.74 179.643 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.503 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -79.99 -15.13 57.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.581 -0.699 . . . . 0.0 110.161 179.174 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.08 -32.97 72.61 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.351 -0.843 . . . . 0.0 109.942 179.592 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -77.59 -63.9 1.27 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.579 -0.701 . . . . 0.0 109.73 179.45 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.55 HD22 ' HG3' ' A' ' 13' ' ' PRO . 5.0 mp -50.1 -25.68 3.72 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.48 -0.762 . . . . 0.0 111.114 -179.807 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -67.19 -49.95 62.74 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.523 -0.736 . . . . 0.0 109.373 179.307 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -61.98 -49.31 76.61 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.68 -0.637 . . . . 0.0 109.351 179.298 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 37.1 mttp -60.33 -27.37 67.3 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.719 -0.613 . . . . 0.0 110.067 179.444 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.598 ' O ' HG22 ' A' ' 73' ' ' ILE . 19.8 t80 -74.2 -65.11 0.89 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.378 -0.826 . . . . 0.0 109.13 179.024 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -58.1 -25.5 61.42 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.784 -0.572 . . . . 0.0 111.115 -179.495 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.2 mmmt -91.83 -14.25 30.06 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.354 -0.841 . . . . 0.0 111.89 -179.102 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -111.84 -30.13 7.41 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.057 -1.027 . . . . 0.0 110.902 -179.624 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.598 HG22 ' O ' ' A' ' 69' ' ' TYR . 2.5 tp . . . . . 0 N--CA 1.495 1.806 0 O-C-N 121.529 -0.732 . . . . 0.0 110.115 -179.787 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.403 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 46.5 Cg_endo . . . . . 0 N--CA 1.483 0.875 0 N-CA-C 110.499 -0.616 . . . . 0.0 110.499 . . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.3 pttt -70.82 -154.84 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.529 -0.732 . . . . 0.0 109.73 179.651 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.26 141.65 87.0 Favored Pre-proline 0 N--CA 1.498 1.956 0 O-C-N 121.374 -0.829 . . . . 0.0 109.806 179.661 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -74.1 133.39 17.97 Favored 'Trans proline' 0 C--N 1.318 -1.076 0 O-C-N 123.305 1.16 . . . . 0.0 110.321 -179.811 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.553 ' HB2' HD21 ' A' ' 18' ' ' LEU . 50.8 Cg_endo -80.94 173.7 11.71 Favored 'Trans proline' 0 C--N 1.319 -1.004 0 O-C-N 123.299 1.157 . . . . 0.0 109.903 179.909 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.562 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 37.2 t -170.53 62.9 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.44 -0.787 . . . . 0.0 110.868 -179.899 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.562 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 69.7 -76.31 0.06 Allowed 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.041 -1.037 . . . . 0.0 110.452 -179.62 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -47.67 -50.22 25.36 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.267 -0.896 . . . . 0.0 111.267 -179.463 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -58.73 -35.78 73.25 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.67 -0.643 . . . . 0.0 110.108 179.785 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.662 HD11 ' HB2' ' A' ' 62' ' ' ALA . 24.1 mt -74.4 -35.01 63.43 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.501 -0.749 . . . . 0.0 110.228 -179.581 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 19' ' ' PHE . . . . . 0.502 ' CE2' ' CZ ' ' A' ' 23' ' ' TYR . 54.9 t80 -74.28 -54.2 8.17 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.599 -0.688 . . . . 0.0 110.626 -179.373 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.458 ' SG ' HD13 ' A' ' 43' ' ' LEU . 1.8 t -59.54 -48.77 80.36 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.583 -0.698 . . . . 0.0 110.489 -179.744 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.7 t -58.63 -26.05 63.32 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.509 -0.744 . . . . 0.0 110.671 -179.694 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -99.13 -22.03 15.87 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.519 -0.738 . . . . 0.0 111.212 -179.316 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.502 ' CZ ' ' CE2' ' A' ' 19' ' ' PHE . 7.1 m-85 -92.68 -36.38 12.98 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.389 -0.819 . . . . 0.0 110.829 -179.466 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.49 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 9.6 mtt180 -47.59 -53.56 29.34 Favored Pre-proline 0 N--CA 1.499 1.986 0 O-C-N 121.38 -0.825 . . . . 0.0 112.215 -179.55 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.529 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.8 Cg_endo -60.64 -26.93 83.93 Favored 'Trans proline' 0 N--CA 1.494 1.544 0 O-C-N 123.198 1.104 . . . . 0.0 110.021 179.997 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.06 -47.13 63.25 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 177.726 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.463 HG22 ' HG ' ' A' ' 34' ' ' LEU . 46.5 mm -55.97 -22.7 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.328 179.551 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.716 ' NZ ' HD12 ' A' ' 34' ' ' LEU . 16.1 mmmt -82.74 -29.64 29.6 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.327 -0.858 . . . . 0.0 111.34 -176.717 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.9 t -72.91 -34.73 66.81 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.177 -0.952 . . . . 0.0 110.18 -179.627 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -97.67 -4.43 37.36 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.72 -0.612 . . . . 0.0 111.226 -179.258 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.454 ' CB ' ' HB2' ' A' ' 34' ' ' LEU . 27.8 m80 -140.08 96.46 8.14 Favored Pre-proline 0 N--CA 1.493 1.703 0 O-C-N 121.26 -0.9 . . . . 0.0 108.698 179.016 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -75.03 -47.36 0.2 Allowed 'Trans proline' 0 C--N 1.315 -1.205 0 O-C-N 123.481 1.253 . . . . 0.0 110.662 -179.306 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.59 -20.59 63.92 Favored Glycine 0 N--CA 1.494 2.513 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 179.03 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.716 HD12 ' NZ ' ' A' ' 28' ' ' LYS . 0.2 OUTLIER -48.01 92.22 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.471 -1.017 . . . . 0.0 111.705 -179.769 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.8 m -66.89 -179.3 0.88 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.497 -0.752 . . . . 0.0 109.461 179.3 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.421 HD13 ' HA ' ' A' ' 36' ' ' ILE . 17.8 mm -60.78 -56.39 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.382 -0.824 . . . . 0.0 109.843 179.946 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.43 ' O ' ' HE2' ' A' ' 41' ' ' LYS . . . -49.89 -43.41 39.48 Favored Glycine 0 N--CA 1.497 2.754 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 -179.018 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.637 ' HB2' HD13 ' A' ' 34' ' ' LEU . 40.5 m-20 -61.5 -36.17 79.73 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.636 -0.92 . . . . 0.0 109.993 178.949 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.52 ' O ' HD12 ' A' ' 43' ' ' LEU . 10.9 m -60.08 -36.9 78.4 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.28 -0.887 . . . . 0.0 110.785 179.573 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.54 -54.02 6.91 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.624 -0.673 . . . . 0.0 110.357 -179.695 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.43 ' HE2' ' O ' ' A' ' 37' ' ' GLY . 1.8 ptpm? -67.39 -28.34 67.84 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.63 -0.669 . . . . 0.0 111.458 -179.23 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.486 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -81.5 -2.01 48.18 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.911 -1.118 . . . . 0.0 110.916 179.697 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.52 HD12 ' O ' ' A' ' 39' ' ' THR . 26.2 mt -106.6 -34.12 7.44 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.203 -0.935 . . . . 0.0 110.174 -179.904 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.5 -40.93 96.45 Favored Glycine 0 N--CA 1.494 2.504 0 N-CA-C 109.885 -1.286 . . . . 0.0 109.885 -179.653 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -55.88 -34.12 65.22 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.544 -0.974 . . . . 0.0 110.732 -179.628 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 47.1 mmm -80.65 -46.88 14.91 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.542 -0.724 . . . . 0.0 110.358 -179.876 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 74.2 t-105 -56.76 -22.11 33.3 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.53 -0.731 . . . . 0.0 110.989 -179.621 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 16.5 t -91.83 -35.52 14.04 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.269 -0.894 . . . . 0.0 110.231 179.976 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -65.02 -34.66 78.97 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.551 -0.718 . . . . 0.0 110.041 179.89 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 63.2 mm-40 -59.01 150.58 24.27 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.556 -0.715 . . . . 0.0 110.417 179.999 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 10.5 t -89.91 -151.53 0.24 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.637 -0.665 . . . . 0.0 109.545 179.744 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -85.74 53.6 2.83 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.258 -0.901 . . . . 0.0 110.192 179.849 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 67.4 mttt -132.17 -43.16 0.96 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.438 -0.789 . . . . 0.0 110.208 179.97 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -59.61 -31.42 69.47 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.488 -0.757 . . . . 0.0 110.626 -179.673 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 69.8 tttt -101.0 25.54 7.96 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.467 -0.771 . . . . 0.0 110.964 -179.503 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.434 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 1.7 mm-40 -97.64 -53.43 0.21 Allowed Pre-proline 0 N--CA 1.496 1.842 0 O-C-N 121.213 -0.929 . . . . 0.0 110.786 -179.836 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.434 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.6 Cg_endo -85.11 -31.86 0.35 Allowed 'Trans proline' 0 C--N 1.321 -0.908 0 O-C-N 122.92 0.958 . . . . 0.0 111.33 -179.634 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.34 -11.63 57.46 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.417 -0.802 . . . . 0.0 111.775 -178.579 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.556 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.5 OUTLIER -79.22 -26.71 42.49 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.075 -1.016 . . . . 0.0 110.856 -179.421 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -76.12 -20.06 57.97 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.487 -0.758 . . . . 0.0 110.871 -179.9 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 36.7 tttt -65.02 -44.23 89.83 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.387 -0.821 . . . . 0.0 110.109 179.977 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.662 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -82.44 -15.51 52.33 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.51 -0.744 . . . . 0.0 110.11 179.283 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.36 -28.17 67.98 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.29 -0.881 . . . . 0.0 109.362 178.923 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -81.5 -64.99 1.07 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.61 -0.681 . . . . 0.0 109.472 179.175 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.511 ' H ' HD12 ' A' ' 65' ' ' LEU . 3.8 mp -50.65 -24.23 3.17 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.573 -0.704 . . . . 0.0 111.318 -179.732 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.3 tttt -63.18 -53.07 59.0 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.443 -0.785 . . . . 0.0 109.663 179.292 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -62.51 -48.78 78.07 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.682 -0.636 . . . . 0.0 110.25 -179.996 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 24.2 mmtp -60.32 -27.18 67.13 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.543 -0.723 . . . . 0.0 110.466 -179.674 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.48 ' O ' HG22 ' A' ' 73' ' ' ILE . 3.7 m-85 -80.72 -64.69 1.13 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.518 -0.739 . . . . 0.0 109.894 179.845 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -50.56 -35.2 28.69 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.5 -0.75 . . . . 0.0 111.163 -179.697 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 41.5 mmtt -76.11 -50.82 13.62 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.546 -0.721 . . . . 0.0 110.778 -179.754 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -74.52 -23.91 58.89 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.45 -0.781 . . . . 0.0 111.302 -179.103 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 73' ' ' ILE . . . . . 0.48 HG22 ' O ' ' A' ' 69' ' ' TYR . 9.1 tp . . . . . 0 N--CA 1.493 1.718 0 O-C-N 121.266 -0.896 . . . . 0.0 109.904 -179.983 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.426 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 48.6 Cg_endo . . . . . 0 N--CA 1.485 1.001 0 N-CA-C 110.725 -0.529 . . . . 0.0 110.725 . . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -108.2 26.27 10.62 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.585 -0.697 . . . . 0.0 110.784 179.815 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -163.27 95.62 1.08 Allowed Pre-proline 0 N--CA 1.494 1.767 0 O-C-N 121.702 -0.624 . . . . 0.0 110.16 -179.906 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -75.56 114.77 4.04 Favored 'Trans proline' 0 C--N 1.316 -1.14 0 O-C-N 123.352 1.185 . . . . 0.0 110.66 -179.843 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.579 ' HB2' HD21 ' A' ' 18' ' ' LEU . 47.4 Cg_endo -81.23 157.57 19.93 Favored 'Trans proline' 0 C--N 1.319 -1.013 0 O-C-N 123.303 1.159 . . . . 0.0 110.026 179.779 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.537 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 32.6 t -151.82 55.78 0.84 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.467 -0.771 . . . . 0.0 110.91 -179.625 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.537 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 67.87 -74.94 0.07 Allowed 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.194 -0.942 . . . . 0.0 110.152 -179.65 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -47.77 -51.26 23.06 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.416 -0.802 . . . . 0.0 111.402 -179.605 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -57.82 -41.67 82.73 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.455 -0.778 . . . . 0.0 109.743 179.548 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.639 HD11 ' HB2' ' A' ' 62' ' ' ALA . 61.9 mt -59.73 -46.65 88.46 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.576 -0.703 . . . . 0.0 109.947 179.9 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -69.67 -51.33 35.64 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.679 -0.638 . . . . 0.0 110.284 -179.729 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.5 m -56.24 -54.33 46.56 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.54 -0.725 . . . . 0.0 110.787 -179.658 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 34.7 t -57.94 -30.75 66.22 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.358 -0.839 . . . . 0.0 110.539 -179.807 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 -86.66 -29.42 22.51 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.534 -0.729 . . . . 0.0 110.721 -179.651 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -99.62 9.76 42.57 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.35 -0.844 . . . . 0.0 111.519 -179.401 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.516 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 3.6 mtt180 -79.75 -50.12 1.27 Allowed Pre-proline 0 N--CA 1.49 1.567 0 O-C-N 121.222 -0.924 . . . . 0.0 111.522 179.453 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.567 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 37.5 Cg_endo -63.74 -15.61 49.88 Favored 'Trans proline' 0 N--CA 1.491 1.362 0 O-C-N 122.918 0.957 . . . . 0.0 110.609 -179.631 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 9.1 tmtt? -72.69 -49.84 28.79 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 177.93 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.534 ' CG1' HD21 ' A' ' 43' ' ' LEU . 16.2 mm -55.65 -38.11 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 CA-C-O 121.51 0.671 . . . . 0.0 110.204 179.804 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.567 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 4.2 mmmm -68.15 -40.93 82.27 Favored 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.183 -177.101 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.4 t -58.04 -24.08 56.93 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.398 -0.814 . . . . 0.0 110.88 -179.527 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -114.32 -23.6 9.32 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.478 -0.764 . . . . 0.0 110.686 -179.679 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.771 ' HB3' HD23 ' A' ' 34' ' ' LEU . 53.8 m80 -119.67 96.79 49.79 Favored Pre-proline 0 N--CA 1.494 1.75 0 O-C-N 121.483 -0.761 . . . . 0.0 109.519 -179.783 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -75.08 -27.94 9.45 Favored 'Trans proline' 0 C--N 1.314 -1.28 0 O-C-N 123.525 1.276 . . . . 0.0 110.542 -179.855 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -85.72 -11.34 74.37 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 110.449 -1.06 . . . . 0.0 110.449 179.951 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.771 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -62.18 81.72 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.282 -1.128 . . . . 0.0 110.747 -179.608 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.5 m -70.98 171.0 11.58 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.407 -0.808 . . . . 0.0 109.904 -179.977 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 38.6 mm -51.76 -29.55 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.175 0 O-C-N 121.262 -0.899 . . . . 0.0 110.315 179.976 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.35 -69.06 1.39 Allowed Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.31 -1.516 . . . . 0.0 109.31 179.802 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.651 ' HB3' HD13 ' A' ' 34' ' ' LEU . 13.7 t70 -67.26 -28.5 68.09 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.591 -0.946 . . . . 0.0 110.698 179.723 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 85.3 m -65.26 -27.8 68.9 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.344 -0.848 . . . . 0.0 110.131 179.775 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.59 -47.27 19.83 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.44 -0.788 . . . . 0.0 109.948 179.76 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -82.57 -12.37 57.77 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.602 -0.686 . . . . 0.0 111.578 -179.603 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.1 OUTLIER -78.85 -60.5 2.35 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.985 -1.072 . . . . 0.0 109.641 179.55 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.534 HD21 ' CG1' ' A' ' 27' ' ' ILE . 52.7 mt -50.96 -25.17 4.32 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.428 -0.795 . . . . 0.0 111.07 -179.873 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.47 -40.43 91.18 Favored Glycine 0 N--CA 1.493 2.435 0 N-CA-C 109.173 -1.571 . . . . 0.0 109.173 179.553 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -54.98 -37.34 66.41 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.507 -0.996 . . . . 0.0 110.676 -179.875 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 10.9 mmt -70.4 -53.09 17.94 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.531 -0.73 . . . . 0.0 109.988 179.872 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 47' ' ' TRP . . . . . 0.409 ' CH2' ' HB3' ' A' ' 55' ' ' LYS . 63.9 t-105 -49.47 -54.58 16.95 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.475 -0.765 . . . . 0.0 111.115 -179.677 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 26.6 t -57.44 -36.56 71.54 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.376 -0.828 . . . . 0.0 110.304 179.993 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -63.82 -41.41 97.86 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.544 -0.722 . . . . 0.0 109.743 179.69 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -60.14 156.76 14.45 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.583 -0.698 . . . . 0.0 110.268 179.814 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.0 m -100.52 -151.93 0.41 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.681 -0.637 . . . . 0.0 109.395 179.485 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.42 51.15 2.15 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.329 -0.857 . . . . 0.0 109.993 179.613 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 42.1 mtmt -130.46 -49.92 1.08 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.431 -0.793 . . . . 0.0 110.523 -179.84 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -70.83 -16.37 62.72 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.553 -0.717 . . . . 0.0 111.481 -179.102 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.414 ' HG3' ' N ' ' A' ' 56' ' ' GLN . 32.2 pttt -107.07 -37.31 6.34 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.152 -0.967 . . . . 0.0 111.116 -179.592 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.414 ' N ' ' HG3' ' A' ' 55' ' ' LYS . 5.9 mm100 -42.87 -56.52 6.02 Favored Pre-proline 0 N--CA 1.508 2.444 0 O-C-N 121.402 -0.811 . . . . 0.0 112.438 -178.847 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.403 ' CD ' ' CB ' ' A' ' 56' ' ' GLN . 48.6 Cg_endo -72.52 -34.15 7.74 Favored 'Trans proline' 0 C--N 1.316 -1.172 0 O-C-N 123.061 1.032 . . . . 0.0 109.891 179.624 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -75.66 -8.16 56.11 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.647 -0.658 . . . . 0.0 110.667 179.818 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.422 ' OE1' ' HB2' ' A' ' 15' ' ' ALA . 5.6 mm-40 -77.49 -58.39 3.3 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.18 -0.95 . . . . 0.0 109.96 179.776 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.401 ' HG3' ' N ' ' A' ' 61' ' ' LYS . 11.1 pt20 -47.75 -28.2 2.38 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.697 -0.627 . . . . 0.0 111.535 -179.413 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.401 ' N ' ' HG3' ' A' ' 60' ' ' GLN . 70.1 tttt -60.35 -50.35 73.97 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.319 -0.863 . . . . 0.0 109.886 179.648 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.639 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -72.64 -8.25 54.35 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.654 -0.654 . . . . 0.0 110.575 179.426 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.58 0.3 52.93 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.175 -0.953 . . . . 0.0 110.215 178.895 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 48.8 mmtt -105.28 -29.34 10.36 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.105 -0.997 . . . . 0.0 109.695 179.398 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.5 mp -88.47 -9.72 51.53 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.78 -0.575 . . . . 0.0 110.157 178.758 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.3 tptm -81.53 -31.17 32.88 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.3 -0.875 . . . . 0.0 109.204 179.154 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -67.89 -61.34 1.92 Allowed 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 120.114 -0.634 . . . . 0.0 109.359 179.411 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.9 mtpp -57.59 -23.9 53.35 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.573 -0.705 . . . . 0.0 110.72 179.887 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.426 ' CD2' ' HB2' ' A' ' 9' ' ' PRO . 23.9 t80 -74.22 -60.28 2.34 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.263 -0.898 . . . . 0.0 109.857 179.662 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -80.2 -17.81 51.32 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.698 -0.627 . . . . 0.0 112.046 -178.723 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.0 ttmm -98.93 -23.76 15.2 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.102 -0.999 . . . . 0.0 112.052 -178.621 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -102.25 -31.98 10.28 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.151 -0.968 . . . . 0.0 111.457 -179.149 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.9 tp . . . . . 0 N--CA 1.502 2.13 0 O-C-N 121.242 -0.911 . . . . 0.0 110.666 -179.492 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.4 ttt . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.145 0.498 . . . . 0.0 110.231 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.5 mttm -167.57 -40.01 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.628 -0.67 . . . . 0.0 110.489 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 10.1 tttt -167.69 84.81 0.21 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.455 -0.778 . . . . 0.0 110.272 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 42.3 mttm -60.93 -56.5 20.45 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.575 -0.703 . . . . 0.0 110.344 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.422 ' HB2' ' HB3' ' A' ' 8' ' ' ALA . 0.9 OUTLIER -162.73 159.7 19.61 Favored Pre-proline 0 N--CA 1.494 1.75 0 O-C-N 121.605 -0.684 . . . . 0.0 110.237 -179.99 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -73.28 -46.64 0.35 Allowed 'Trans proline' 0 C--N 1.318 -1.069 0 O-C-N 123.333 1.175 . . . . 0.0 110.627 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -79.4 -21.61 45.4 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.565 -0.709 . . . . 0.0 110.837 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.422 ' HB3' ' HB2' ' A' ' 5' ' ' ASP . . . -74.95 144.85 80.27 Favored Pre-proline 0 N--CA 1.496 1.846 0 O-C-N 121.358 -0.839 . . . . 0.0 109.81 179.632 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -73.09 88.52 0.95 Allowed 'Trans proline' 0 C--N 1.317 -1.093 0 O-C-N 123.292 1.153 . . . . 0.0 110.568 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.8 mtpt -56.07 -171.57 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.662 -0.649 . . . . 0.0 110.711 -179.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.2 mtt85 -56.64 139.46 75.94 Favored Pre-proline 0 N--CA 1.498 1.933 0 O-C-N 121.412 -0.805 . . . . 0.0 110.456 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.422 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 50.0 Cg_endo -77.03 133.27 13.48 Favored 'Trans proline' 0 C--N 1.318 -1.039 0 O-C-N 123.382 1.201 . . . . 0.0 110.252 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.78 ' CG ' HD21 ' A' ' 18' ' ' LEU . 50.3 Cg_endo -82.42 -162.5 0.18 Allowed 'Trans proline' 0 C--N 1.319 -0.993 0 O-C-N 123.236 1.124 . . . . 0.0 109.903 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.539 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 31.0 t -165.82 63.52 0.11 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.445 -0.784 . . . . 0.0 110.458 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.539 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 67.63 -75.54 0.06 Allowed 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.21 -0.931 . . . . 0.0 109.958 -179.368 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -47.19 -50.48 20.71 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.424 -0.798 . . . . 0.0 111.386 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -59.18 -39.53 82.82 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.614 -0.679 . . . . 0.0 109.746 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.78 HD21 ' CG ' ' A' ' 13' ' ' PRO . 45.0 mt -65.94 -37.19 85.39 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.594 -0.691 . . . . 0.0 109.891 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.492 ' CE2' ' CZ ' ' A' ' 23' ' ' TYR . 28.0 t80 -77.37 -54.06 6.91 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.634 -0.666 . . . . 0.0 110.654 -179.517 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 14.6 t -56.91 -53.07 62.14 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.459 -0.776 . . . . 0.0 110.707 -179.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 82.7 p -57.77 -25.4 60.44 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.577 -0.702 . . . . 0.0 110.859 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -96.55 -26.44 15.26 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.378 -0.826 . . . . 0.0 111.143 -179.352 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.492 ' CZ ' ' CE2' ' A' ' 19' ' ' PHE . 6.2 m-85 -88.5 -34.66 17.35 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.322 -0.861 . . . . 0.0 110.96 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.521 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 25.5 mtt180 -48.18 -52.83 38.61 Favored Pre-proline 0 N--CA 1.498 1.947 0 O-C-N 121.338 -0.851 . . . . 0.0 112.12 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.564 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.3 Cg_endo -59.64 -27.62 85.4 Favored 'Trans proline' 0 N--CA 1.494 1.541 0 O-C-N 123.184 1.097 . . . . 0.0 110.233 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.9 tmtt? -69.76 -45.9 67.02 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.1 mm -57.77 -31.59 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.246 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.564 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 4.8 mmmm -71.26 -36.23 71.67 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 120.004 -0.678 . . . . 0.0 110.427 -177.283 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 39.7 t -63.09 -23.38 67.42 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.393 -0.817 . . . . 0.0 110.8 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -117.14 -18.87 9.9 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.447 -0.783 . . . . 0.0 111.122 -179.524 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.701 ' HB3' HD23 ' A' ' 34' ' ' LEU . 52.0 m80 -123.25 96.1 44.74 Favored Pre-proline 0 N--CA 1.496 1.85 0 O-C-N 121.374 -0.829 . . . . 0.0 109.676 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -74.87 -36.73 2.49 Favored 'Trans proline' 0 C--N 1.316 -1.171 0 O-C-N 123.461 1.242 . . . . 0.0 110.303 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.403 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -74.37 -16.89 79.73 Favored Glycine 0 N--CA 1.49 2.261 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.701 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -59.74 80.17 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.529 -0.983 . . . . 0.0 111.335 -179.354 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.403 ' N ' ' O ' ' A' ' 33' ' ' GLY . 75.8 p -74.57 173.0 11.01 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.311 -0.868 . . . . 0.0 109.521 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 40.4 mm -52.13 -30.39 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.173 0 O-C-N 121.322 -0.862 . . . . 0.0 110.399 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.22 -68.81 1.5 Allowed Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.338 -1.505 . . . . 0.0 109.338 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.428 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 0.4 OUTLIER -67.82 -28.59 67.7 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.686 -0.891 . . . . 0.0 110.655 179.745 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 78.4 m -66.45 -29.75 69.95 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.297 -0.877 . . . . 0.0 110.014 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.53 -46.09 34.21 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.592 -0.692 . . . . 0.0 109.87 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.86 -13.01 54.69 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.621 -0.674 . . . . 0.0 111.774 -179.446 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.428 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 3.7 tppt? -77.46 -59.58 2.72 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 120.986 -1.071 . . . . 0.0 109.825 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.508 HD22 ' HG3' ' A' ' 24' ' ' ARG . 1.2 mp -53.33 -28.88 30.88 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.419 -0.801 . . . . 0.0 110.578 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -71.24 -44.57 52.57 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.114 -1.595 . . . . 0.0 109.114 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -55.31 -33.63 63.47 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.605 -0.938 . . . . 0.0 110.532 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 65.5 mmm -76.81 -49.62 15.4 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.634 -0.666 . . . . 0.0 109.564 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 70.1 t-105 -50.37 -53.02 32.24 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.563 -0.711 . . . . 0.0 110.964 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.4 t -62.74 -34.6 77.55 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.46 -0.775 . . . . 0.0 110.129 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -63.9 -39.72 94.83 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.558 -0.714 . . . . 0.0 110.141 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -57.54 157.52 6.84 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.602 -0.686 . . . . 0.0 110.594 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 17.5 t -88.51 -148.91 0.17 Allowed 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -89.31 47.58 1.5 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.154 -0.967 . . . . 0.0 110.257 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 40.7 mttp -126.94 -42.51 1.74 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.464 -0.772 . . . . 0.0 110.095 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -54.9 -26.64 37.17 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.42 -0.8 . . . . 0.0 110.926 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 40.9 tttm -107.29 26.85 9.68 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.43 -0.794 . . . . 0.0 110.963 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.432 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 3.9 mm-40 -99.91 -55.24 0.16 Allowed Pre-proline 0 N--CA 1.497 1.897 0 O-C-N 121.338 -0.851 . . . . 0.0 110.966 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.432 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.1 Cg_endo -83.37 -37.2 0.18 Allowed 'Trans proline' 0 C--N 1.322 -0.851 0 O-C-N 122.935 0.966 . . . . 0.0 110.692 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -80.51 4.9 16.79 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.523 -0.735 . . . . 0.0 111.579 -179.215 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.07 -19.98 18.33 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.178 -0.951 . . . . 0.0 110.567 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -77.48 -24.63 50.11 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.46 -0.775 . . . . 0.0 110.267 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.431 ' HD3' HD13 ' A' ' 18' ' ' LEU . 35.1 tttt -60.76 -41.52 95.64 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.482 -0.761 . . . . 0.0 109.863 179.725 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.1 -10.41 59.74 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.564 -0.71 . . . . 0.0 110.939 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -98.01 4.3 49.34 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.246 -0.908 . . . . 0.0 110.83 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.66 -40.7 5.67 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.126 -0.984 . . . . 0.0 109.787 179.569 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.746 HD11 ' HD2' ' A' ' 13' ' ' PRO . 3.4 pp -78.88 -0.16 29.64 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.831 -0.543 . . . . 0.0 110.737 179.671 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.0 ttpt -92.55 -21.06 20.32 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.243 -0.911 . . . . 0.0 109.871 179.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -83.29 -12.42 56.7 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.46 -0.775 . . . . 0.0 110.196 178.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -105.31 -30.39 9.67 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.327 -0.858 . . . . 0.0 109.347 178.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.67 ' O ' HG22 ' A' ' 73' ' ' ILE . 4.4 t80 -74.8 -53.59 8.88 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.716 -0.615 . . . . 0.0 109.577 179.435 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -56.44 -19.43 15.08 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.614 -0.679 . . . . 0.0 111.405 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.8 mttt -105.95 -29.0 10.24 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.262 -0.899 . . . . 0.0 110.802 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -86.7 -39.57 15.9 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.466 -0.771 . . . . 0.0 111.099 -179.27 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.67 HG22 ' O ' ' A' ' 69' ' ' TYR . 6.6 tp -61.47 -21.01 24.17 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.378 -0.826 . . . . 0.0 110.919 -179.384 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.02 -37.0 83.26 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.345 -0.847 . . . . 0.0 109.988 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -94.04 -26.06 16.94 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.677 -0.64 . . . . 0.0 110.282 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -63.5 -29.3 70.59 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.45 -0.781 . . . . 0.0 110.157 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 38.7 mtt-85 -78.95 -75.88 0.22 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.573 -0.705 . . . . 0.0 110.133 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 53.97 46.84 24.73 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.356 -0.84 . . . . 0.0 110.74 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.6 ptmt . . . . . 0 N--CA 1.495 1.78 0 CA-C-O 118.0 -1.0 . . . . 0.0 110.355 179.991 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.9 ttt . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.006 0.432 . . . . 0.0 110.187 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 57.2 -84.38 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.692 -0.63 . . . . 0.0 110.954 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 39.8 tttt 54.08 40.88 32.08 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.033 -1.042 . . . . 0.0 110.61 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.5 mttp -166.26 -167.4 1.03 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.645 -0.66 . . . . 0.0 109.997 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -123.36 164.85 25.52 Favored Pre-proline 0 N--CA 1.493 1.717 0 O-C-N 121.503 -0.748 . . . . 0.0 110.375 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.37 -19.21 25.6 Favored 'Trans proline' 0 C--N 1.317 -1.124 0 O-C-N 123.538 1.283 . . . . 0.0 110.949 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 67.1 m-80 -79.85 -30.09 40.23 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.294 -0.879 . . . . 0.0 110.268 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -92.74 136.5 24.94 Favored Pre-proline 0 N--CA 1.493 1.716 0 O-C-N 121.572 -0.705 . . . . 0.0 110.052 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.416 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 50.0 Cg_endo -74.17 94.91 0.9 Allowed 'Trans proline' 0 C--N 1.319 -1.015 0 O-C-N 123.19 1.1 . . . . 0.0 110.578 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.02 -168.25 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.494 -0.754 . . . . 0.0 110.016 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -60.15 137.21 91.32 Favored Pre-proline 0 N--CA 1.498 1.936 0 O-C-N 121.447 -0.783 . . . . 0.0 110.208 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -76.5 136.21 17.21 Favored 'Trans proline' 0 C--N 1.318 -1.063 0 O-C-N 123.36 1.19 . . . . 0.0 109.808 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.661 ' CB ' HD21 ' A' ' 18' ' ' LEU . 49.4 Cg_endo -79.94 -169.84 0.88 Allowed 'Trans proline' 0 C--N 1.317 -1.107 0 O-C-N 123.28 1.147 . . . . 0.0 110.213 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.495 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 1.0 OUTLIER -163.22 61.33 0.18 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.491 -0.756 . . . . 0.0 110.773 -179.787 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.495 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 65.77 -78.88 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.166 -0.959 . . . . 0.0 110.64 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -46.02 -52.26 12.15 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.237 -0.915 . . . . 0.0 111.729 -179.183 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -57.42 -33.75 68.22 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.499 -0.75 . . . . 0.0 110.131 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.661 HD21 ' CB ' ' A' ' 13' ' ' PRO . 47.8 mt -70.48 -38.3 74.37 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.613 -0.679 . . . . 0.0 110.204 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.497 ' CE2' ' CE1' ' A' ' 23' ' ' TYR . 52.7 t80 -77.21 -54.91 5.91 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.688 -0.632 . . . . 0.0 110.478 -179.537 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -56.81 -53.06 62.13 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.572 -0.705 . . . . 0.0 110.505 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.7 t -59.49 -17.99 36.23 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.578 -0.702 . . . . 0.0 111.131 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -107.89 -11.73 15.3 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.25 -0.906 . . . . 0.0 111.663 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.497 ' CE1' ' CE2' ' A' ' 19' ' ' PHE . 2.5 m-85 -100.35 -33.9 10.2 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.065 -1.022 . . . . 0.0 110.869 -179.421 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.523 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 27.7 mtt180 -47.8 -51.7 44.44 Favored Pre-proline 0 N--CA 1.498 1.943 0 O-C-N 121.31 -0.869 . . . . 0.0 112.3 -179.662 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.567 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.3 Cg_endo -60.43 -26.23 82.26 Favored 'Trans proline' 0 N--CA 1.494 1.539 0 O-C-N 123.252 1.133 . . . . 0.0 110.343 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.2 tmtt? -70.31 -45.38 66.35 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 178.112 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 47.8 mm -58.83 -28.79 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 CA-C-O 121.173 0.511 . . . . 0.0 110.309 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.567 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.7 mmmm -73.27 -33.65 65.36 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.593 -0.692 . . . . 0.0 110.547 -177.247 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 13.1 t -67.69 -23.53 65.31 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.397 -0.814 . . . . 0.0 110.636 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -116.09 -14.42 11.18 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.414 -0.804 . . . . 0.0 111.247 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.671 ' HB3' HD23 ' A' ' 34' ' ' LEU . 44.4 m80 -130.62 94.7 28.54 Favored Pre-proline 0 N--CA 1.496 1.834 0 O-C-N 121.301 -0.874 . . . . 0.0 109.376 179.377 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -74.95 -38.72 1.49 Allowed 'Trans proline' 0 C--N 1.315 -1.192 0 O-C-N 123.465 1.245 . . . . 0.0 110.401 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.416 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -71.99 -22.57 78.74 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 109.864 -1.294 . . . . 0.0 109.864 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.671 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -52.07 86.79 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.627 -0.925 . . . . 0.0 111.775 -179.312 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.416 ' N ' ' O ' ' A' ' 33' ' ' GLY . 17.2 m -76.27 172.06 13.5 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.513 -0.742 . . . . 0.0 109.653 179.545 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 44.9 mm -56.87 -27.49 26.45 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.975 0 O-C-N 121.407 -0.808 . . . . 0.0 110.095 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.32 -63.78 4.72 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.412 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 17.7 t70 -74.07 -32.35 63.24 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.574 -0.956 . . . . 0.0 110.61 179.796 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.44 ' OG1' HD12 ' A' ' 34' ' ' LEU . 89.8 m -66.34 -33.86 76.68 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.304 -0.872 . . . . 0.0 110.162 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.1 -31.65 68.06 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.629 -0.669 . . . . 0.0 109.956 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -102.2 -8.05 21.65 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.604 -0.685 . . . . 0.0 111.543 -179.603 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.1 OUTLIER -87.38 3.64 46.19 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.001 -1.062 . . . . 0.0 110.203 179.062 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.8 mt -102.21 -33.87 9.47 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.023 -1.048 . . . . 0.0 109.493 179.093 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -68.48 -31.0 73.3 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.427 -1.469 . . . . 0.0 109.427 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -56.93 -45.8 82.49 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.501 -0.999 . . . . 0.0 110.241 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 25.8 mtt -77.25 -49.6 14.71 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.642 -0.661 . . . . 0.0 109.646 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 73.3 t-105 -54.93 -22.14 14.02 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.613 -0.679 . . . . 0.0 110.879 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.0 p -88.87 -35.26 16.65 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.322 -0.861 . . . . 0.0 109.885 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.13 -34.98 77.39 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.629 -0.669 . . . . 0.0 109.821 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 87.3 mm-40 -63.08 157.6 21.77 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.59 -0.694 . . . . 0.0 109.809 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.2 m -147.33 103.65 3.58 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.514 -0.741 . . . . 0.0 110.339 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 52.95 51.95 14.84 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.472 -0.768 . . . . 0.0 110.994 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.6 tppt? -150.77 -69.77 0.18 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.498 -0.751 . . . . 0.0 109.939 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -64.39 -36.31 83.74 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.353 -0.842 . . . . 0.0 110.437 -179.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -93.28 19.44 8.16 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.436 -0.79 . . . . 0.0 111.358 -179.317 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.402 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 4.3 mt-30 -92.23 -52.13 0.28 Allowed Pre-proline 0 N--CA 1.496 1.831 0 O-C-N 121.398 -0.814 . . . . 0.0 110.415 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.402 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 55.8 Cg_endo -83.23 -28.53 1.47 Allowed 'Trans proline' 0 C--N 1.319 -0.975 0 O-C-N 123.074 1.039 . . . . 0.0 110.275 179.775 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -84.28 1.83 42.98 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.543 -0.723 . . . . 0.0 111.649 -179.051 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.07 -24.65 16.23 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.082 -1.012 . . . . 0.0 110.704 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -75.87 -21.42 57.21 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.413 -0.804 . . . . 0.0 110.217 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 20.0 tttp -59.93 -44.66 94.22 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.46 -0.775 . . . . 0.0 109.932 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.68 -10.41 59.33 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.532 -0.73 . . . . 0.0 110.511 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.09 5.38 37.97 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.235 -0.916 . . . . 0.0 110.383 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 19.9 mmmt -105.48 -33.13 8.23 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.246 -0.909 . . . . 0.0 109.334 179.139 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.7 mp -80.03 2.87 22.11 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.881 -0.512 . . . . 0.0 111.052 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -95.92 -26.0 15.76 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.081 -1.012 . . . . 0.0 110.009 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -84.88 -15.13 45.68 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.545 -0.722 . . . . 0.0 110.588 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -103.19 -28.83 11.68 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.38 -0.825 . . . . 0.0 109.715 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.453 ' O ' HG22 ' A' ' 73' ' ' ILE . 20.6 t80 -74.61 -53.47 9.3 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.752 -0.593 . . . . 0.0 109.868 179.653 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -68.78 -9.63 51.99 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.737 -0.602 . . . . 0.0 111.587 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 38.5 mttm -104.29 -31.81 9.39 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.143 -0.973 . . . . 0.0 110.779 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -93.99 -28.68 15.64 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.494 -0.754 . . . . 0.0 111.136 -179.369 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.453 HG22 ' O ' ' A' ' 69' ' ' TYR . 3.5 tp -69.42 -22.13 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 O-C-N 121.426 -0.796 . . . . 0.0 110.917 -179.392 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.28 -49.96 67.56 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.42 -0.8 . . . . 0.0 110.13 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -83.15 -19.54 36.45 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.599 -0.688 . . . . 0.0 110.591 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -67.87 -26.53 66.07 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.412 -0.805 . . . . 0.0 110.487 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -87.26 -80.23 0.26 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.471 -0.768 . . . . 0.0 110.377 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -172.26 48.36 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.324 -0.86 . . . . 0.0 110.126 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.0 mmtm . . . . . 0 N--CA 1.494 1.74 0 CA-C-O 117.969 -1.015 . . . . 0.0 110.311 -179.917 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.669 0 CA-C-O 121.175 0.512 . . . . 0.0 110.124 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.98 122.19 32.77 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.521 -0.737 . . . . 0.0 110.188 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 23.3 ttpt -170.69 155.77 4.97 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.526 -0.734 . . . . 0.0 110.143 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -169.41 -157.72 0.18 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.511 -0.743 . . . . 0.0 109.863 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.03 145.04 90.04 Favored Pre-proline 0 N--CA 1.495 1.811 0 O-C-N 121.598 -0.689 . . . . 0.0 110.274 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -74.7 -33.82 4.71 Favored 'Trans proline' 0 C--N 1.318 -1.056 0 O-C-N 123.353 1.186 . . . . 0.0 110.485 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 31.1 t30 -79.29 -20.23 48.54 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.644 -0.66 . . . . 0.0 110.797 -179.303 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -88.69 136.56 30.93 Favored Pre-proline 0 N--CA 1.494 1.749 0 O-C-N 121.332 -0.855 . . . . 0.0 109.751 179.536 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -73.1 99.74 1.14 Allowed 'Trans proline' 0 C--N 1.319 -0.984 0 O-C-N 123.111 1.058 . . . . 0.0 110.412 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.3 pttt -59.93 -163.65 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.615 -0.678 . . . . 0.0 110.363 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -64.3 141.05 98.09 Favored Pre-proline 0 N--CA 1.496 1.837 0 O-C-N 121.543 -0.723 . . . . 0.0 110.236 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -75.66 132.11 14.24 Favored 'Trans proline' 0 C--N 1.318 -1.063 0 O-C-N 123.26 1.137 . . . . 0.0 109.852 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.691 ' CB ' HD21 ' A' ' 18' ' ' LEU . 49.2 Cg_endo -81.23 -171.2 1.17 Allowed 'Trans proline' 0 C--N 1.317 -1.116 0 O-C-N 123.237 1.125 . . . . 0.0 110.352 -179.611 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.498 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 32.1 t -166.32 63.02 0.1 Allowed 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.524 -0.735 . . . . 0.0 110.582 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 65.75 -79.0 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.173 -0.954 . . . . 0.0 110.329 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.5 ' CE2' ' CD1' ' A' ' 47' ' ' TRP . 2.8 t80 -47.56 -49.07 27.39 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.217 -0.927 . . . . 0.0 111.403 -179.421 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -58.01 -30.25 65.95 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.658 -0.651 . . . . 0.0 110.074 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.691 HD21 ' CB ' ' A' ' 13' ' ' PRO . 36.0 mt -79.04 -31.76 44.7 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.48 -0.763 . . . . 0.0 110.489 -179.607 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.5 ' CE1' ' CZ ' ' A' ' 23' ' ' TYR . 59.4 t80 -79.2 -55.04 5.39 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.518 -0.739 . . . . 0.0 110.669 -179.349 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.438 ' SG ' HD13 ' A' ' 43' ' ' LEU . 5.7 t -56.7 -54.63 43.98 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.406 -0.809 . . . . 0.0 110.581 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 84.2 p -55.88 -21.52 20.54 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.444 -0.785 . . . . 0.0 110.967 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.5 mm-40 -101.23 -24.87 14.17 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.398 -0.814 . . . . 0.0 110.828 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.5 ' CZ ' ' CE1' ' A' ' 19' ' ' PHE . 8.0 m-85 -95.58 11.83 31.79 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.43 -0.794 . . . . 0.0 111.456 -179.293 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.524 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 4.5 mtt180 -87.1 -45.13 0.53 Allowed Pre-proline 0 N--CA 1.488 1.454 0 O-C-N 121.173 -0.955 . . . . 0.0 112.263 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.598 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.0 Cg_endo -66.76 -16.93 51.67 Favored 'Trans proline' 0 N--CA 1.49 1.275 0 O-C-N 122.899 0.947 . . . . 0.0 110.449 -179.203 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.8 tmtt? -71.69 -48.74 45.37 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 178.116 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 26.9 mm -56.67 -33.38 40.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 CA-C-O 121.376 0.608 . . . . 0.0 110.315 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.598 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 4.6 mmmm -72.1 -38.42 69.35 Favored 'General case' 0 N--CA 1.497 1.92 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.337 -177.072 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.7 t -57.81 -26.29 61.77 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.401 -0.812 . . . . 0.0 110.693 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -114.92 -22.68 9.48 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.53 -0.731 . . . . 0.0 110.721 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.741 ' HB3' HD23 ' A' ' 34' ' ' LEU . 36.5 m80 -122.1 95.7 47.17 Favored Pre-proline 0 N--CA 1.496 1.86 0 O-C-N 121.393 -0.817 . . . . 0.0 109.649 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -75.29 -36.2 2.51 Favored 'Trans proline' 0 C--N 1.316 -1.155 0 O-C-N 123.418 1.22 . . . . 0.0 110.346 -179.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.403 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -75.5 -17.87 80.02 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 110.203 -1.159 . . . . 0.0 110.203 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.741 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -55.79 86.99 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.253 0 O-C-N 121.563 -0.963 . . . . 0.0 111.191 -179.469 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.403 ' N ' ' O ' ' A' ' 33' ' ' GLY . 40.6 t -72.44 171.57 12.04 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.581 -0.7 . . . . 0.0 110.011 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.7 mm -55.84 -28.99 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.072 0 O-C-N 121.411 -0.806 . . . . 0.0 110.125 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.91 -64.15 4.45 Favored Glycine 0 N--CA 1.493 2.471 0 N-CA-C 109.178 -1.569 . . . . 0.0 109.178 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.593 ' HB3' HD13 ' A' ' 34' ' ' LEU . 13.7 t70 -72.19 -34.01 68.09 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.546 -0.973 . . . . 0.0 110.438 179.626 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 96.4 m -64.21 -33.15 75.15 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.338 -0.851 . . . . 0.0 110.151 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.01 -36.97 69.88 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.638 -0.664 . . . . 0.0 110.062 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -96.24 -9.56 30.09 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.581 -0.699 . . . . 0.0 111.888 -179.332 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -88.8 7.33 34.63 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 120.986 -1.072 . . . . 0.0 110.258 179.158 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.438 HD13 ' SG ' ' A' ' 20' ' ' CYS . 16.2 mt -105.6 -30.18 9.66 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.053 -1.029 . . . . 0.0 109.584 179.162 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.65 -28.83 73.53 Favored Glycine 0 N--CA 1.493 2.44 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -55.02 -44.16 74.33 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.437 -1.037 . . . . 0.0 110.556 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 34.5 mtm -82.31 -46.74 13.23 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.541 -0.725 . . . . 0.0 109.912 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' TRP . . . . . 0.5 ' CD1' ' CE2' ' A' ' 16' ' ' PHE . 74.6 t-105 -54.68 -22.03 12.53 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.628 -0.67 . . . . 0.0 111.06 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 11.1 t -97.5 -33.16 11.47 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.359 -0.838 . . . . 0.0 110.216 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -62.73 -36.35 82.73 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.566 -0.709 . . . . 0.0 110.032 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 13.4 mm-40 -58.9 156.98 10.5 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.521 -0.737 . . . . 0.0 110.504 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.8 t -86.6 -148.43 0.13 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.671 -0.643 . . . . 0.0 109.369 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.67 49.26 1.77 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.201 -0.937 . . . . 0.0 110.335 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 17.3 mtmm -126.64 -40.19 1.94 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.523 -0.735 . . . . 0.0 110.29 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -55.79 -32.66 63.7 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.366 -0.834 . . . . 0.0 110.845 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.5 tttm -103.24 26.28 8.5 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.41 -0.806 . . . . 0.0 110.931 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.441 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 3.9 mt-30 -99.0 -55.0 0.18 Allowed Pre-proline 0 N--CA 1.495 1.823 0 O-C-N 121.288 -0.882 . . . . 0.0 110.655 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.441 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.0 Cg_endo -83.94 -35.15 0.23 Allowed 'Trans proline' 0 C--N 1.321 -0.912 0 O-C-N 122.918 0.957 . . . . 0.0 110.779 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -81.54 4.33 21.72 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.411 -0.806 . . . . 0.0 111.446 -179.302 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.408 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -96.71 -23.0 16.65 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.976 -1.077 . . . . 0.0 110.731 -179.806 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -75.61 -22.65 56.69 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.458 -0.777 . . . . 0.0 110.239 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 66.0 tttt -60.93 -41.67 96.64 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.426 -0.796 . . . . 0.0 109.93 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.78 -11.34 60.76 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.586 -0.696 . . . . 0.0 110.58 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.68 6.13 36.29 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.327 -0.858 . . . . 0.0 110.503 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 24.7 mmtp -106.12 -33.85 7.73 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.216 -0.928 . . . . 0.0 109.281 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.1 mp -79.42 0.64 28.5 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.881 -0.512 . . . . 0.0 111.004 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 31.7 tttm -91.53 -26.03 18.96 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.171 -0.956 . . . . 0.0 109.839 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -85.06 -14.44 47.24 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.5 -0.75 . . . . 0.0 110.656 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 20.4 mtpt -102.92 -29.92 11.13 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.327 -0.858 . . . . 0.0 109.854 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.447 ' O ' HG22 ' A' ' 73' ' ' ILE . 21.0 t80 -75.1 -53.24 9.22 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.631 -0.668 . . . . 0.0 109.684 179.495 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -69.28 -9.02 51.3 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.639 -0.663 . . . . 0.0 111.47 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 43.8 mttm -109.02 -33.71 6.82 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.085 -1.009 . . . . 0.0 110.697 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -87.02 -33.95 19.39 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.418 -0.801 . . . . 0.0 111.003 -179.42 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.447 HG22 ' O ' ' A' ' 69' ' ' TYR . 3.2 tp -63.34 -19.95 25.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 O-C-N 121.433 -0.792 . . . . 0.0 110.909 -179.45 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.04 -48.16 66.41 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.311 -0.868 . . . . 0.0 109.838 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.3 -27.28 26.07 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.695 -0.628 . . . . 0.0 109.981 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.401 ' HB3' ' HA ' ' A' ' 73' ' ' ILE . 67.8 t80 -62.54 -29.43 70.56 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.608 -0.682 . . . . 0.0 110.102 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 46.3 mtp85 -73.93 -74.16 0.2 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.63 -0.669 . . . . 0.0 110.039 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 57.85 104.82 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.478 -0.764 . . . . 0.0 110.4 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.773 0 CA-C-O 118.052 -0.975 . . . . 0.0 110.246 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 32.6 ttm . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 121.089 0.471 . . . . 0.0 110.172 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.11 95.52 8.62 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.598 -0.689 . . . . 0.0 110.209 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 11.5 ttmt -170.04 -159.67 0.21 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.542 -0.724 . . . . 0.0 110.133 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -147.13 -155.26 0.61 Allowed 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.583 -0.698 . . . . 0.0 109.854 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.38 148.69 98.66 Favored Pre-proline 0 N--CA 1.496 1.848 0 O-C-N 121.371 -0.831 . . . . 0.0 110.084 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -73.01 -40.83 1.57 Allowed 'Trans proline' 0 C--N 1.317 -1.093 0 O-C-N 123.402 1.211 . . . . 0.0 110.468 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -79.65 0.85 28.5 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.548 -0.72 . . . . 0.0 111.282 -179.699 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -93.36 130.31 36.03 Favored Pre-proline 0 N--CA 1.494 1.758 0 O-C-N 121.114 -0.991 . . . . 0.0 109.879 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -74.06 89.26 1.04 Allowed 'Trans proline' 0 C--N 1.319 -0.986 0 O-C-N 123.137 1.072 . . . . 0.0 110.406 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -103.86 33.28 3.49 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.513 -0.742 . . . . 0.0 110.399 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -169.63 100.75 0.47 Allowed Pre-proline 0 N--CA 1.495 1.797 0 O-C-N 121.795 -0.566 . . . . 0.0 110.584 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.42 ' HB3' ' CD2' ' A' ' 69' ' ' TYR . 46.6 Cg_endo -75.26 116.46 4.55 Favored 'Trans proline' 0 C--N 1.319 -1.018 0 O-C-N 123.305 1.161 . . . . 0.0 110.168 179.616 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.649 ' HB2' HD21 ' A' ' 18' ' ' LEU . 46.7 Cg_endo -81.5 163.82 19.06 Favored 'Trans proline' 0 C--N 1.317 -1.087 0 O-C-N 123.255 1.134 . . . . 0.0 110.38 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.504 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 24.7 t -164.98 62.44 0.13 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.582 -0.699 . . . . 0.0 110.518 -179.878 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.504 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 65.48 -78.1 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.167 -0.958 . . . . 0.0 110.048 -179.504 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -47.66 -50.11 25.62 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.347 -0.845 . . . . 0.0 111.435 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -58.42 -37.23 74.94 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.538 -0.726 . . . . 0.0 109.924 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.77 HD11 ' HB2' ' A' ' 62' ' ' ALA . 43.7 mt -67.95 -39.71 83.38 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.642 -0.661 . . . . 0.0 110.104 -179.76 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.497 ' CE2' ' CE1' ' A' ' 23' ' ' TYR . 37.9 t80 -72.69 -52.88 13.4 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.667 -0.645 . . . . 0.0 110.868 -179.324 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.57 ' SG ' HD13 ' A' ' 43' ' ' LEU . 23.3 t -57.57 -50.51 72.86 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.527 -0.733 . . . . 0.0 110.716 -179.638 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 94.4 p -60.19 -26.97 66.76 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.525 -0.734 . . . . 0.0 110.844 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -95.36 -23.84 17.0 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.407 -0.808 . . . . 0.0 111.372 -179.156 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.497 ' CE1' ' CE2' ' A' ' 19' ' ' PHE . 7.0 m-85 -91.53 -33.64 15.08 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.278 -0.889 . . . . 0.0 111.003 -179.308 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.523 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 17.9 mtt180 -48.5 -52.72 41.57 Favored Pre-proline 0 N--CA 1.498 1.938 0 O-C-N 121.313 -0.867 . . . . 0.0 112.138 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.573 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.2 Cg_endo -59.65 -28.36 87.18 Favored 'Trans proline' 0 N--CA 1.495 1.597 0 O-C-N 123.265 1.14 . . . . 0.0 110.134 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.67 -44.42 74.1 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 178.109 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.3 mm -59.63 -31.09 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.112 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.573 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.4 mmmm -72.78 -38.24 67.35 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 120.032 -0.667 . . . . 0.0 110.575 -177.043 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.9 t -57.7 -26.43 61.72 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.384 -0.822 . . . . 0.0 110.756 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -115.25 -22.85 9.21 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.519 -0.738 . . . . 0.0 110.822 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.702 ' HB3' HD23 ' A' ' 34' ' ' LEU . 33.7 m80 -122.18 95.57 47.16 Favored Pre-proline 0 N--CA 1.496 1.87 0 O-C-N 121.452 -0.78 . . . . 0.0 109.635 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -75.13 -40.49 0.85 Allowed 'Trans proline' 0 C--N 1.315 -1.193 0 O-C-N 123.464 1.244 . . . . 0.0 110.189 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.405 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -70.21 -19.33 75.69 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.702 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -56.63 85.3 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.527 -0.984 . . . . 0.0 111.11 -179.509 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.405 ' N ' ' O ' ' A' ' 33' ' ' GLY . 66.3 m -73.4 174.45 8.14 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.432 -0.792 . . . . 0.0 109.836 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 41.3 mm -54.57 -33.22 26.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 O-C-N 121.393 -0.817 . . . . 0.0 110.238 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.05 -64.89 3.93 Favored Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.445 ' HB3' HD13 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -69.1 -36.06 77.13 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.613 -0.934 . . . . 0.0 110.267 179.516 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.0 m -62.66 -30.7 71.57 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.356 -0.84 . . . . 0.0 110.209 179.459 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.22 -44.26 38.47 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.51 -0.743 . . . . 0.0 110.119 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.403 ' HG2' ' HA ' ' A' ' 38' ' ' ASP . 0.7 OUTLIER -86.65 -14.15 43.49 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.542 -0.724 . . . . 0.0 111.784 -179.158 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.3 OUTLIER -87.04 6.95 29.88 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.92 -1.113 . . . . 0.0 110.453 179.319 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.57 HD13 ' SG ' ' A' ' 20' ' ' CYS . 14.6 mt -103.89 -29.58 10.89 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.089 -1.007 . . . . 0.0 109.664 179.355 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -66.83 -29.41 74.63 Favored Glycine 0 N--CA 1.492 2.427 0 N-CA-C 109.449 -1.46 . . . . 0.0 109.449 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -52.4 -44.23 65.24 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.474 -1.015 . . . . 0.0 110.731 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 17.4 mtt -86.32 -42.12 13.98 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.631 -0.668 . . . . 0.0 109.873 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' TRP . . . . . 0.424 ' CH2' ' HG3' ' A' ' 55' ' ' LYS . 73.8 t-105 -55.21 -23.18 20.81 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.577 -0.702 . . . . 0.0 110.894 -179.713 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 38.1 t -94.55 -32.89 13.26 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.44 -0.788 . . . . 0.0 110.006 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -62.69 -37.08 85.04 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.589 -0.694 . . . . 0.0 109.677 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -63.22 156.4 25.48 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.669 -0.645 . . . . 0.0 109.903 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.2 m -104.94 -152.3 0.46 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.733 -0.604 . . . . 0.0 109.382 179.635 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -84.61 54.19 2.94 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.389 -0.819 . . . . 0.0 109.92 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 52.5 mttm -130.04 -51.56 1.12 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.466 -0.771 . . . . 0.0 110.251 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -75.21 -23.46 57.62 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.478 -0.764 . . . . 0.0 111.347 -179.051 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.424 ' HG3' ' CH2' ' A' ' 47' ' ' TRP . 3.5 mppt? -89.89 -40.23 12.54 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.239 -0.913 . . . . 0.0 110.911 -179.396 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.401 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 7.7 mm100 -43.72 -56.71 6.8 Favored Pre-proline 0 N--CA 1.508 2.437 0 O-C-N 121.585 -0.697 . . . . 0.0 112.497 -178.842 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.401 ' HD2' ' N ' ' A' ' 56' ' ' GLN . 45.6 Cg_endo -70.47 -35.77 10.02 Favored 'Trans proline' 0 C--N 1.316 -1.164 0 O-C-N 122.993 0.996 . . . . 0.0 110.194 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -76.04 -9.86 58.96 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.608 -0.682 . . . . 0.0 110.786 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -76.5 -58.47 3.26 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.218 -0.926 . . . . 0.0 110.005 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -48.81 -27.95 3.36 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.6 -0.688 . . . . 0.0 111.491 -179.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 41.5 tttt -58.35 -53.33 59.55 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.395 -0.815 . . . . 0.0 109.984 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.77 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -73.52 -9.92 59.18 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.581 -0.7 . . . . 0.0 110.436 179.116 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.92 -0.16 47.19 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.355 -0.841 . . . . 0.0 110.081 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 20.2 mmtt -105.49 -28.12 11.0 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.136 -0.977 . . . . 0.0 109.733 179.264 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.6 mp -88.24 -10.39 49.86 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.837 -0.54 . . . . 0.0 110.18 178.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 5.3 tppt? -80.55 -32.75 36.6 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.388 -0.82 . . . . 0.0 109.202 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -67.94 -60.23 2.66 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 120.071 -0.652 . . . . 0.0 109.401 179.443 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.0 mmmt -57.37 -24.78 57.41 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.604 -0.685 . . . . 0.0 110.598 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.578 ' O ' HG22 ' A' ' 73' ' ' ILE . 12.8 t80 -73.27 -66.58 0.67 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.388 -0.82 . . . . 0.0 109.48 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -61.43 -16.23 44.8 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.848 -0.533 . . . . 0.0 111.38 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.8 ttmm -97.76 -24.19 15.57 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.176 -0.952 . . . . 0.0 111.231 -179.432 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -103.83 -30.1 10.58 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.398 -0.814 . . . . 0.0 110.862 -179.511 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.578 HG22 ' O ' ' A' ' 69' ' ' TYR . 7.7 tp -63.97 -27.45 42.84 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.839 0 O-C-N 121.368 -0.832 . . . . 0.0 110.313 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.15 -56.45 9.89 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.573 -0.705 . . . . 0.0 109.635 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.21 -24.37 66.6 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.688 -0.633 . . . . 0.0 109.931 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -67.67 -39.82 84.47 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.564 -0.71 . . . . 0.0 109.921 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 15.1 mtt180 -96.35 11.29 35.28 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.665 -0.647 . . . . 0.0 110.979 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 52.18 85.49 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.064 -1.023 . . . . 0.0 110.851 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt . . . . . 0 N--CA 1.494 1.752 0 CA-C-O 118.062 -0.97 . . . . 0.0 110.351 -179.993 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.5 tpt . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.143 0.497 . . . . 0.0 110.18 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 52.54 59.26 4.62 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.463 -0.773 . . . . 0.0 110.752 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 75.0 tttt -170.62 67.97 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.482 -0.762 . . . . 0.0 110.005 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.404 ' HE3' ' NH2' ' A' ' 11' ' ' ARG . 4.6 mttm -59.88 -76.93 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.592 -0.693 . . . . 0.0 110.523 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.778 ' HB2' ' HB3' ' A' ' 8' ' ' ALA . 3.9 m-20 -121.42 157.33 56.53 Favored Pre-proline 0 N--CA 1.494 1.733 0 O-C-N 121.467 -0.771 . . . . 0.0 110.783 -179.603 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -73.42 -15.79 24.79 Favored 'Trans proline' 0 N--CA 1.487 1.127 0 O-C-N 123.595 1.313 . . . . 0.0 111.269 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -113.54 -22.3 10.38 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.393 -0.817 . . . . 0.0 110.387 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.778 ' HB3' ' HB2' ' A' ' 5' ' ' ASP . . . -89.91 141.94 28.55 Favored Pre-proline 0 N--CA 1.494 1.773 0 O-C-N 121.466 -0.771 . . . . 0.0 110.099 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -74.76 126.19 9.96 Favored 'Trans proline' 0 C--N 1.318 -1.033 0 O-C-N 123.299 1.158 . . . . 0.0 110.419 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.97 -170.0 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.531 -0.731 . . . . 0.0 110.67 -179.731 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.404 ' NH2' ' HE3' ' A' ' 4' ' ' LYS . 1.0 OUTLIER -67.72 145.61 98.15 Favored Pre-proline 0 N--CA 1.497 1.884 0 O-C-N 121.498 -0.751 . . . . 0.0 110.437 -179.742 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -76.28 129.65 11.39 Favored 'Trans proline' 0 C--N 1.318 -1.027 0 O-C-N 123.393 1.207 . . . . 0.0 109.883 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.692 ' CB ' HD21 ' A' ' 18' ' ' LEU . 50.4 Cg_endo -81.8 -173.65 1.86 Allowed 'Trans proline' 0 C--N 1.317 -1.113 0 O-C-N 123.264 1.139 . . . . 0.0 110.428 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.523 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 60.6 p -161.7 59.64 0.26 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.567 -0.708 . . . . 0.0 110.516 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.523 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 66.82 -76.88 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.083 -1.011 . . . . 0.0 110.169 -179.568 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.428 ' CE2' ' CD1' ' A' ' 47' ' ' TRP . 5.5 t80 -47.74 -49.88 26.97 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.298 -0.876 . . . . 0.0 111.348 -179.613 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -57.99 -35.98 71.98 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.643 -0.661 . . . . 0.0 109.982 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.692 HD21 ' CB ' ' A' ' 13' ' ' PRO . 41.6 mt -70.9 -36.85 72.9 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.532 -0.73 . . . . 0.0 110.265 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.503 ' CZ ' ' CE2' ' A' ' 23' ' ' TYR . 50.8 t80 -76.15 -54.23 7.12 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.563 -0.71 . . . . 0.0 110.497 -179.412 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.46 ' SG ' HD13 ' A' ' 43' ' ' LEU . 48.8 t -58.03 -51.78 68.25 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.565 -0.709 . . . . 0.0 110.616 -179.63 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 72.2 p -57.84 -22.95 50.46 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.536 -0.728 . . . . 0.0 111.036 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.4 mm-40 -102.6 -24.98 13.73 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.354 -0.841 . . . . 0.0 111.446 -179.22 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.503 ' CE2' ' CZ ' ' A' ' 19' ' ' PHE . 10.4 m-85 -93.09 12.61 23.59 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.308 -0.87 . . . . 0.0 111.595 -179.323 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.532 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 3.6 mtp180 -85.76 -45.33 0.61 Allowed Pre-proline 0 N--CA 1.489 1.478 0 O-C-N 121.145 -0.972 . . . . 0.0 112.03 179.302 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.589 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 37.7 Cg_endo -65.83 -15.41 48.94 Favored 'Trans proline' 0 N--CA 1.49 1.318 0 O-C-N 122.883 0.938 . . . . 0.0 110.483 -179.13 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.5 tmtm? -73.4 -51.64 16.6 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 177.766 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 37.5 mm -52.61 -33.71 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 CA-C-O 121.465 0.65 . . . . 0.0 110.317 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.589 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.7 mmmm -72.18 -37.49 69.3 Favored 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.279 -177.243 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.9 t -59.13 -25.48 63.89 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.466 -0.771 . . . . 0.0 110.753 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -116.8 -23.37 8.13 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.421 -0.8 . . . . 0.0 110.873 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.727 ' HB3' HD23 ' A' ' 34' ' ' LEU . 37.4 m80 -120.65 96.33 48.87 Favored Pre-proline 0 N--CA 1.496 1.87 0 O-C-N 121.403 -0.81 . . . . 0.0 109.574 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -75.32 -32.66 4.86 Favored 'Trans proline' 0 C--N 1.316 -1.16 0 O-C-N 123.465 1.245 . . . . 0.0 110.464 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -80.45 -13.44 81.7 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.727 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -60.83 83.19 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.381 -1.07 . . . . 0.0 110.987 -179.5 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 78.2 p -74.72 170.64 15.44 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.541 -0.724 . . . . 0.0 109.78 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.2 mm -52.6 -27.7 11.79 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.155 0 O-C-N 121.218 -0.926 . . . . 0.0 110.369 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -61.56 -71.67 0.77 Allowed Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.118 -1.593 . . . . 0.0 109.118 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.426 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 7.1 t70 -67.33 -25.01 65.8 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.642 -0.917 . . . . 0.0 110.623 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 64.5 m -71.64 -46.98 57.37 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.549 -0.719 . . . . 0.0 109.962 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -52.55 -41.79 63.85 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.545 -0.722 . . . . 0.0 110.069 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -86.03 -10.15 55.52 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.72 -0.613 . . . . 0.0 111.231 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.426 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -74.21 -59.48 2.71 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.004 -1.06 . . . . 0.0 109.449 179.236 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.46 HD13 ' SG ' ' A' ' 20' ' ' CYS . 14.5 mt -53.51 -27.74 27.31 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.806 -0.559 . . . . 0.0 110.899 -179.767 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -60.34 -45.44 96.15 Favored Glycine 0 N--CA 1.496 2.669 0 N-CA-C 109.614 -1.394 . . . . 0.0 109.614 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -62.32 -48.89 77.84 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.567 -0.96 . . . . 0.0 109.878 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 17.5 mmt -60.13 -24.5 64.75 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.588 -0.695 . . . . 0.0 110.551 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' TRP . . . . . 0.428 ' CD1' ' CE2' ' A' ' 16' ' ' PHE . 72.4 t-105 -79.71 -48.93 12.84 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.537 -0.727 . . . . 0.0 109.473 179.539 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.1 t -67.66 -26.96 66.46 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.64 -0.663 . . . . 0.0 110.007 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -68.22 -44.72 75.13 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.557 -0.714 . . . . 0.0 109.596 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 19.7 mm-40 -57.17 153.3 12.06 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.618 -0.676 . . . . 0.0 110.372 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.4 t -98.34 -152.47 0.4 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.649 -0.657 . . . . 0.0 109.533 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -88.01 49.55 1.82 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.38 -0.825 . . . . 0.0 110.082 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -127.48 -49.14 1.41 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.512 -0.743 . . . . 0.0 110.289 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -67.2 -27.4 67.23 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.461 -0.774 . . . . 0.0 110.74 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.3 tttt -81.43 -36.53 29.34 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.414 -0.804 . . . . 0.0 110.713 -179.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -43.83 -52.95 13.73 Favored Pre-proline 0 N--CA 1.507 2.386 0 O-C-N 121.507 -0.745 . . . . 0.0 112.324 -178.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -78.53 -37.19 0.73 Allowed 'Trans proline' 0 C--N 1.315 -1.206 0 O-C-N 123.172 1.09 . . . . 0.0 111.073 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.59 1.42 46.1 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.433 -0.792 . . . . 0.0 112.102 -178.362 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.469 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -97.69 -23.86 15.76 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.023 -1.048 . . . . 0.0 110.601 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -77.85 -22.56 49.72 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.442 -0.786 . . . . 0.0 110.29 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 65.4 tttt -61.32 -43.14 99.37 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.411 -0.806 . . . . 0.0 109.944 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -74.2 -10.84 60.01 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.619 -0.676 . . . . 0.0 110.658 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -86.08 3.06 44.17 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.299 -0.875 . . . . 0.0 110.451 179.11 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 36.7 mmtm -105.64 -31.61 8.84 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.181 -0.949 . . . . 0.0 109.741 179.381 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.5 mp -82.38 1.73 35.83 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.802 -0.561 . . . . 0.0 110.624 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 65.7 tttt -91.49 -28.46 17.59 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.205 -0.934 . . . . 0.0 109.629 179.454 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -87.07 -10.89 51.81 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.61 -0.681 . . . . 0.0 110.613 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 34.3 mmtt -103.73 -34.19 8.67 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.336 -0.853 . . . . 0.0 109.551 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.421 ' O ' HG22 ' A' ' 73' ' ' ILE . 24.8 t80 -73.78 -53.83 9.41 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.74 -0.6 . . . . 0.0 109.685 179.488 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -68.41 -12.31 60.96 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.7 -0.625 . . . . 0.0 111.219 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.83 -31.73 8.7 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.288 -0.882 . . . . 0.0 110.972 -179.471 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -91.22 -35.64 14.39 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.403 -0.811 . . . . 0.0 111.096 -179.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.421 HG22 ' O ' ' A' ' 69' ' ' TYR . 4.5 tp -53.66 -38.88 35.94 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 O-C-N 121.308 -0.87 . . . . 0.0 110.95 -179.179 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.514 ' HB1' ' HB3' ' A' ' 79' ' ' LYS . . . -56.59 -53.41 57.92 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.497 -0.752 . . . . 0.0 110.392 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.62 -32.44 73.92 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.594 -0.691 . . . . 0.0 109.646 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.691 ' CZ ' ' HB2' ' A' ' 8' ' ' ALA . 79.7 t80 -62.23 -41.99 98.91 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.698 -0.627 . . . . 0.0 110.1 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 11.1 mtp180 -82.78 -80.68 0.17 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.57 -0.706 . . . . 0.0 110.092 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -168.53 44.11 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.306 -0.871 . . . . 0.0 110.199 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.514 ' HB3' ' HB1' ' A' ' 74' ' ' ALA . 22.6 mtmt . . . . . 0 N--CA 1.493 1.701 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.276 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.7 ttt . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 121.119 0.485 . . . . 0.0 110.2 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -98.3 84.46 3.24 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.52 -0.737 . . . . 0.0 110.253 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.8 ttpt -60.01 -48.79 80.24 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.558 -0.714 . . . . 0.0 110.289 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 35.2 mttp -60.01 -74.75 0.07 Allowed 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.597 -0.689 . . . . 0.0 110.4 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -167.35 158.76 10.24 Favored Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.457 -0.777 . . . . 0.0 110.353 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.98 -39.71 2.14 Favored 'Trans proline' 0 C--N 1.318 -1.048 0 O-C-N 123.359 1.189 . . . . 0.0 110.296 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 11.0 p30 -78.94 -7.58 58.14 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.61 -0.681 . . . . 0.0 111.108 -179.241 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -95.16 135.47 23.4 Favored Pre-proline 0 N--CA 1.494 1.725 0 O-C-N 121.23 -0.918 . . . . 0.0 109.44 179.344 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -72.3 102.41 1.37 Allowed 'Trans proline' 0 C--N 1.318 -1.05 0 O-C-N 123.189 1.1 . . . . 0.0 110.688 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.61 -161.03 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.638 -0.663 . . . . 0.0 109.974 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.33 140.96 93.13 Favored Pre-proline 0 N--CA 1.497 1.921 0 O-C-N 121.236 -0.915 . . . . 0.0 110.099 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -75.24 135.52 18.75 Favored 'Trans proline' 0 C--N 1.318 -1.077 0 O-C-N 123.314 1.165 . . . . 0.0 109.767 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.543 ' CB ' HD21 ' A' ' 18' ' ' LEU . 49.8 Cg_endo -80.04 -177.32 3.73 Favored 'Trans proline' 0 C--N 1.317 -1.092 0 O-C-N 123.285 1.15 . . . . 0.0 110.262 -179.677 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.532 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 23.2 t -159.36 59.5 0.4 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.418 -0.801 . . . . 0.0 110.47 -179.668 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.532 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 67.6 -75.53 0.06 Allowed 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.196 -0.94 . . . . 0.0 110.172 -179.508 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -48.49 -48.73 37.82 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.333 -0.855 . . . . 0.0 111.271 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -59.66 -41.41 90.53 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.511 -0.743 . . . . 0.0 109.189 179.279 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.543 HD21 ' CB ' ' A' ' 13' ' ' PRO . 57.1 mt -62.05 -46.3 89.75 Favored 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.993 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -64.31 -50.37 68.09 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.603 -0.686 . . . . 0.0 110.006 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.596 ' SG ' HD13 ' A' ' 43' ' ' LEU . 6.6 t -68.64 -19.01 64.4 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.59 -0.693 . . . . 0.0 110.28 179.289 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.7 t -76.95 -17.69 58.74 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.286 -0.884 . . . . 0.0 111.725 -178.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -128.58 -14.45 4.65 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.02 -1.05 . . . . 0.0 112.776 -178.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.4 ' HB3' ' CD2' ' A' ' 43' ' ' LEU . 12.4 m-85 -87.92 13.85 10.06 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 120.944 -1.097 . . . . 0.0 111.671 -179.19 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.641 ' HG2' HD11 ' A' ' 43' ' ' LEU . 11.2 mtp180 -87.53 -45.97 0.5 Allowed Pre-proline 0 N--CA 1.49 1.556 0 O-C-N 121.162 -0.961 . . . . 0.0 112.386 179.746 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.578 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.1 Cg_endo -65.92 -15.97 50.9 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 O-C-N 122.981 0.99 . . . . 0.0 110.663 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.9 tmtt? -73.28 -52.34 14.31 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 177.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 42.1 mm -52.53 -30.98 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 CA-C-O 121.36 0.6 . . . . 0.0 110.439 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.578 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 6.2 mmmm -73.11 -36.78 66.82 Favored 'General case' 0 N--CA 1.498 1.945 0 C-N-CA 120.111 -0.636 . . . . 0.0 110.334 -177.246 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.2 t -58.7 -25.26 62.69 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.429 -0.795 . . . . 0.0 110.679 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -118.26 -22.84 7.52 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.515 -0.741 . . . . 0.0 110.949 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.72 ' HB3' HD23 ' A' ' 34' ' ' LEU . 34.4 m80 -121.11 96.54 48.34 Favored Pre-proline 0 N--CA 1.496 1.863 0 O-C-N 121.281 -0.887 . . . . 0.0 109.669 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -75.23 -35.58 2.91 Favored 'Trans proline' 0 C--N 1.315 -1.192 0 O-C-N 123.426 1.224 . . . . 0.0 110.513 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.78 -11.27 85.59 Favored Glycine 0 N--CA 1.492 2.409 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.72 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -64.44 80.91 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.209 -1.171 . . . . 0.0 110.55 -179.818 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.4 t -75.03 173.69 10.38 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.522 -0.737 . . . . 0.0 109.485 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 39.0 mm -51.08 -32.02 11.59 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.213 0 O-C-N 121.187 -0.946 . . . . 0.0 110.503 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.6 -74.4 0.37 Allowed Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.223 -1.551 . . . . 0.0 109.223 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.97 -23.24 67.33 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.657 -0.908 . . . . 0.0 110.85 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 38.9 m -72.24 -46.22 56.93 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.366 -0.834 . . . . 0.0 109.904 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -53.34 -49.48 67.01 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.416 -0.803 . . . . 0.0 110.073 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.97 -12.37 60.33 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.763 -0.586 . . . . 0.0 111.152 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.57 -57.93 3.66 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.154 -0.966 . . . . 0.0 109.631 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.641 HD11 ' HG2' ' A' ' 24' ' ' ARG . 22.2 mt -54.5 -34.6 61.94 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.725 -0.609 . . . . 0.0 111.064 -179.667 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -61.02 -49.68 75.86 Favored Glycine 0 N--CA 1.494 2.558 0 N-CA-C 109.974 -1.25 . . . . 0.0 109.974 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -53.69 -35.59 61.27 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.401 -1.058 . . . . 0.0 110.833 -179.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 20.2 mmt -69.1 -50.95 43.55 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.621 -0.674 . . . . 0.0 109.488 179.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 31.2 t-105 -51.37 -58.31 6.59 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.708 -0.62 . . . . 0.0 110.818 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 12.6 t -60.97 -34.57 74.97 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.517 -0.739 . . . . 0.0 110.382 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -58.48 -41.6 85.65 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.576 -0.702 . . . . 0.0 110.432 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 41.7 mm-40 -67.17 167.79 11.47 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.46 -0.775 . . . . 0.0 110.029 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.1 m -141.06 96.09 2.94 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.53 -0.731 . . . . 0.0 110.506 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 51.84 46.4 26.63 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.409 -0.807 . . . . 0.0 111.133 179.673 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 11.3 tmtt? -141.48 -63.03 0.46 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.538 -0.726 . . . . 0.0 110.254 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -61.89 -17.45 56.64 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.581 -0.699 . . . . 0.0 110.904 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 53.1 tttm -99.29 -32.38 11.22 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.238 -0.913 . . . . 0.0 110.765 -179.559 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.427 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 7.4 mt-30 -43.51 -56.72 6.54 Favored Pre-proline 0 N--CA 1.508 2.461 0 O-C-N 121.469 -0.769 . . . . 0.0 112.273 -178.788 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.427 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.4 Cg_endo -78.75 -35.14 1.11 Allowed 'Trans proline' 0 C--N 1.316 -1.18 0 O-C-N 123.059 1.031 . . . . 0.0 110.658 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -83.85 5.8 23.85 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.445 -0.784 . . . . 0.0 112.186 -178.331 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.528 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -101.35 -21.36 14.86 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 120.965 -1.084 . . . . 0.0 110.625 179.808 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -78.88 -23.55 44.77 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.422 -0.798 . . . . 0.0 110.277 179.489 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 48.3 tttm -62.91 -41.35 99.43 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.479 -0.763 . . . . 0.0 109.985 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.406 ' HB1' ' HA ' ' A' ' 14' ' ' SER . . . -71.12 -9.21 57.67 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.596 -0.69 . . . . 0.0 110.896 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -89.07 4.57 47.94 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.232 -0.917 . . . . 0.0 110.646 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -105.89 -32.61 8.27 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.128 -0.982 . . . . 0.0 109.611 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.9 mp -79.3 1.18 25.88 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.826 -0.546 . . . . 0.0 111.034 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 72.7 tttt -93.2 -23.37 18.57 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.161 -0.962 . . . . 0.0 109.957 179.42 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -85.24 -12.66 52.0 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.377 -0.827 . . . . 0.0 110.654 179.48 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -102.8 -31.24 10.4 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.327 -0.858 . . . . 0.0 109.52 179.474 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.487 ' O ' HG22 ' A' ' 73' ' ' ILE . 22.2 t80 -74.65 -55.08 6.27 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.799 -0.563 . . . . 0.0 109.671 179.532 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -66.3 -12.31 55.74 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.756 -0.59 . . . . 0.0 111.437 -179.433 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -103.68 -31.13 10.03 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.187 -0.945 . . . . 0.0 110.612 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -92.38 -31.12 15.45 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.445 -0.785 . . . . 0.0 110.955 -179.394 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.487 HG22 ' O ' ' A' ' 69' ' ' TYR . 2.6 tp -66.61 -20.21 26.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 121.361 -0.837 . . . . 0.0 110.839 -179.437 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.72 -47.66 71.63 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.293 -0.879 . . . . 0.0 109.847 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -82.78 -22.24 34.34 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.679 -0.638 . . . . 0.0 110.421 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -63.3 -36.6 84.22 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.447 -0.783 . . . . 0.0 110.097 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 36.3 mtt180 -95.73 17.43 15.05 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.528 -0.733 . . . . 0.0 110.778 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -93.47 46.3 1.19 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.254 -0.904 . . . . 0.0 110.189 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.8 ptmt . . . . . 0 N--CA 1.495 1.821 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.29 -179.988 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.4 tpp . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.053 0.454 . . . . 0.0 110.22 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.9 mttm -86.34 171.9 10.84 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.52 -0.738 . . . . 0.0 110.284 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -174.31 -36.1 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.496 -0.752 . . . . 0.0 110.57 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 20.8 mmtt -49.69 -71.62 0.06 Allowed 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.315 -0.865 . . . . 0.0 111.362 -179.417 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -172.29 154.95 3.36 Favored Pre-proline 0 N--CA 1.498 1.949 0 O-C-N 121.391 -0.818 . . . . 0.0 110.159 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -73.31 -31.91 8.76 Favored 'Trans proline' 0 C--N 1.318 -1.044 0 O-C-N 123.449 1.236 . . . . 0.0 110.28 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -79.11 -18.57 53.03 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.552 -0.718 . . . . 0.0 110.741 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -100.28 103.52 23.81 Favored Pre-proline 0 N--CA 1.495 1.776 0 O-C-N 121.394 -0.817 . . . . 0.0 109.658 179.486 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.415 ' O ' ' CD1' ' A' ' 69' ' ' TYR . 55.6 Cg_endo -76.83 53.43 4.11 Favored 'Trans proline' 0 N--CA 1.488 1.174 0 O-C-N 123.167 1.088 . . . . 0.0 111.515 -179.456 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.5 tptt -71.97 164.22 26.48 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.021 -1.05 . . . . 0.0 110.228 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 49.17 94.83 0.04 OUTLIER Pre-proline 0 N--CA 1.5 2.056 0 O-C-N 121.579 -0.701 . . . . 0.0 111.604 179.705 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -73.52 136.51 23.83 Favored 'Trans proline' 0 C--N 1.316 -1.176 0 O-C-N 123.431 1.227 . . . . 0.0 109.769 179.405 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.736 ' HB2' HD21 ' A' ' 18' ' ' LEU . 49.6 Cg_endo -79.96 167.89 19.63 Favored 'Trans proline' 0 C--N 1.316 -1.134 0 O-C-N 123.273 1.144 . . . . 0.0 110.362 -179.65 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.517 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 57.5 p -161.37 66.38 0.28 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.569 -0.707 . . . . 0.0 110.456 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 65.79 -77.5 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.166 -0.958 . . . . 0.0 110.015 -179.589 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -51.13 -42.63 60.86 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.246 -0.908 . . . . 0.0 110.924 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -63.99 -25.04 67.95 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.617 -0.677 . . . . 0.0 109.966 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.736 HD21 ' HB2' ' A' ' 13' ' ' PRO . 41.7 mt -84.6 -39.06 19.16 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.508 -0.745 . . . . 0.0 110.363 -179.581 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.501 ' CE2' ' CZ ' ' A' ' 23' ' ' TYR . 44.5 t80 -69.32 -50.44 46.52 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.578 -0.701 . . . . 0.0 110.464 -179.5 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 35.5 t -65.95 -33.46 75.86 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.541 -0.724 . . . . 0.0 110.083 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 29.4 t -82.16 1.17 37.51 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.513 -0.742 . . . . 0.0 111.599 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -133.96 1.9 3.33 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.975 -1.078 . . . . 0.0 111.881 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.501 ' CZ ' ' CE2' ' A' ' 19' ' ' PHE . 8.6 m-85 -110.88 -27.02 9.01 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 120.969 -1.082 . . . . 0.0 110.878 -179.646 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.523 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 18.5 mtp180 -49.14 -52.03 51.41 Favored Pre-proline 0 N--CA 1.497 1.916 0 O-C-N 121.326 -0.859 . . . . 0.0 112.252 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.571 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 35.7 Cg_endo -59.37 -29.11 89.34 Favored 'Trans proline' 0 N--CA 1.495 1.576 0 O-C-N 123.171 1.09 . . . . 0.0 110.28 -179.587 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.8 tmtm? -68.26 -43.75 77.13 Favored 'General case' 0 N--CA 1.493 1.675 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 178.148 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.1 mm -60.99 -30.27 47.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.177 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.571 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.1 mmmm -73.14 -38.2 66.35 Favored 'General case' 0 N--CA 1.497 1.881 0 C-N-CA 119.937 -0.705 . . . . 0.0 110.633 -177.113 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 13.8 t -56.94 -26.83 60.32 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.324 -0.86 . . . . 0.0 110.707 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -114.86 -24.65 8.56 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.567 -0.708 . . . . 0.0 110.738 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.712 ' HB3' HD23 ' A' ' 34' ' ' LEU . 30.5 m80 -120.63 95.69 48.96 Favored Pre-proline 0 N--CA 1.497 1.897 0 O-C-N 121.464 -0.773 . . . . 0.0 109.649 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -75.06 -41.49 0.64 Allowed 'Trans proline' 0 C--N 1.315 -1.193 0 O-C-N 123.409 1.215 . . . . 0.0 110.19 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.416 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -69.07 -19.93 74.31 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 110.077 -1.209 . . . . 0.0 110.077 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.712 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -56.42 84.98 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.528 -0.983 . . . . 0.0 111.175 -179.397 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.416 ' N ' ' O ' ' A' ' 33' ' ' GLY . 71.9 p -73.27 175.81 6.52 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.452 -0.78 . . . . 0.0 109.657 179.732 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 43.5 mm -56.31 -32.64 35.8 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 O-C-N 121.395 -0.816 . . . . 0.0 110.128 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.7 -65.18 3.67 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.26 -1.536 . . . . 0.0 109.26 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.406 ' HB3' HD13 ' A' ' 34' ' ' LEU . 0.7 OUTLIER -68.37 -36.55 79.36 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.56 -0.965 . . . . 0.0 110.299 179.573 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 93.8 m -63.29 -29.93 71.16 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.448 -0.782 . . . . 0.0 110.063 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.75 -44.89 39.44 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.559 -0.713 . . . . 0.0 109.795 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -86.71 -11.78 50.19 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.606 -0.684 . . . . 0.0 111.892 -179.22 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.404 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 11.5 tptt -87.83 6.75 33.81 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 120.813 -1.18 . . . . 0.0 110.495 179.292 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.9 mt -101.08 -27.76 13.08 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.193 -0.942 . . . . 0.0 109.515 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -68.96 -28.25 73.19 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.168 -1.573 . . . . 0.0 109.168 179.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -57.5 -54.9 41.62 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.445 -1.032 . . . . 0.0 109.875 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 33.6 mtt -68.48 -52.33 33.53 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 120.125 -0.63 . . . . 0.0 109.398 179.203 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' TRP . . . . . 0.438 ' CH2' ' HG2' ' A' ' 55' ' ' LYS . 54.6 t-105 -50.77 -58.02 6.96 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.49 -0.756 . . . . 0.0 110.936 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 26.6 t -59.19 -34.2 71.85 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.435 -0.791 . . . . 0.0 110.39 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -61.73 -40.88 96.64 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.596 -0.69 . . . . 0.0 109.973 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -60.0 155.52 16.63 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.635 -0.666 . . . . 0.0 110.307 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.6 m -106.49 -152.12 0.47 Allowed 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.01 58.72 3.01 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.332 -0.855 . . . . 0.0 109.953 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 8.8 tttp -139.93 -52.6 0.52 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.401 -0.812 . . . . 0.0 110.211 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -62.45 -25.56 68.04 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.511 -0.743 . . . . 0.0 110.586 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.438 ' HG2' ' CH2' ' A' ' 47' ' ' TRP . 14.7 mtpt -81.57 -34.47 31.02 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.404 -0.81 . . . . 0.0 110.607 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -44.64 -52.53 17.68 Favored Pre-proline 0 N--CA 1.507 2.387 0 O-C-N 121.572 -0.705 . . . . 0.0 111.986 -179.257 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -78.71 -38.22 0.53 Allowed 'Trans proline' 0 C--N 1.315 -1.227 0 O-C-N 123.263 1.138 . . . . 0.0 110.85 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.1 5.0 23.97 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.51 -0.744 . . . . 0.0 112.055 -178.548 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.44 -23.07 15.25 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.053 -1.029 . . . . 0.0 110.363 179.743 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -77.48 -26.22 51.11 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.474 -0.766 . . . . 0.0 110.214 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 72.8 tttt -59.57 -42.26 92.04 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.538 -0.726 . . . . 0.0 110.115 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.408 ' HB1' ' O ' ' A' ' 13' ' ' PRO . . . -69.48 -11.09 60.54 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.573 -0.705 . . . . 0.0 110.63 179.494 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.66 4.94 34.17 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.195 -0.941 . . . . 0.0 110.537 179.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 40.4 mmtt -105.82 -34.79 7.55 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.198 -0.939 . . . . 0.0 109.309 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.674 HD22 ' HG3' ' A' ' 13' ' ' PRO . 7.6 mp -82.36 -2.34 52.62 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.828 -0.545 . . . . 0.0 110.362 178.977 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 30.0 tptt -83.3 -33.94 25.83 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.27 -0.894 . . . . 0.0 109.112 179.166 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -67.7 -61.73 1.75 Allowed 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.168 179.209 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -58.87 -18.54 33.75 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.736 -0.602 . . . . 0.0 111.067 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.415 ' CD1' ' O ' ' A' ' 9' ' ' PRO . 9.5 t80 -78.49 -60.38 2.4 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.229 -0.919 . . . . 0.0 109.494 179.465 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -76.71 -1.04 25.89 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.599 -0.688 . . . . 0.0 111.561 -179.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.7 ttmt -113.0 -37.61 4.75 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.995 -1.066 . . . . 0.0 111.228 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -86.93 -31.19 20.82 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.417 -0.802 . . . . 0.0 111.284 -179.057 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.409 HG22 ' O ' ' A' ' 69' ' ' TYR . 3.0 tp -65.25 -17.33 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.434 -0.791 . . . . 0.0 111.129 -179.373 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.58 -48.28 64.61 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.344 -0.847 . . . . 0.0 109.87 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -88.21 -24.75 23.19 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.668 -0.645 . . . . 0.0 110.144 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.406 ' HB3' ' HA ' ' A' ' 73' ' ' ILE . 48.6 t80 -61.87 -31.39 71.66 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.504 -0.747 . . . . 0.0 110.275 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 29.7 mtt180 -71.26 -73.82 0.17 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.543 -0.723 . . . . 0.0 110.123 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 57.23 103.87 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.435 -0.791 . . . . 0.0 110.505 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 20.1 mttt . . . . . 0 N--CA 1.493 1.678 0 CA-C-O 118.067 -0.968 . . . . 0.0 110.212 179.939 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.9 ttp . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.086 0.469 . . . . 0.0 110.191 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.11 145.19 30.87 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.608 -0.683 . . . . 0.0 110.181 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -169.93 -65.31 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.528 -0.733 . . . . 0.0 110.125 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 16.6 mmmt -68.0 -74.97 0.11 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.556 -0.715 . . . . 0.0 110.18 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.426 ' HB2' ' HB3' ' A' ' 8' ' ' ALA . 5.9 m-20 -156.15 126.97 3.51 Favored Pre-proline 0 N--CA 1.493 1.711 0 O-C-N 121.552 -0.718 . . . . 0.0 109.986 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -72.43 -37.53 4.22 Favored 'Trans proline' 0 N--CA 1.486 1.06 0 O-C-N 123.127 1.067 . . . . 0.0 110.388 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -80.03 -6.47 57.66 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.618 -0.676 . . . . 0.0 111.172 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.426 ' HB3' ' HB2' ' A' ' 5' ' ' ASP . . . -103.51 136.05 19.28 Favored Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.106 -0.996 . . . . 0.0 110.205 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.404 ' O ' ' CD1' ' A' ' 69' ' ' TYR . 49.2 Cg_endo -77.07 89.1 1.34 Allowed 'Trans proline' 0 C--N 1.319 -0.986 0 O-C-N 123.191 1.101 . . . . 0.0 110.268 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.1 pttp -99.66 30.59 3.56 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.479 -0.763 . . . . 0.0 110.853 -179.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.53 100.57 0.43 Allowed Pre-proline 0 N--CA 1.497 1.896 0 O-C-N 121.7 -0.625 . . . . 0.0 110.811 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -76.26 118.69 5.03 Favored 'Trans proline' 0 C--N 1.319 -1.02 0 O-C-N 123.263 1.138 . . . . 0.0 110.1 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.701 ' HB2' HD21 ' A' ' 18' ' ' LEU . 48.3 Cg_endo -81.93 166.41 16.95 Favored 'Trans proline' 0 C--N 1.318 -1.077 0 O-C-N 123.236 1.124 . . . . 0.0 110.446 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.535 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 32.4 t -156.69 54.78 0.54 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.466 -0.771 . . . . 0.0 110.582 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.535 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 67.99 -76.23 0.06 Allowed 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.256 -0.902 . . . . 0.0 109.965 -179.527 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -48.81 -49.91 36.84 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.357 -0.839 . . . . 0.0 111.378 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.03 -40.73 81.62 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.541 -0.724 . . . . 0.0 109.629 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.701 HD21 ' HB2' ' A' ' 13' ' ' PRO . 59.9 mt -60.52 -48.07 83.37 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.695 -0.628 . . . . 0.0 110.159 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.409 ' CZ ' ' CE1' ' A' ' 23' ' ' TYR . 60.6 t80 -66.88 -50.19 63.27 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.674 -0.641 . . . . 0.0 110.443 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.462 ' SG ' HD13 ' A' ' 43' ' ' LEU . 1.5 m -64.07 -31.93 73.3 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.507 -0.746 . . . . 0.0 109.966 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.0 m -65.48 -22.9 66.79 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.636 -0.665 . . . . 0.0 110.768 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -107.2 -25.71 11.4 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.405 -0.809 . . . . 0.0 111.55 -179.148 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.409 ' CE1' ' CZ ' ' A' ' 19' ' ' PHE . 0.6 OUTLIER -83.21 -34.75 25.83 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.13 -0.981 . . . . 0.0 110.928 -179.133 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.514 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 35.5 mtt180 -48.43 -53.18 37.25 Favored Pre-proline 0 N--CA 1.498 1.925 0 O-C-N 121.275 -0.89 . . . . 0.0 112.022 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.528 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.4 Cg_endo -59.93 -27.09 84.16 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 O-C-N 123.169 1.089 . . . . 0.0 110.182 179.855 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.4 tmtt? -69.55 -44.83 70.12 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.1 mm -59.08 -35.0 54.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 CA-C-O 121.084 0.468 . . . . 0.0 110.094 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.544 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 4.8 mmmm -70.15 -39.92 75.08 Favored 'General case' 0 N--CA 1.497 1.908 0 C-N-CA 120.09 -0.644 . . . . 0.0 110.43 -177.173 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.9 t -57.67 -25.64 60.54 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.348 -0.845 . . . . 0.0 110.891 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -114.0 -23.62 9.47 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.508 -0.745 . . . . 0.0 110.654 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.711 ' HB3' HD23 ' A' ' 34' ' ' LEU . 43.6 m80 -120.7 96.06 48.87 Favored Pre-proline 0 N--CA 1.495 1.784 0 O-C-N 121.414 -0.804 . . . . 0.0 109.482 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -74.96 -36.25 2.7 Favored 'Trans proline' 0 C--N 1.316 -1.161 0 O-C-N 123.462 1.243 . . . . 0.0 110.351 -179.602 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.4 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -75.3 -16.73 80.44 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 110.174 -1.17 . . . . 0.0 110.174 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.711 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -57.86 83.88 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.486 -1.008 . . . . 0.0 111.255 -179.323 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 33' ' ' GLY . 19.9 m -75.71 172.89 11.86 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.502 -0.749 . . . . 0.0 109.758 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.413 ' O ' ' HB2' ' A' ' 40' ' ' ALA . 42.5 mm -54.6 -28.36 19.17 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.113 0 O-C-N 121.34 -0.85 . . . . 0.0 110.228 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.18 -70.67 0.94 Allowed Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.146 -1.582 . . . . 0.0 109.146 179.705 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.408 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 10.7 t0 -67.49 -31.99 72.5 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.672 -0.899 . . . . 0.0 110.388 179.569 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.409 ' O ' HD12 ' A' ' 43' ' ' LEU . 78.2 m -65.78 -29.93 70.5 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.457 -0.777 . . . . 0.0 109.913 179.42 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.413 ' HB2' ' O ' ' A' ' 36' ' ' ILE . . . -73.16 -44.32 60.19 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.638 -0.664 . . . . 0.0 109.566 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -86.92 -13.39 44.89 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.646 -0.659 . . . . 0.0 111.78 -179.36 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 9.0 tptt -86.23 6.54 29.05 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 120.941 -1.1 . . . . 0.0 110.696 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.462 HD13 ' SG ' ' A' ' 20' ' ' CYS . 11.8 mt -102.1 -28.58 12.25 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.107 -0.996 . . . . 0.0 109.495 179.055 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -70.4 -29.7 69.8 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.092 -1.603 . . . . 0.0 109.092 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -55.41 -49.83 71.36 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.475 -1.014 . . . . 0.0 110.22 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 31.3 mmt -73.75 -49.72 24.13 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.663 -0.648 . . . . 0.0 109.643 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 62.2 t-105 -51.71 -59.27 4.49 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.479 -0.763 . . . . 0.0 110.847 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.0 t -61.52 -33.39 73.72 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.479 -0.763 . . . . 0.0 110.274 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -59.58 -39.74 85.11 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.54 -0.725 . . . . 0.0 110.284 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -63.48 162.37 12.76 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.579 -0.701 . . . . 0.0 110.297 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 81.1 p -96.18 -147.37 0.29 Allowed 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -85.72 51.85 2.31 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.152 -0.968 . . . . 0.0 110.095 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 9.8 tptp -125.23 -42.82 1.97 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.42 -0.8 . . . . 0.0 110.121 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -62.34 -37.07 84.23 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.563 -0.71 . . . . 0.0 110.728 -179.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 22.0 tttp -91.03 19.9 5.33 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.375 -0.828 . . . . 0.0 111.348 -179.284 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.463 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 0.7 OUTLIER -94.25 -57.21 0.22 Allowed Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.012 -1.055 . . . . 0.0 110.341 179.888 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.463 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 57.0 Cg_endo -83.28 -31.26 0.68 Allowed 'Trans proline' 0 N--CA 1.484 0.95 0 O-C-N 122.998 0.999 . . . . 0.0 110.577 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -82.33 2.02 34.2 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.49 -0.757 . . . . 0.0 112.004 -178.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.441 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -96.72 -21.92 17.29 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.035 -1.041 . . . . 0.0 110.736 -179.916 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -82.36 -24.64 34.39 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.425 -0.797 . . . . 0.0 110.201 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 71.0 tttt -62.89 -45.0 94.6 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.514 -0.741 . . . . 0.0 109.846 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.469 ' HB2' ' H ' ' A' ' 15' ' ' ALA . . . -74.27 -10.24 59.4 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.623 -0.673 . . . . 0.0 110.835 179.694 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.87 0.65 52.53 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.256 -0.902 . . . . 0.0 110.372 179.163 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.79 -30.43 9.41 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.225 -0.922 . . . . 0.0 109.92 179.494 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.469 ' N ' HD12 ' A' ' 65' ' ' LEU . 6.5 mp -83.22 -7.16 59.65 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.89 -0.506 . . . . 0.0 110.401 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.7 ttpt -81.34 -27.33 34.98 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.272 -0.892 . . . . 0.0 109.457 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -85.22 -6.29 59.28 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.674 -0.641 . . . . 0.0 110.363 179.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 36.6 mmtm -105.38 -35.24 7.57 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.367 -0.833 . . . . 0.0 108.888 178.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.703 ' O ' HG22 ' A' ' 73' ' ' ILE . 35.8 t80 -75.5 -57.2 4.03 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 179.392 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -57.69 -19.73 29.08 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.665 -0.647 . . . . 0.0 111.218 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 33.2 mmtm -102.75 -24.62 13.71 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.32 -0.863 . . . . 0.0 111.287 -179.225 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -98.79 -36.53 9.78 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.33 -0.856 . . . . 0.0 111.314 -179.102 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.703 HG22 ' O ' ' A' ' 69' ' ' TYR . 4.7 tp -70.53 -26.61 28.99 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.304 -0.873 . . . . 0.0 110.616 -179.381 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.19 -45.07 96.09 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.455 -0.778 . . . . 0.0 109.992 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.98 -16.98 36.61 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.709 -0.62 . . . . 0.0 110.615 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -81.44 -32.04 32.83 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.318 -0.864 . . . . 0.0 110.196 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 29.5 mtt180 -100.73 1.38 40.35 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.624 -0.672 . . . . 0.0 111.176 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -71.27 77.17 0.73 Allowed 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.162 -0.961 . . . . 0.0 110.161 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.8 mptt . . . . . 0 N--CA 1.496 1.85 0 CA-C-O 117.955 -1.021 . . . . 0.0 110.165 179.977 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 34.8 ttm . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 121.086 0.469 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.9 mttm -103.36 170.77 7.75 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.565 -0.71 . . . . 0.0 110.307 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -170.05 64.03 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.592 -0.692 . . . . 0.0 110.083 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 16.3 pttm -85.71 -168.01 2.06 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.541 -0.724 . . . . 0.0 110.128 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.405 ' HB2' ' CB ' ' A' ' 8' ' ' ALA . 0.8 OUTLIER -48.54 149.56 2.84 Favored Pre-proline 0 N--CA 1.501 2.116 0 O-C-N 121.622 -0.674 . . . . 0.0 111.259 -179.9 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -75.92 -30.25 6.08 Favored 'Trans proline' 0 C--N 1.319 -1.017 0 O-C-N 123.465 1.245 . . . . 0.0 111.139 -179.484 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -114.85 24.71 11.53 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.281 -0.887 . . . . 0.0 111.057 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.405 ' CB ' ' HB2' ' A' ' 5' ' ' ASP . . . -105.7 90.8 4.5 Favored Pre-proline 0 N--CA 1.496 1.833 0 O-C-N 121.427 -0.796 . . . . 0.0 110.095 179.527 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -72.03 81.67 1.38 Allowed 'Trans proline' 0 C--N 1.316 -1.148 0 O-C-N 123.205 1.108 . . . . 0.0 110.543 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.1 tptt -60.93 -157.39 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.651 -0.656 . . . . 0.0 110.143 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -49.47 140.22 13.94 Favored Pre-proline 0 N--CA 1.502 2.169 0 O-C-N 121.269 -0.895 . . . . 0.0 111.227 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.407 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.0 Cg_endo -76.83 128.69 10.23 Favored 'Trans proline' 0 C--N 1.318 -1.032 0 O-C-N 123.276 1.145 . . . . 0.0 110.263 -179.803 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.472 ' HB2' HD21 ' A' ' 18' ' ' LEU . 50.4 Cg_endo -82.18 179.46 5.51 Favored 'Trans proline' 0 C--N 1.319 -1.022 0 O-C-N 123.212 1.111 . . . . 0.0 110.23 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.537 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -163.17 65.3 0.18 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.554 -0.716 . . . . 0.0 110.257 -179.861 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.537 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 67.02 -76.63 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.185 0 O-C-N 121.183 -0.948 . . . . 0.0 109.938 -179.36 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.415 ' CD2' ' CD1' ' A' ' 47' ' ' TRP . 6.6 t80 -51.78 -43.22 62.93 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.249 -0.907 . . . . 0.0 111.022 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -63.77 -30.25 71.37 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.612 -0.68 . . . . 0.0 109.386 179.572 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.472 HD21 ' HB2' ' A' ' 13' ' ' PRO . 58.2 mt -75.28 -43.97 48.3 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.589 -0.695 . . . . 0.0 110.037 -179.815 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -65.56 -48.28 72.96 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.627 -0.671 . . . . 0.0 110.077 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 12.0 t -65.93 -29.5 69.93 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.564 -0.71 . . . . 0.0 109.771 179.564 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.5 t -90.52 7.12 40.6 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.578 -0.701 . . . . 0.0 111.653 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -138.79 0.75 2.03 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 120.973 -1.08 . . . . 0.0 112.11 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -123.58 22.08 9.2 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 120.872 -1.142 . . . . 0.0 110.905 -179.68 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.514 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 8.6 mtt180 -85.47 -45.98 0.63 Allowed Pre-proline 0 N--CA 1.488 1.439 0 O-C-N 121.447 -0.783 . . . . 0.0 112.064 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.561 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.3 Cg_endo -66.57 -15.44 47.67 Favored 'Trans proline' 0 N--CA 1.491 1.341 0 O-C-N 122.853 0.922 . . . . 0.0 110.613 -179.286 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? -73.39 -50.84 19.75 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 178.108 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 30.1 mm -54.51 -33.52 26.86 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.942 0 CA-C-O 121.298 0.57 . . . . 0.0 110.263 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.561 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.2 mmmm -71.27 -37.12 71.92 Favored 'General case' 0 N--CA 1.498 1.953 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.147 -177.26 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 24.8 t -58.6 -25.61 62.79 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.422 -0.799 . . . . 0.0 110.637 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -115.29 -24.22 8.55 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.55 -0.719 . . . . 0.0 110.618 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.783 ' HB3' HD23 ' A' ' 34' ' ' LEU . 41.2 m80 -119.63 96.56 49.72 Favored Pre-proline 0 N--CA 1.496 1.864 0 O-C-N 121.45 -0.781 . . . . 0.0 109.568 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -75.37 -28.42 8.6 Favored 'Trans proline' 0 C--N 1.315 -1.233 0 O-C-N 123.4 1.211 . . . . 0.0 110.502 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -84.44 -13.55 73.15 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.783 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -60.39 82.36 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.356 -1.085 . . . . 0.0 111.019 -179.441 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.1 t -69.74 170.19 11.43 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.487 -0.758 . . . . 0.0 109.977 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 38.6 mm -52.7 -30.08 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.262 -0.899 . . . . 0.0 110.264 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.0 -65.88 3.1 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.33 -1.508 . . . . 0.0 109.33 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.715 ' HB3' HD13 ' A' ' 34' ' ' LEU . 3.4 t70 -69.55 -30.49 68.3 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.617 -0.931 . . . . 0.0 110.591 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.2 m -63.76 -29.32 70.54 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.331 -0.856 . . . . 0.0 110.249 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.41 -44.8 27.9 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.576 -0.702 . . . . 0.0 110.169 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -86.02 -13.28 47.95 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.554 -0.716 . . . . 0.0 111.669 -179.398 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.9 tptt -76.88 -59.69 2.67 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.055 -1.028 . . . . 0.0 109.718 179.522 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 45.1 mt -48.67 -25.12 1.62 Allowed 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.474 -0.766 . . . . 0.0 111.458 -179.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -71.08 -36.98 64.14 Favored Glycine 0 N--CA 1.492 2.403 0 N-CA-C 109.051 -1.62 . . . . 0.0 109.051 179.337 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -53.86 -38.18 64.42 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.577 -0.955 . . . . 0.0 110.746 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 28.3 mtp -76.41 -49.69 16.09 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.599 -0.688 . . . . 0.0 109.861 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' TRP . . . . . 0.415 ' CD1' ' CD2' ' A' ' 16' ' ' PHE . 57.6 t-105 -49.99 -53.39 26.86 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.527 -0.733 . . . . 0.0 111.067 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.3 t -59.34 -36.14 75.14 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.447 -0.783 . . . . 0.0 110.459 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -62.29 -39.29 92.46 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.612 -0.68 . . . . 0.0 110.046 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -57.52 154.21 11.56 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.546 -0.721 . . . . 0.0 110.539 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.1 m -102.01 -151.55 0.42 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.694 -0.629 . . . . 0.0 109.457 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.06 52.48 2.53 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.306 -0.871 . . . . 0.0 110.124 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -132.54 -51.75 0.93 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.408 -0.808 . . . . 0.0 110.034 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -64.95 -25.0 67.69 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.687 -0.633 . . . . 0.0 110.47 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 37.7 tttp -81.09 -35.33 31.8 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.524 -0.735 . . . . 0.0 110.534 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -44.23 -52.75 15.57 Favored Pre-proline 0 N--CA 1.507 2.391 0 O-C-N 121.498 -0.751 . . . . 0.0 112.048 -179.208 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -78.41 -37.42 0.72 Allowed 'Trans proline' 0 C--N 1.315 -1.189 0 O-C-N 123.232 1.122 . . . . 0.0 111.045 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -84.85 4.67 32.11 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.344 -0.847 . . . . 0.0 112.146 -178.433 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -101.02 -24.15 14.38 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.002 -1.061 . . . . 0.0 110.552 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -75.28 -23.32 57.4 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.446 -0.784 . . . . 0.0 110.284 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 66.7 tttt -60.42 -41.66 94.39 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.561 -0.712 . . . . 0.0 110.145 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.41 -11.51 60.49 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.494 -0.754 . . . . 0.0 110.569 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -83.69 2.62 36.83 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.222 -0.923 . . . . 0.0 110.383 179.202 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 26.6 mmtm -105.33 -32.12 8.74 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.196 -0.94 . . . . 0.0 109.742 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.423 ' N ' HD12 ' A' ' 65' ' ' LEU . 6.2 mp -83.57 1.73 40.67 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.832 -0.543 . . . . 0.0 110.685 179.297 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 74.4 tttt -92.28 -32.02 15.18 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.232 -0.918 . . . . 0.0 109.508 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -83.53 -12.8 55.75 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.658 -0.651 . . . . 0.0 110.56 179.433 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -105.07 -28.19 11.18 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.318 -0.864 . . . . 0.0 109.464 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.53 ' O ' HG22 ' A' ' 73' ' ' ILE . 17.5 t80 -76.74 -54.54 6.5 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.775 -0.578 . . . . 0.0 109.6 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -64.04 -14.2 52.65 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.578 -0.702 . . . . 0.0 111.348 -179.481 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt -106.79 -29.96 9.21 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.26 -0.9 . . . . 0.0 111.125 -179.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -96.02 -34.34 11.8 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.289 -0.882 . . . . 0.0 111.555 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.53 HG22 ' O ' ' A' ' 69' ' ' TYR . 5.0 tp -63.15 -23.11 32.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.187 -0.946 . . . . 0.0 110.731 -179.256 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.02 -45.84 80.06 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.519 -0.738 . . . . 0.0 109.891 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -84.05 -27.76 28.09 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.631 -0.668 . . . . 0.0 110.028 179.659 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -65.64 -42.07 91.86 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.554 -0.716 . . . . 0.0 110.051 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 33.9 mtt85 -64.56 -74.9 0.09 Allowed 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.589 -0.694 . . . . 0.0 110.119 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 53.76 49.19 19.77 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.29 -0.881 . . . . 0.0 110.567 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 31.6 mttm . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.301 -179.987 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.079 0.466 . . . . 0.0 110.261 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.18 -57.51 3.15 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.555 -0.715 . . . . 0.0 110.079 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 75.0 tttt -59.94 106.66 0.52 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.536 -0.727 . . . . 0.0 110.36 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 43.2 mttp -60.58 -73.67 0.09 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.617 -0.677 . . . . 0.0 110.384 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -158.78 168.25 12.8 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.498 -0.751 . . . . 0.0 110.293 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.9 -49.11 0.26 Allowed 'Trans proline' 0 N--CA 1.486 1.058 0 O-C-N 123.396 1.208 . . . . 0.0 110.373 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -78.64 -8.09 58.3 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.614 -0.679 . . . . 0.0 111.167 -179.202 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -84.88 143.21 39.92 Favored Pre-proline 0 N--CA 1.493 1.71 0 O-C-N 121.143 -0.973 . . . . 0.0 109.309 179.144 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.442 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 44.4 Cg_endo -70.51 94.2 0.59 Allowed 'Trans proline' 0 C--N 1.316 -1.138 0 O-C-N 123.278 1.147 . . . . 0.0 110.656 -179.585 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.7 mtpt -67.14 -172.37 0.2 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.694 -0.628 . . . . 0.0 109.956 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.0 mtt85 -52.37 136.34 41.37 Favored Pre-proline 0 N--CA 1.5 2.071 0 O-C-N 121.309 -0.87 . . . . 0.0 110.665 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -74.51 128.85 12.23 Favored 'Trans proline' 0 C--N 1.319 -1.004 0 O-C-N 123.257 1.135 . . . . 0.0 110.262 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.682 ' CB ' HD21 ' A' ' 18' ' ' LEU . 48.5 Cg_endo -82.25 174.47 9.92 Favored 'Trans proline' 0 C--N 1.317 -1.094 0 O-C-N 123.25 1.132 . . . . 0.0 110.223 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.517 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 20.2 t -157.14 67.44 0.53 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.427 -0.796 . . . . 0.0 110.599 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 65.61 -76.44 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.107 -0.996 . . . . 0.0 110.531 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -48.48 -43.86 35.28 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.262 -0.899 . . . . 0.0 111.229 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -63.86 -26.77 68.76 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 120.126 -0.63 . . . . 0.0 109.949 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.682 HD21 ' CB ' ' A' ' 13' ' ' PRO . 20.7 mt -89.23 -28.35 20.01 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.377 -0.827 . . . . 0.0 110.379 -179.375 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.495 ' CZ ' ' CE2' ' A' ' 23' ' ' TYR . 36.9 t80 -76.92 -54.62 6.35 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.551 -0.718 . . . . 0.0 110.716 -179.267 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 10.7 t -63.04 -35.66 80.96 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.608 -0.682 . . . . 0.0 110.224 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 46.6 t -69.81 -19.73 63.47 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.564 -0.71 . . . . 0.0 111.063 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -111.6 -17.59 13.0 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.261 -0.899 . . . . 0.0 111.555 -179.128 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.576 ' HB3' HD22 ' A' ' 43' ' ' LEU . 6.2 m-85 -89.0 -32.24 17.71 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.274 -0.891 . . . . 0.0 110.91 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.528 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 5.3 mtp180 -49.11 -52.23 49.55 Favored Pre-proline 0 N--CA 1.497 1.91 0 O-C-N 121.307 -0.871 . . . . 0.0 111.811 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.532 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.2 Cg_endo -59.55 -28.08 86.55 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 O-C-N 123.133 1.07 . . . . 0.0 110.054 179.691 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.8 tmtt? -69.9 -46.44 65.44 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 108.107 -1.072 . . . . 0.0 108.107 177.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.601 ' CG1' HD21 ' A' ' 43' ' ' LEU . 41.7 mm -56.94 -34.64 44.9 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.051 179.75 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.555 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 3.4 mmmm -70.16 -38.85 75.54 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.629 -0.67 . . . . 0.0 110.543 -177.518 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.0 t -58.29 -25.67 62.09 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.482 -0.761 . . . . 0.0 110.941 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -115.86 -24.28 8.24 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.455 -0.778 . . . . 0.0 110.853 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.728 ' HB3' HD23 ' A' ' 34' ' ' LEU . 40.3 m80 -119.96 96.25 49.35 Favored Pre-proline 0 N--CA 1.495 1.802 0 O-C-N 121.522 -0.736 . . . . 0.0 109.456 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -75.21 -29.59 7.75 Favored 'Trans proline' 0 C--N 1.315 -1.203 0 O-C-N 123.434 1.228 . . . . 0.0 110.543 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.401 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -82.72 -15.96 71.8 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.728 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -58.52 82.54 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.501 -1.0 . . . . 0.0 111.28 -179.333 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.401 ' N ' ' O ' ' A' ' 33' ' ' GLY . 66.4 m -69.94 -179.15 1.77 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.39 -0.818 . . . . 0.0 109.66 179.672 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 43.8 mm -56.93 -37.76 56.06 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 O-C-N 121.378 -0.826 . . . . 0.0 110.141 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -57.75 -59.39 10.91 Favored Glycine 0 N--CA 1.494 2.506 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.669 ' CB ' HD13 ' A' ' 34' ' ' LEU . 45.2 m-20 -67.8 -41.01 83.8 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.613 -0.933 . . . . 0.0 109.998 179.135 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 96.3 m -59.77 -26.93 66.11 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.217 -0.927 . . . . 0.0 110.271 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -83.81 -49.18 9.31 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.545 -0.722 . . . . 0.0 110.416 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -81.2 -12.33 59.19 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.548 -0.72 . . . . 0.0 111.975 -179.068 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.471 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -83.94 -61.56 1.79 Allowed 'General case' 0 N--CA 1.5 2.04 0 O-C-N 120.998 -1.064 . . . . 0.0 109.704 179.542 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.601 HD21 ' CG1' ' A' ' 27' ' ' ILE . 61.8 mt -52.18 -24.51 7.25 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.457 -0.777 . . . . 0.0 111.182 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.1 -39.75 83.61 Favored Glycine 0 N--CA 1.493 2.434 0 N-CA-C 109.728 -1.349 . . . . 0.0 109.728 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -56.71 -33.85 66.88 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.467 -1.019 . . . . 0.0 110.584 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 9.6 mtt -75.82 -51.26 12.96 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.601 -0.687 . . . . 0.0 110.18 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -47.69 -38.97 16.19 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.593 -0.692 . . . . 0.0 111.602 -179.233 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.0 t -81.83 -27.13 33.76 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.33 -0.856 . . . . 0.0 110.341 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -63.61 -41.95 98.27 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.544 -0.722 . . . . 0.0 110.312 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.2 169.33 7.24 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.515 -0.74 . . . . 0.0 109.941 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.6 m -155.52 107.16 2.59 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.493 -0.754 . . . . 0.0 110.529 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 51.92 42.05 29.94 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.475 -0.765 . . . . 0.0 110.915 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.9 mttm -139.3 -76.37 0.35 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.548 -0.72 . . . . 0.0 110.348 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -61.98 -25.98 67.94 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.508 -0.745 . . . . 0.0 110.701 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.4 ttpm? -82.89 -33.71 26.88 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.427 -0.795 . . . . 0.0 110.603 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -44.52 -52.17 18.36 Favored Pre-proline 0 N--CA 1.506 2.35 0 O-C-N 121.526 -0.734 . . . . 0.0 111.907 -179.168 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.421 ' HA ' ' NE2' ' A' ' 60' ' ' GLN . 56.1 Cg_endo -79.83 -37.53 0.45 Allowed 'Trans proline' 0 C--N 1.315 -1.186 0 O-C-N 123.262 1.138 . . . . 0.0 110.804 179.596 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -84.62 8.76 15.71 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.571 -0.706 . . . . 0.0 112.034 -178.452 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.03 -24.28 13.23 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 120.955 -1.091 . . . . 0.0 110.19 179.511 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.421 ' NE2' ' HA ' ' A' ' 57' ' ' PRO . 12.1 pt20 -74.87 -26.6 59.79 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.494 -0.754 . . . . 0.0 110.137 179.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.416 ' CG ' HD13 ' A' ' 18' ' ' LEU . 42.1 tttt -57.21 -43.3 82.67 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.569 -0.707 . . . . 0.0 110.5 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.621 ' HB1' ' O ' ' A' ' 13' ' ' PRO . . . -73.63 -11.18 60.34 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.452 -0.78 . . . . 0.0 110.774 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.92 -3.52 57.1 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.249 -0.907 . . . . 0.0 110.515 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 64.8 mmtt -97.55 -33.16 11.46 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.254 -0.904 . . . . 0.0 109.655 179.662 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.9 mp -84.11 5.44 26.11 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.842 -0.536 . . . . 0.0 110.964 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -98.99 -32.79 11.11 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.333 -0.855 . . . . 0.0 109.331 179.426 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -63.27 -46.67 85.76 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 120.237 -0.585 . . . . 0.0 110.079 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 22.0 tptt -71.29 -63.84 1.03 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.469 -0.769 . . . . 0.0 109.6 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.442 ' CD2' ' HB2' ' A' ' 9' ' ' PRO . 24.4 t80 -36.06 -49.27 0.64 Allowed 'General case' 0 N--CA 1.509 2.486 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -179.296 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -67.16 -32.18 73.1 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.464 -0.773 . . . . 0.0 111.377 -179.245 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.7 ttmt -95.73 -23.79 16.81 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.323 -0.861 . . . . 0.0 111.703 -178.808 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -92.14 -24.9 18.95 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.291 -0.881 . . . . 0.0 111.334 -178.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.406 HG22 ' O ' ' A' ' 69' ' ' TYR . 4.5 tp -77.29 -20.2 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 121.433 -0.792 . . . . 0.0 110.93 -179.527 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.61 -34.2 77.67 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.398 -0.814 . . . . 0.0 109.868 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -102.66 -14.36 16.73 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.654 -0.654 . . . . 0.0 110.635 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -63.98 -35.23 80.02 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.272 -0.892 . . . . 0.0 110.175 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 65.8 mtt180 -103.19 17.81 23.2 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.589 -0.694 . . . . 0.0 110.78 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 52.24 79.67 0.1 Allowed 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.173 -0.955 . . . . 0.0 110.892 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.781 0 CA-C-O 117.993 -1.004 . . . . 0.0 110.211 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 32.9 ttm . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 121.139 0.495 . . . . 0.0 110.274 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 52.81 -177.2 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.185 0 O-C-N 121.48 -0.763 . . . . 0.0 110.803 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 32.9 ttmt 52.87 75.41 0.24 Allowed 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.426 -0.796 . . . . 0.0 110.692 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.9 mtpm? -61.75 -77.14 0.05 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.61 -0.681 . . . . 0.0 110.463 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.599 ' HB2' ' HB3' ' A' ' 8' ' ' ALA . 0.5 OUTLIER -104.11 159.68 28.53 Favored Pre-proline 0 N--CA 1.494 1.762 0 O-C-N 121.55 -0.719 . . . . 0.0 110.57 -179.487 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -76.87 -16.22 16.32 Favored 'Trans proline' 0 N--CA 1.486 1.057 0 O-C-N 123.492 1.259 . . . . 0.0 111.863 -179.411 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.1 p30 -135.74 18.19 3.3 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.281 -0.887 . . . . 0.0 111.257 -179.59 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.599 ' HB3' ' HB2' ' A' ' 5' ' ' ASP . . . -105.22 125.94 32.27 Favored Pre-proline 0 N--CA 1.494 1.767 0 O-C-N 121.399 -0.813 . . . . 0.0 110.167 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -72.36 117.72 5.27 Favored 'Trans proline' 0 N--CA 1.485 0.996 0 O-C-N 123.128 1.067 . . . . 0.0 110.229 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -128.82 31.43 4.94 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.553 -0.717 . . . . 0.0 110.514 -179.816 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.1 mtt85 -161.97 85.5 1.6 Allowed Pre-proline 0 N--CA 1.494 1.775 0 O-C-N 121.815 -0.553 . . . . 0.0 110.042 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.403 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.2 Cg_endo -82.24 118.14 2.92 Favored 'Trans proline' 0 C--N 1.317 -1.097 0 O-C-N 123.411 1.216 . . . . 0.0 110.339 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.729 ' HB2' HD21 ' A' ' 18' ' ' LEU . 46.9 Cg_endo -80.45 173.56 12.23 Favored 'Trans proline' 0 C--N 1.318 -1.04 0 O-C-N 123.278 1.146 . . . . 0.0 110.099 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.544 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 41.0 t -166.84 61.29 0.09 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.5 -0.75 . . . . 0.0 110.501 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.544 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 68.27 -77.47 0.05 OUTLIER 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.127 -0.983 . . . . 0.0 110.041 -179.341 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -50.66 -45.28 57.87 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.194 -0.941 . . . . 0.0 110.893 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -60.84 -29.7 69.66 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 120.201 -0.599 . . . . 0.0 109.801 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.729 HD21 ' HB2' ' A' ' 13' ' ' PRO . 35.4 mt -80.68 -36.54 32.2 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.542 -0.724 . . . . 0.0 110.219 -179.666 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.499 ' CE2' ' CE2' ' A' ' 23' ' ' TYR . 18.1 t80 -69.41 -52.3 28.25 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.592 -0.692 . . . . 0.0 110.35 -179.588 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 4.4 t -64.43 -29.81 70.85 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.521 -0.737 . . . . 0.0 109.909 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.3 m -70.01 -15.32 63.0 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.6 -0.688 . . . . 0.0 111.536 -179.301 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.2 -17.64 4.25 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.034 -1.041 . . . . 0.0 112.466 -179.02 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.499 ' CE2' ' CE2' ' A' ' 19' ' ' PHE . 12.9 m-85 -91.27 15.11 12.63 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 120.949 -1.094 . . . . 0.0 111.551 -179.378 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.507 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 17.4 mtt180 -91.92 -42.36 0.37 Allowed Pre-proline 0 N--CA 1.489 1.485 0 O-C-N 121.278 -0.889 . . . . 0.0 112.476 179.429 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.581 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.2 Cg_endo -68.08 -16.19 44.37 Favored 'Trans proline' 0 N--CA 1.49 1.298 0 O-C-N 122.759 0.873 . . . . 0.0 110.386 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -73.16 -51.78 16.59 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 177.694 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 40.3 mm -52.54 -29.07 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 CA-C-O 121.304 0.573 . . . . 0.0 110.495 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.581 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 6.4 mmmm -75.19 -32.68 61.28 Favored 'General case' 0 N--CA 1.496 1.845 0 C-N-CA 120.091 -0.643 . . . . 0.0 110.214 -177.359 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.9 t -62.59 -25.82 68.28 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.576 -0.702 . . . . 0.0 110.422 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -118.2 -19.39 9.02 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.539 -0.726 . . . . 0.0 111.14 -179.626 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.755 ' HB3' HD23 ' A' ' 34' ' ' LEU . 34.1 m80 -124.4 95.71 42.78 Favored Pre-proline 0 N--CA 1.498 1.97 0 O-C-N 121.294 -0.878 . . . . 0.0 109.706 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -75.57 -33.95 3.7 Favored 'Trans proline' 0 C--N 1.316 -1.163 0 O-C-N 123.472 1.249 . . . . 0.0 110.248 -179.872 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.411 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -77.03 -18.36 78.75 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.755 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -57.21 83.78 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.491 -1.005 . . . . 0.0 111.297 -179.287 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.411 ' N ' ' O ' ' A' ' 33' ' ' GLY . 63.9 m -75.14 171.01 14.9 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.487 -0.758 . . . . 0.0 109.848 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.0 mm -53.1 -27.57 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 121.343 -0.848 . . . . 0.0 110.303 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -61.22 -67.07 2.29 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.207 -1.557 . . . . 0.0 109.207 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.454 ' HB3' HD13 ' A' ' 34' ' ' LEU . 7.5 t70 -71.87 -28.55 63.61 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.529 -0.983 . . . . 0.0 110.679 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 86.8 m -65.89 -33.79 76.65 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.36 -0.838 . . . . 0.0 110.159 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.63 -39.35 67.28 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.56 -0.712 . . . . 0.0 110.276 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -91.51 -12.11 35.48 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.6 -0.687 . . . . 0.0 111.597 -179.577 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.404 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 14.0 tptt -77.61 -59.29 2.84 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.042 -1.036 . . . . 0.0 109.731 179.499 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 34.5 mt -47.28 -28.32 1.91 Allowed 'General case' 0 N--CA 1.504 2.242 0 O-C-N 121.554 -0.716 . . . . 0.0 111.416 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -64.28 -35.07 91.5 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.2 -1.56 . . . . 0.0 109.2 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -50.83 -36.08 35.66 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.535 -0.979 . . . . 0.0 111.037 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 34.0 mtt -86.62 -40.98 14.63 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.522 -0.736 . . . . 0.0 110.237 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' TRP . . . . . 0.442 ' CH2' ' HG2' ' A' ' 55' ' ' LYS . 73.1 t-105 -55.34 -22.52 19.55 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.551 -0.718 . . . . 0.0 111.028 -179.566 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 66.6 p -93.55 -33.3 13.8 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.286 -0.884 . . . . 0.0 110.166 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -63.42 -36.72 84.68 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.561 -0.712 . . . . 0.0 110.015 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -63.04 152.66 36.34 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.583 -0.698 . . . . 0.0 110.194 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 9.3 t -101.26 -152.61 0.43 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.685 -0.634 . . . . 0.0 109.423 179.654 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -83.51 55.44 3.2 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.397 -0.814 . . . . 0.0 110.023 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 39.6 mttt -132.24 -48.92 0.92 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.415 -0.803 . . . . 0.0 110.324 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -67.86 -28.1 67.25 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.532 -0.73 . . . . 0.0 110.774 -179.547 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.442 ' HG2' ' CH2' ' A' ' 47' ' ' TRP . 18.7 mtmt -79.79 -36.74 36.58 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.372 -0.83 . . . . 0.0 110.572 -179.639 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -44.22 -53.37 14.01 Favored Pre-proline 0 N--CA 1.507 2.385 0 O-C-N 121.505 -0.747 . . . . 0.0 112.33 -178.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -77.2 -37.33 1.07 Allowed 'Trans proline' 0 C--N 1.315 -1.226 0 O-C-N 123.129 1.068 . . . . 0.0 111.258 -179.561 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.48 -5.27 58.6 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.454 -0.779 . . . . 0.0 112.026 -178.462 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.96 -24.1 21.37 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.992 -1.068 . . . . 0.0 111.072 -179.328 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -78.47 -22.09 48.07 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.325 -0.859 . . . . 0.0 110.626 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 73.8 tttt -64.7 -42.35 95.35 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.365 -0.834 . . . . 0.0 109.803 179.719 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.551 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -80.86 -15.14 57.14 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.558 -0.714 . . . . 0.0 110.068 179.106 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.34 -35.38 75.52 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.379 -0.826 . . . . 0.0 110.029 179.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -72.62 -62.81 1.31 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.454 -0.779 . . . . 0.0 109.783 179.648 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.484 HD22 ' HG3' ' A' ' 13' ' ' PRO . 5.0 mp -51.22 -24.05 3.97 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.443 -0.786 . . . . 0.0 111.25 -179.736 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 10.9 tttt -70.36 -52.54 21.84 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.395 -0.816 . . . . 0.0 109.506 179.47 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -62.19 -50.33 72.25 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.609 -0.682 . . . . 0.0 109.543 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -58.45 -20.62 46.47 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.557 -0.715 . . . . 0.0 110.548 179.59 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.511 ' O ' HG22 ' A' ' 73' ' ' ILE . 23.4 t80 -86.82 -58.31 2.65 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.449 -0.782 . . . . 0.0 110.026 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -69.37 -32.67 71.86 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.629 -0.669 . . . . 0.0 111.868 -178.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.0 mmtm -85.47 -14.34 46.4 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.267 -0.895 . . . . 0.0 111.823 -178.793 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -107.31 -20.69 13.2 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.143 -0.973 . . . . 0.0 111.34 -179.288 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.511 HG22 ' O ' ' A' ' 69' ' ' TYR . 2.7 tp -82.14 -22.31 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.3 -0.875 . . . . 0.0 110.825 -179.781 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.32 -41.16 96.95 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.384 -0.822 . . . . 0.0 109.869 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -93.17 -4.02 52.89 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.631 -0.668 . . . . 0.0 110.954 179.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.507 ' CZ ' ' HB2' ' A' ' 8' ' ' ALA . 63.8 t80 -87.78 -24.68 23.7 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.117 -0.989 . . . . 0.0 110.659 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 4.8 mtp85 -72.0 -79.86 0.07 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.447 -0.783 . . . . 0.0 110.343 -179.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.457 ' HB3' ' HE2' ' A' ' 79' ' ' LYS . . . -129.44 -144.8 0.28 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.31 -0.869 . . . . 0.0 109.729 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.457 ' HE2' ' HB3' ' A' ' 78' ' ' ALA . 11.9 mtmt . . . . . 0 N--CA 1.503 2.176 0 O-C-N 121.046 -1.034 . . . . 0.0 110.8 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.5 tpt . . . . . 0 N--CA 1.493 1.678 0 CA-C-O 121.01 0.433 . . . . 0.0 110.157 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.1 mttm -95.68 -168.16 1.73 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.549 -0.719 . . . . 0.0 110.378 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -177.09 -33.64 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.466 -0.771 . . . . 0.0 110.64 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -56.46 -168.72 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.466 -0.771 . . . . 0.0 111.207 -179.272 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.416 ' CB ' ' HD2' ' A' ' 6' ' ' PRO . 0.1 OUTLIER -147.4 -180.0 1.06 Allowed Pre-proline 0 N--CA 1.495 1.788 0 O-C-N 121.67 -0.643 . . . . 0.0 109.914 -179.518 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.416 ' HD2' ' CB ' ' A' ' 5' ' ' ASP . 43.3 Cg_endo -69.99 -35.5 11.86 Favored 'Trans proline' 0 N--CA 1.486 1.082 0 O-C-N 123.255 1.134 . . . . 0.0 110.314 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -77.92 -22.11 50.13 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.606 -0.684 . . . . 0.0 110.28 -179.362 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.402 ' HB2' ' CZ ' ' A' ' 76' ' ' TYR . . . -105.12 134.71 19.51 Favored Pre-proline 0 N--CA 1.493 1.712 0 O-C-N 121.432 -0.793 . . . . 0.0 108.885 178.618 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.17 119.31 6.2 Favored 'Trans proline' 0 C--N 1.318 -1.071 0 O-C-N 123.054 1.028 . . . . 0.0 110.425 -179.463 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.48 -166.91 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.586 -0.696 . . . . 0.0 109.917 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -60.94 146.19 87.82 Favored Pre-proline 0 N--CA 1.496 1.872 0 O-C-N 121.509 -0.744 . . . . 0.0 110.085 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.429 ' HD3' ' CZ ' ' A' ' 69' ' ' TYR . 47.0 Cg_endo -74.21 124.41 8.99 Favored 'Trans proline' 0 C--N 1.317 -1.13 0 O-C-N 123.299 1.157 . . . . 0.0 110.159 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.725 ' HB2' HD21 ' A' ' 18' ' ' LEU . 47.2 Cg_endo -81.43 -179.93 5.33 Favored 'Trans proline' 0 C--N 1.318 -1.055 0 O-C-N 123.286 1.15 . . . . 0.0 110.079 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.555 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 38.1 t -168.93 62.16 0.06 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.461 -0.775 . . . . 0.0 110.811 -179.766 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.644 ' HB2' ' HA ' ' A' ' 59' ' ' GLU . . . 69.6 -77.65 0.05 Allowed 'General case' 0 N--CA 1.503 2.203 0 O-C-N 120.945 -1.097 . . . . 0.0 110.533 -179.783 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.443 ' CE2' ' CD1' ' A' ' 47' ' ' TRP . 3.3 t80 -49.49 -46.93 48.83 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.12 -0.987 . . . . 0.0 111.114 -179.578 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -60.31 -28.29 68.0 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.551 -0.718 . . . . 0.0 110.281 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.725 HD21 ' HB2' ' A' ' 13' ' ' PRO . 23.7 mt -83.99 -35.63 23.77 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.352 -0.843 . . . . 0.0 110.532 -179.37 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.485 ' CE1' ' CE1' ' A' ' 23' ' ' TYR . 59.0 t80 -71.93 -52.68 16.01 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.531 -0.731 . . . . 0.0 110.718 -179.214 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.556 ' SG ' HD13 ' A' ' 43' ' ' LEU . 36.4 t -56.78 -55.16 37.88 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.395 -0.816 . . . . 0.0 110.658 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 9.2 t -55.35 -23.99 27.01 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.502 -0.749 . . . . 0.0 110.989 -179.717 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -98.97 -21.19 16.38 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.4 -0.812 . . . . 0.0 111.288 -179.494 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.485 ' CE1' ' CE1' ' A' ' 19' ' ' PHE . 5.6 m-85 -100.11 15.93 25.75 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.349 -0.845 . . . . 0.0 111.352 -179.364 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.506 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 0.5 OUTLIER -92.25 -42.92 0.36 Allowed Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.314 -0.867 . . . . 0.0 112.744 179.663 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.603 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.2 Cg_endo -67.36 -17.94 49.64 Favored 'Trans proline' 0 N--CA 1.491 1.344 0 O-C-N 122.798 0.893 . . . . 0.0 110.493 -178.837 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? -71.78 -49.34 39.72 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 178.014 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 26.4 mm -56.06 -30.13 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 CA-C-O 121.257 0.551 . . . . 0.0 110.628 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.603 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 6.0 mmmm -73.84 -34.98 64.75 Favored 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 120.058 -0.657 . . . . 0.0 110.259 -177.236 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.9 t -62.76 -24.19 67.58 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.472 -0.767 . . . . 0.0 110.647 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -118.33 -16.57 9.62 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.415 -0.803 . . . . 0.0 111.194 -179.536 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.707 ' HB3' HD23 ' A' ' 34' ' ' LEU . 41.6 m80 -127.33 95.24 36.5 Favored Pre-proline 0 N--CA 1.498 1.949 0 O-C-N 121.351 -0.843 . . . . 0.0 109.578 179.594 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -74.95 -35.91 2.91 Favored 'Trans proline' 0 C--N 1.315 -1.231 0 O-C-N 123.492 1.259 . . . . 0.0 110.342 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.408 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -74.9 -19.07 80.1 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 110.099 -1.2 . . . . 0.0 110.099 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.707 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -57.2 83.81 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.584 -0.951 . . . . 0.0 111.312 -179.374 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.408 ' N ' ' O ' ' A' ' 33' ' ' GLY . 46.7 t -72.71 175.99 5.95 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.422 -0.799 . . . . 0.0 109.542 179.701 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 43.0 mm -56.48 -29.82 29.81 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 O-C-N 121.362 -0.836 . . . . 0.0 110.122 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.31 -64.91 3.83 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.445 ' HB3' HD13 ' A' ' 34' ' ' LEU . 0.6 OUTLIER -71.65 -31.81 67.24 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.66 -0.906 . . . . 0.0 110.564 179.803 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.5 m -67.09 -32.2 73.19 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.387 -0.821 . . . . 0.0 109.901 179.479 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.09 -35.34 69.2 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.621 -0.674 . . . . 0.0 109.914 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -97.92 -12.68 21.79 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.602 -0.686 . . . . 0.0 111.764 -179.422 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.431 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 6.1 tptt -85.16 5.18 31.07 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.044 -1.035 . . . . 0.0 110.528 179.377 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.556 HD13 ' SG ' ' A' ' 20' ' ' CYS . 18.3 mt -101.8 -33.51 9.79 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.029 -1.044 . . . . 0.0 109.316 179.168 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -66.25 -30.31 76.52 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.391 -1.484 . . . . 0.0 109.391 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.53 -41.39 63.44 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.38 -1.071 . . . . 0.0 110.679 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 11.6 mmt -87.03 -42.78 12.82 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.59 -0.694 . . . . 0.0 109.999 179.676 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' TRP . . . . . 0.443 ' CD1' ' CE2' ' A' ' 16' ' ' PHE . 72.9 t-105 -55.74 -23.76 31.13 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.505 -0.747 . . . . 0.0 110.723 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.4 t -85.79 -35.68 20.56 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.366 -0.834 . . . . 0.0 109.997 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -63.45 -33.67 76.08 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.66 -0.65 . . . . 0.0 109.839 179.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 89.8 mm-40 -63.32 151.26 41.23 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.676 -0.64 . . . . 0.0 110.094 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 88.6 p -103.06 -153.02 0.46 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.733 -0.605 . . . . 0.0 109.578 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -82.7 56.4 3.36 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.342 -0.849 . . . . 0.0 110.05 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 15.3 tttt -133.74 -51.18 0.85 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.448 -0.783 . . . . 0.0 110.204 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -67.78 -26.19 65.98 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.542 -0.724 . . . . 0.0 110.616 -179.705 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.423 ' O ' ' N ' ' A' ' 59' ' ' GLU . 10.9 ttmt -82.7 -36.88 25.49 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.563 -0.711 . . . . 0.0 110.668 -179.797 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -43.42 -52.53 13.08 Favored Pre-proline 0 N--CA 1.508 2.466 0 O-C-N 121.455 -0.778 . . . . 0.0 112.47 -178.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -78.34 -37.45 0.74 Allowed 'Trans proline' 0 C--N 1.315 -1.218 0 O-C-N 123.129 1.068 . . . . 0.0 111.848 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -84.66 -10.38 57.37 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.345 -0.847 . . . . 0.0 112.409 -177.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.644 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -85.46 -26.9 26.05 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.064 -1.022 . . . . 0.0 110.933 -179.036 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -75.4 -18.26 59.98 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.435 -0.791 . . . . 0.0 110.947 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 59.2 tttt -65.02 -43.67 91.68 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.278 -0.888 . . . . 0.0 110.204 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.551 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -76.38 -12.84 60.12 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.494 -0.754 . . . . 0.0 110.328 179.393 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.96 -40.83 94.85 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.31 -0.869 . . . . 0.0 110.42 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -69.87 -62.39 1.4 Allowed 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.237 -0.914 . . . . 0.0 109.705 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.6 mp -46.29 -24.27 0.45 Allowed 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.606 -0.684 . . . . 0.0 112.142 -179.522 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.5 tptt -71.33 -45.39 63.07 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.295 -0.878 . . . . 0.0 109.517 179.023 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -66.1 -57.39 7.78 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.71 -0.619 . . . . 0.0 109.873 179.689 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 59.1 mttt -54.83 -25.47 28.65 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.56 -0.713 . . . . 0.0 110.71 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.603 ' O ' HG22 ' A' ' 73' ' ' ILE . 46.0 t80 -78.12 -66.19 0.88 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.517 -0.74 . . . . 0.0 109.611 179.514 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -58.58 -22.56 56.3 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.728 -0.608 . . . . 0.0 111.288 -179.267 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 39.2 mttt -93.79 -18.84 21.61 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.288 -0.883 . . . . 0.0 111.574 -179.069 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -110.04 -27.06 9.38 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.249 -0.907 . . . . 0.0 111.02 -179.376 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.603 HG22 ' O ' ' A' ' 69' ' ' TYR . 4.7 tp -66.98 -33.93 66.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 O-C-N 121.389 -0.819 . . . . 0.0 110.459 -179.563 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.1 -54.52 44.93 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.596 -0.69 . . . . 0.0 110.135 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.19 -19.21 61.78 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.634 -0.666 . . . . 0.0 110.483 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.402 ' CZ ' ' HB2' ' A' ' 8' ' ' ALA . 74.1 t80 -70.65 -39.96 73.32 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.37 -0.832 . . . . 0.0 110.26 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 13.3 mtt-85 -75.67 -83.55 0.06 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.602 -0.686 . . . . 0.0 110.246 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -172.07 38.92 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.139 -0.975 . . . . 0.0 110.091 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 30.0 mmtt . . . . . 0 N--CA 1.494 1.728 0 CA-C-O 117.973 -1.013 . . . . 0.0 110.376 -179.961 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.1 ttt . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.107 0.48 . . . . 0.0 110.247 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -109.62 88.08 2.66 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.635 -0.666 . . . . 0.0 110.114 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 8.6 tttt -169.69 -154.24 0.11 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.517 -0.739 . . . . 0.0 110.116 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.3 tttp -166.31 -151.08 0.12 Allowed 'General case' 0 N--CA 1.485 1.317 0 O-C-N 121.378 -0.826 . . . . 0.0 109.818 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -109.37 168.45 7.68 Favored Pre-proline 0 N--CA 1.494 1.768 0 O-C-N 121.403 -0.811 . . . . 0.0 110.269 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -72.19 -29.77 13.98 Favored 'Trans proline' 0 C--N 1.316 -1.139 0 O-C-N 123.47 1.248 . . . . 0.0 110.339 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -79.25 -15.16 58.43 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.591 -0.693 . . . . 0.0 110.795 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -102.54 128.65 27.65 Favored Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.273 -0.892 . . . . 0.0 109.632 179.538 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -70.94 102.8 1.27 Allowed 'Trans proline' 0 N--CA 1.485 1.011 0 O-C-N 123.154 1.081 . . . . 0.0 110.727 -179.656 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.26 -165.14 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.593 -0.692 . . . . 0.0 110.432 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 7.5 mpt_? -56.83 148.56 47.67 Favored Pre-proline 0 N--CA 1.498 1.953 0 O-C-N 121.455 -0.778 . . . . 0.0 110.732 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.425 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.5 Cg_endo -79.26 126.65 7.05 Favored 'Trans proline' 0 C--N 1.317 -1.1 0 O-C-N 123.387 1.204 . . . . 0.0 110.069 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.56 ' HB2' HD21 ' A' ' 18' ' ' LEU . 49.2 Cg_endo -81.68 178.45 6.56 Favored 'Trans proline' 0 C--N 1.318 -1.067 0 O-C-N 123.266 1.14 . . . . 0.0 110.379 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.532 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 14.7 t -160.23 63.33 0.33 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.502 -0.748 . . . . 0.0 110.526 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.532 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 67.19 -76.42 0.05 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.092 -1.005 . . . . 0.0 109.914 -179.37 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.419 ' CD1' ' CD1' ' A' ' 47' ' ' TRP . 18.6 t80 -51.58 -42.54 61.97 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.326 -0.858 . . . . 0.0 110.814 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -62.62 -29.16 70.4 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.696 -0.627 . . . . 0.0 109.357 179.382 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.56 HD21 ' HB2' ' A' ' 13' ' ' PRO . 45.0 mt -81.36 -40.35 23.66 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.67 -0.644 . . . . 0.0 110.276 -179.658 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -63.4 -49.74 72.58 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.485 -0.759 . . . . 0.0 109.865 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.594 ' HA ' HD22 ' A' ' 43' ' ' LEU . 9.0 t -60.85 -27.52 68.16 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.621 -0.674 . . . . 0.0 109.743 179.422 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 10.6 t -102.9 20.81 16.75 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.587 -0.696 . . . . 0.0 110.875 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -142.26 -12.01 0.83 Allowed 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.19 -0.944 . . . . 0.0 112.099 179.589 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -119.23 24.38 10.78 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.854 -1.154 . . . . 0.0 110.862 -179.434 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.572 ' HG2' HD11 ' A' ' 43' ' ' LEU . 8.0 mtt180 -85.45 -45.93 0.63 Allowed Pre-proline 0 N--CA 1.489 1.485 0 O-C-N 121.512 -0.742 . . . . 0.0 112.126 179.699 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.558 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.7 Cg_endo -66.91 -14.76 44.94 Favored 'Trans proline' 0 N--CA 1.49 1.281 0 O-C-N 122.925 0.961 . . . . 0.0 110.675 -179.11 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.84 -53.07 11.04 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 177.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 27.1 mm -52.03 -31.73 14.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 CA-C-O 121.417 0.627 . . . . 0.0 110.48 179.616 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.558 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.4 mmmm -72.71 -37.28 67.85 Favored 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.225 -177.39 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 26.4 t -58.64 -25.09 62.37 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.495 -0.753 . . . . 0.0 110.764 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -117.52 -21.58 8.53 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.531 -0.73 . . . . 0.0 110.96 -179.59 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.706 ' HB3' HD23 ' A' ' 34' ' ' LEU . 41.0 m80 -121.7 96.59 47.2 Favored Pre-proline 0 N--CA 1.496 1.857 0 O-C-N 121.247 -0.908 . . . . 0.0 109.783 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -75.23 -37.9 1.73 Allowed 'Trans proline' 0 C--N 1.315 -1.195 0 O-C-N 123.446 1.235 . . . . 0.0 110.433 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.32 -9.41 85.78 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 110.452 -1.059 . . . . 0.0 110.452 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.706 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -64.52 82.34 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.163 -1.198 . . . . 0.0 110.33 -179.882 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.6 t -76.49 173.06 11.97 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.503 -0.748 . . . . 0.0 109.703 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 40.0 mm -50.94 -29.72 8.03 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.186 0 O-C-N 121.271 -0.893 . . . . 0.0 110.6 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.87 -75.29 0.29 Allowed Glycine 0 N--CA 1.492 2.389 0 N-CA-C 109.069 -1.612 . . . . 0.0 109.069 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.439 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 29.3 t70 -66.2 -18.84 65.6 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.701 -0.882 . . . . 0.0 111.039 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 36.3 m -73.95 -45.58 49.43 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.243 -0.91 . . . . 0.0 109.954 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -52.32 -44.83 65.33 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.442 -0.787 . . . . 0.0 110.15 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.401 ' CD ' ' HA ' ' A' ' 38' ' ' ASP . 0.5 OUTLIER -80.32 -11.19 59.74 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.76 -0.587 . . . . 0.0 111.243 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.439 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -82.0 2.47 30.76 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 120.93 -1.106 . . . . 0.0 110.815 179.111 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.594 HD22 ' HA ' ' A' ' 20' ' ' CYS . 9.4 mt -106.34 -30.35 9.2 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.204 -0.935 . . . . 0.0 109.599 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -78.99 -42.11 12.99 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 108.854 -1.698 . . . . 0.0 108.854 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -55.11 -42.89 73.52 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.533 -0.98 . . . . 0.0 110.401 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 17.6 mmt -74.18 -50.5 18.98 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.571 -0.706 . . . . 0.0 109.535 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' TRP . . . . . 0.419 ' CD1' ' CD1' ' A' ' 16' ' ' PHE . 69.2 t-105 -49.61 -52.95 26.85 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.642 -0.661 . . . . 0.0 111.047 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 45.0 t -59.92 -35.48 74.99 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.407 -0.808 . . . . 0.0 110.326 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -63.58 -40.27 96.52 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.567 -0.708 . . . . 0.0 109.934 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 89.3 mm-40 -57.52 155.2 9.9 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.576 -0.702 . . . . 0.0 110.556 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 21.7 t -99.87 -150.67 0.38 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.722 -0.612 . . . . 0.0 109.511 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -89.65 47.46 1.47 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.281 -0.887 . . . . 0.0 110.275 179.724 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 62.0 mttt -126.8 -50.71 1.47 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.551 -0.718 . . . . 0.0 110.069 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -64.16 -24.74 67.79 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.67 -0.644 . . . . 0.0 110.405 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 66.1 tttt -81.96 -35.16 29.3 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.467 -0.771 . . . . 0.0 110.432 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -44.44 -52.22 17.89 Favored Pre-proline 0 N--CA 1.506 2.343 0 O-C-N 121.513 -0.742 . . . . 0.0 112.022 -179.04 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -78.96 -37.73 0.54 Allowed 'Trans proline' 0 C--N 1.315 -1.204 0 O-C-N 123.188 1.099 . . . . 0.0 110.958 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -84.53 4.29 32.64 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.38 -0.825 . . . . 0.0 112.043 -178.325 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.01 -23.89 14.77 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.072 -1.017 . . . . 0.0 110.446 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -76.36 -23.76 54.16 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.394 -0.816 . . . . 0.0 110.251 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 50.6 tttm -61.44 -39.82 92.19 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.421 -0.799 . . . . 0.0 109.856 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.489 ' HB1' ' O ' ' A' ' 13' ' ' PRO . . . -78.1 -13.06 60.01 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.6 -0.687 . . . . 0.0 110.365 179.348 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.35 1.75 35.58 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.397 -0.814 . . . . 0.0 110.291 178.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 26.3 mmtm -104.35 -30.36 10.15 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.147 -0.971 . . . . 0.0 109.735 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.476 ' N ' HD12 ' A' ' 65' ' ' LEU . 7.1 mp -86.48 1.51 51.22 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.894 -0.504 . . . . 0.0 110.592 179.102 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.5 tptt -94.38 -34.28 12.84 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.156 -0.965 . . . . 0.0 109.428 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -82.93 -11.59 58.05 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.751 -0.593 . . . . 0.0 110.394 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -105.04 -28.78 10.84 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.439 -0.788 . . . . 0.0 109.467 179.111 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.513 ' HE1' HD13 ' A' ' 73' ' ' ILE . 19.3 t80 -75.76 -54.41 6.98 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.6 -0.688 . . . . 0.0 109.59 179.575 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -68.08 -14.68 63.16 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.719 -0.613 . . . . 0.0 111.306 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 60.8 mttt -101.33 -30.53 11.44 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.256 -0.903 . . . . 0.0 110.709 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -92.48 -31.31 15.3 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.483 -0.76 . . . . 0.0 110.852 -179.439 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.513 HD13 ' HE1' ' A' ' 69' ' ' TYR . 3.7 tp -66.46 -16.05 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 O-C-N 121.398 -0.814 . . . . 0.0 110.953 -179.57 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.44 -47.47 33.42 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.253 -0.905 . . . . 0.0 109.61 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -82.88 -27.08 30.96 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.687 -0.633 . . . . 0.0 109.723 179.233 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 66.8 t80 -63.74 -44.38 93.68 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.586 -0.696 . . . . 0.0 109.88 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 35.5 mtt180 -61.54 -73.0 0.11 Allowed 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.572 -0.705 . . . . 0.0 110.09 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 53.08 46.44 26.69 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.429 -0.794 . . . . 0.0 110.674 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 14.8 mttt . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.284 -179.946 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 30.6 ttm . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 121.065 0.46 . . . . 0.0 110.252 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.35 25.93 7.12 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.561 -0.712 . . . . 0.0 110.381 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -69.58 101.02 1.53 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.537 -0.727 . . . . 0.0 110.286 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.4 mttp -158.17 -172.58 3.95 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.522 -0.736 . . . . 0.0 110.317 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -132.25 176.02 3.23 Favored Pre-proline 0 N--CA 1.495 1.791 0 O-C-N 121.558 -0.714 . . . . 0.0 110.119 -179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.0 -29.48 22.67 Favored 'Trans proline' 0 N--CA 1.487 1.138 0 O-C-N 123.407 1.214 . . . . 0.0 110.296 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -78.29 -19.28 53.92 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.592 -0.693 . . . . 0.0 110.637 -179.233 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -95.53 134.24 24.56 Favored Pre-proline 0 N--CA 1.494 1.73 0 O-C-N 121.341 -0.85 . . . . 0.0 109.173 179.003 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.466 ' HB2' ' CG ' ' A' ' 69' ' ' TYR . 45.1 Cg_endo -72.89 108.23 2.53 Favored 'Trans proline' 0 C--N 1.319 -1.025 0 O-C-N 123.139 1.073 . . . . 0.0 110.775 -179.415 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.6 pttt -67.06 -153.92 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.575 -0.703 . . . . 0.0 109.615 179.51 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -57.75 138.21 82.61 Favored Pre-proline 0 N--CA 1.499 2.01 0 O-C-N 121.269 -0.895 . . . . 0.0 110.145 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -74.56 134.37 18.53 Favored 'Trans proline' 0 C--N 1.318 -1.078 0 O-C-N 123.246 1.129 . . . . 0.0 110.082 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.656 ' HB2' HD21 ' A' ' 18' ' ' LEU . 50.8 Cg_endo -80.56 179.7 5.88 Favored 'Trans proline' 0 C--N 1.318 -1.07 0 O-C-N 123.208 1.11 . . . . 0.0 110.164 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.541 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -170.0 61.65 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.398 -0.814 . . . . 0.0 110.827 -179.877 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.657 ' HB2' ' HA ' ' A' ' 59' ' ' GLU . . . 68.13 -78.71 0.04 OUTLIER 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.072 -1.018 . . . . 0.0 110.473 -179.76 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.417 ' CE2' ' CD1' ' A' ' 47' ' ' TRP . 3.9 t80 -48.65 -49.36 37.73 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.163 -0.961 . . . . 0.0 111.231 -179.463 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -57.15 -31.07 64.99 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.575 -0.703 . . . . 0.0 110.14 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.656 HD21 ' HB2' ' A' ' 13' ' ' PRO . 34.2 mt -78.57 -31.63 47.39 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.534 -0.729 . . . . 0.0 110.181 -179.779 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.502 ' CZ ' ' CZ ' ' A' ' 23' ' ' TYR . 52.1 t80 -76.79 -55.03 5.85 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.607 -0.683 . . . . 0.0 110.731 -179.306 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.8 t -57.7 -52.9 63.56 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.435 -0.791 . . . . 0.0 110.526 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 8.0 t -55.71 -24.19 33.24 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.5 -0.75 . . . . 0.0 110.855 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -98.72 -24.85 14.88 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.426 -0.796 . . . . 0.0 111.001 -179.524 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.658 ' HB3' HD22 ' A' ' 43' ' ' LEU . 2.2 m-85 -88.22 -36.4 16.78 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.378 -0.826 . . . . 0.0 110.685 -179.57 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.54 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 6.8 mtt180 -48.43 -51.38 51.74 Favored Pre-proline 0 N--CA 1.496 1.861 0 O-C-N 121.44 -0.788 . . . . 0.0 111.992 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.577 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.4 Cg_endo -60.11 -28.69 87.51 Favored 'Trans proline' 0 N--CA 1.495 1.566 0 O-C-N 123.21 1.111 . . . . 0.0 109.977 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.3 tmtt? -67.8 -44.68 76.76 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 178.022 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.635 HG13 HD21 ' A' ' 43' ' ' LEU . 46.4 mm -59.54 -23.37 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 CA-C-N 116.152 -0.477 . . . . 0.0 109.877 179.456 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.577 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.9 mmmm -83.56 -38.55 21.54 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.458 -0.777 . . . . 0.0 110.058 -177.693 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.7 t -57.43 -26.62 61.45 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.354 -0.841 . . . . 0.0 110.097 179.614 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -109.19 -48.05 3.32 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.611 -0.681 . . . . 0.0 109.857 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.826 ' HB3' HD23 ' A' ' 34' ' ' LEU . 14.2 m80 -103.31 103.58 35.93 Favored Pre-proline 0 N--CA 1.497 1.884 0 O-C-N 121.642 -0.661 . . . . 0.0 109.685 -179.456 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -81.38 -40.99 0.15 Allowed 'Trans proline' 0 C--N 1.314 -1.287 0 O-C-N 123.367 1.193 . . . . 0.0 109.975 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.08 -23.26 69.52 Favored Glycine 0 N--CA 1.488 2.146 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 179.12 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.826 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -51.79 91.76 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.529 -0.983 . . . . 0.0 110.909 179.976 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 68.7 m -74.35 175.41 7.69 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.583 -0.698 . . . . 0.0 109.755 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.508 ' H ' HD12 ' A' ' 36' ' ' ILE . 2.5 mp -59.65 -31.81 47.85 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.348 -0.845 . . . . 0.0 109.584 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.15 -61.41 7.36 Favored Glycine 0 N--CA 1.495 2.607 0 N-CA-C 109.02 -1.632 . . . . 0.0 109.02 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.678 ' HB3' HD13 ' A' ' 34' ' ' LEU . 16.5 t0 -71.36 -35.92 71.3 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.694 -0.886 . . . . 0.0 110.091 179.163 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.407 ' HB ' ' HA ' ' A' ' 36' ' ' ILE . 80.5 m -64.6 -29.9 70.92 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.138 -0.976 . . . . 0.0 109.82 179.157 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.56 -37.9 59.62 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.641 -0.662 . . . . 0.0 110.245 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.411 ' HG2' ' HA ' ' A' ' 38' ' ' ASP . 2.3 ptpt -95.87 -13.71 23.75 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.525 -0.734 . . . . 0.0 111.922 -178.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -86.04 4.49 37.77 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 120.974 -1.079 . . . . 0.0 110.626 179.7 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.658 HD22 ' HB3' ' A' ' 23' ' ' TYR . 80.1 mt -106.77 -34.27 7.33 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.262 -0.899 . . . . 0.0 109.488 179.467 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -64.57 -32.7 85.08 Favored Glycine 0 N--CA 1.493 2.476 0 N-CA-C 109.79 -1.324 . . . . 0.0 109.79 -179.686 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -51.18 -33.95 29.48 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.403 -1.057 . . . . 0.0 110.794 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 39.2 mtt -87.43 -41.05 13.85 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.604 -0.685 . . . . 0.0 109.888 179.64 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' TRP . . . . . 0.417 ' CD1' ' CE2' ' A' ' 16' ' ' PHE . 71.7 t-105 -56.19 -23.89 38.23 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.55 -0.718 . . . . 0.0 110.858 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 21.9 t -85.28 -36.08 21.1 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.48 -0.763 . . . . 0.0 110.066 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -63.03 -33.02 74.53 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.633 -0.667 . . . . 0.0 109.828 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 -64.81 149.64 49.0 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.645 -0.659 . . . . 0.0 110.12 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.6 m -104.44 -153.22 0.48 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.669 -0.644 . . . . 0.0 109.526 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.88 58.29 3.33 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.376 -0.827 . . . . 0.0 109.915 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 26.7 tttt -136.24 -50.79 0.7 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.399 -0.813 . . . . 0.0 110.297 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -69.81 -27.95 65.31 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.557 -0.715 . . . . 0.0 110.726 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.419 ' O ' ' N ' ' A' ' 59' ' ' GLU . 32.6 ttpt -80.0 -37.71 33.65 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.444 -0.785 . . . . 0.0 110.695 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -44.14 -53.01 14.56 Favored Pre-proline 0 N--CA 1.508 2.439 0 O-C-N 121.472 -0.768 . . . . 0.0 112.513 -178.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -77.66 -37.43 0.92 Allowed 'Trans proline' 0 C--N 1.315 -1.2 0 O-C-N 123.078 1.041 . . . . 0.0 111.744 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -81.86 -14.86 55.67 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.395 -0.815 . . . . 0.0 112.089 -178.111 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.657 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -82.84 -24.97 33.04 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.202 -0.936 . . . . 0.0 111.086 -178.934 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -79.83 -20.59 45.7 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.451 -0.781 . . . . 0.0 110.845 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 43.1 tttm -63.04 -48.39 78.9 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.409 -0.807 . . . . 0.0 110.195 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.65 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -81.12 -13.36 58.76 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.447 -0.783 . . . . 0.0 110.316 179.294 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.87 -28.14 69.83 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.321 -0.862 . . . . 0.0 109.154 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -81.75 -66.06 0.94 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.577 -0.702 . . . . 0.0 109.17 178.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.559 ' H ' HD12 ' A' ' 65' ' ' LEU . 3.1 mp -48.32 -22.56 0.7 Allowed 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.602 -0.687 . . . . 0.0 112.117 -179.356 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 23.9 tptt -65.49 -45.46 83.54 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.14 -0.975 . . . . 0.0 109.851 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -66.66 -54.51 22.42 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.662 -0.649 . . . . 0.0 110.349 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 68.9 mttt -56.4 -29.93 62.12 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.487 -0.758 . . . . 0.0 110.478 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.538 ' O ' HG22 ' A' ' 73' ' ' ILE . 3.8 m-85 -75.72 -70.07 0.45 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.576 -0.703 . . . . 0.0 109.834 179.652 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -49.53 -29.26 6.56 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.662 -0.649 . . . . 0.0 111.342 -179.53 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.8 ttmm -84.47 -58.04 2.9 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.529 -0.732 . . . . 0.0 110.47 -179.693 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -64.11 -30.23 71.31 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.624 -0.673 . . . . 0.0 111.112 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.538 HG22 ' O ' ' A' ' 69' ' ' TYR . 9.7 tp -71.53 -35.42 56.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.351 -0.843 . . . . 0.0 110.442 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.9 -48.72 80.53 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.47 -0.769 . . . . 0.0 110.111 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.77 -11.32 59.87 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.634 -0.666 . . . . 0.0 110.746 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -83.71 -30.08 27.03 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.312 -0.867 . . . . 0.0 110.242 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 22.6 mtt180 -85.73 6.13 29.18 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.499 -0.751 . . . . 0.0 111.173 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 51.17 88.86 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.119 0 O-C-N 120.986 -1.071 . . . . 0.0 110.98 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.7 tptt . . . . . 0 N--CA 1.494 1.739 0 CA-C-O 117.999 -1.001 . . . . 0.0 110.253 -179.978 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.0 tpp . . . . . 0 N--CA 1.49 1.573 0 CA-C-O 121.184 0.516 . . . . 0.0 110.229 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 52.74 91.94 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.465 -0.772 . . . . 0.0 110.746 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -170.24 100.42 0.27 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.55 -0.719 . . . . 0.0 110.266 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 17.4 mtpp -60.1 -62.96 1.48 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.56 -0.713 . . . . 0.0 110.415 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -162.23 165.21 16.09 Favored Pre-proline 0 N--CA 1.493 1.715 0 O-C-N 121.497 -0.752 . . . . 0.0 110.33 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.65 -40.23 2.17 Favored 'Trans proline' 0 C--N 1.318 -1.043 0 O-C-N 123.436 1.229 . . . . 0.0 110.33 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 35.5 t30 -78.51 -11.33 59.95 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.715 -0.616 . . . . 0.0 111.044 -179.095 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -105.21 132.62 20.72 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.156 -0.965 . . . . 0.0 109.361 178.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.76 114.76 4.11 Favored 'Trans proline' 0 C--N 1.318 -1.032 0 O-C-N 123.095 1.05 . . . . 0.0 110.458 -179.667 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.5 pttt -60.12 -162.44 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.664 -0.648 . . . . 0.0 110.337 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.68 144.59 98.8 Favored Pre-proline 0 N--CA 1.495 1.821 0 O-C-N 121.421 -0.799 . . . . 0.0 110.069 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.405 ' HG3' ' CE2' ' A' ' 69' ' ' TYR . 49.3 Cg_endo -75.24 131.0 13.54 Favored 'Trans proline' 0 C--N 1.317 -1.082 0 O-C-N 123.296 1.156 . . . . 0.0 109.802 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.674 ' CB ' HD21 ' A' ' 18' ' ' LEU . 48.9 Cg_endo -81.26 -176.75 3.27 Favored 'Trans proline' 0 C--N 1.317 -1.115 0 O-C-N 123.197 1.104 . . . . 0.0 110.172 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.535 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 76.4 p -165.48 59.21 0.11 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.513 -0.742 . . . . 0.0 110.807 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.535 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 68.52 -77.09 0.05 Allowed 'General case' 0 N--CA 1.504 2.258 0 O-C-N 121.12 -0.987 . . . . 0.0 110.662 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -46.99 -51.6 16.74 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.299 -0.876 . . . . 0.0 111.47 -179.391 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -57.55 -36.95 72.31 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.497 -0.752 . . . . 0.0 109.945 179.572 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.674 HD21 ' CB ' ' A' ' 13' ' ' PRO . 36.1 mt -70.08 -38.63 75.75 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.619 -0.676 . . . . 0.0 110.347 -179.751 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.492 ' CE1' ' CE1' ' A' ' 23' ' ' TYR . 63.1 t80 -71.94 -53.05 14.3 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.517 -0.739 . . . . 0.0 110.621 -179.507 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 34.6 t -56.83 -53.82 53.46 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.368 -0.833 . . . . 0.0 110.657 -179.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 11.8 t -56.22 -29.01 60.39 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.534 -0.729 . . . . 0.0 110.822 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -90.82 -27.75 18.65 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.468 -0.77 . . . . 0.0 110.798 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.492 ' CE1' ' CE1' ' A' ' 19' ' ' PHE . 9.1 m-85 -94.74 14.69 20.43 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.511 -0.743 . . . . 0.0 111.287 -179.433 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.527 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 4.2 mtp180 -88.59 -43.82 0.46 Allowed Pre-proline 0 N--CA 1.488 1.446 0 O-C-N 121.253 -0.904 . . . . 0.0 112.53 179.741 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.566 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 37.8 Cg_endo -65.66 -17.41 56.67 Favored 'Trans proline' 0 N--CA 1.491 1.365 0 O-C-N 122.865 0.929 . . . . 0.0 110.563 -178.775 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.8 tmtt? -72.02 -50.43 28.64 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 177.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 24.5 mm -54.86 -33.79 29.23 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 CA-C-O 121.224 0.535 . . . . 0.0 110.631 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.566 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 6.2 mmmm -71.01 -38.35 72.64 Favored 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 120.121 -0.632 . . . . 0.0 110.321 -177.073 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.6 t -58.65 -24.47 61.22 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.515 -0.741 . . . . 0.0 110.797 -179.531 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -117.29 -23.04 7.99 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.435 -0.79 . . . . 0.0 110.978 -179.565 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.747 ' HB3' HD23 ' A' ' 34' ' ' LEU . 43.0 m80 -120.56 96.58 48.91 Favored Pre-proline 0 N--CA 1.495 1.82 0 O-C-N 121.342 -0.848 . . . . 0.0 109.709 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -75.59 -29.07 7.68 Favored 'Trans proline' 0 C--N 1.315 -1.226 0 O-C-N 123.416 1.219 . . . . 0.0 110.54 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -85.04 -12.2 74.55 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 110.571 -1.012 . . . . 0.0 110.571 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.747 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -61.56 83.67 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.257 -1.143 . . . . 0.0 110.658 -179.543 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 71.5 p -72.52 171.1 13.0 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.512 -0.742 . . . . 0.0 109.847 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.586 ' H ' HD12 ' A' ' 36' ' ' ILE . 2.7 mp -53.6 -28.6 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.122 0 O-C-N 121.281 -0.887 . . . . 0.0 109.944 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.49 -71.13 0.83 Allowed Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.242 -1.543 . . . . 0.0 109.242 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.486 ' HB3' HD13 ' A' ' 34' ' ' LEU . 15.0 t70 -66.53 -27.41 67.74 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.698 -0.883 . . . . 0.0 110.456 179.551 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.433 ' HB ' ' HA ' ' A' ' 36' ' ' ILE . 33.2 m -67.38 -27.72 67.34 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.494 -0.754 . . . . 0.0 109.893 179.404 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.38 -47.37 23.52 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.574 -0.704 . . . . 0.0 109.685 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.69 -17.1 52.18 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.605 -0.684 . . . . 0.0 111.377 -179.64 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.413 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 11.0 tptt -76.66 -59.15 2.9 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.111 -0.993 . . . . 0.0 109.885 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.42 HD12 ' O ' ' A' ' 39' ' ' THR . 54.7 mt -47.03 -27.42 1.32 Allowed 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.648 -0.657 . . . . 0.0 111.544 -179.578 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.91 -36.2 91.79 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.182 -1.567 . . . . 0.0 109.182 179.542 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -51.01 -37.36 44.65 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.508 -0.995 . . . . 0.0 111.074 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 65.0 mtt -82.47 -42.8 18.03 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.598 -0.689 . . . . 0.0 110.318 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 69.9 t-105 -49.37 -32.93 12.43 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.523 -0.736 . . . . 0.0 111.585 -179.199 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.3 t -93.02 -24.06 18.47 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.306 -0.872 . . . . 0.0 110.592 -179.796 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -64.02 -43.3 96.02 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.413 -0.805 . . . . 0.0 109.993 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 52.2 mm-40 -61.83 157.62 17.74 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.719 -0.613 . . . . 0.0 110.329 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.3 t -87.23 -147.7 0.14 Allowed 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -83.58 54.11 2.75 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.181 -0.949 . . . . 0.0 110.125 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.0 tttt -129.62 -37.08 1.6 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.465 -0.772 . . . . 0.0 110.596 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -58.61 -38.62 78.4 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.304 -0.873 . . . . 0.0 110.791 -179.576 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -92.92 24.13 3.84 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.35 -0.844 . . . . 0.0 111.458 -179.197 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.454 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 4.4 mm-40 -98.05 -56.89 0.18 Allowed Pre-proline 0 N--CA 1.498 1.959 0 O-C-N 121.219 -0.926 . . . . 0.0 110.539 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.454 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.7 Cg_endo -83.23 -32.16 0.55 Allowed 'Trans proline' 0 N--CA 1.482 0.84 0 O-C-N 122.817 0.904 . . . . 0.0 110.666 179.76 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -82.09 -0.85 46.47 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.493 -0.754 . . . . 0.0 111.769 -178.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.42 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -92.54 -24.52 18.73 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.084 -1.01 . . . . 0.0 110.814 -179.577 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -79.26 -23.91 43.34 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.443 -0.785 . . . . 0.0 110.332 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -61.66 -44.83 96.21 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.432 -0.792 . . . . 0.0 109.92 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.517 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -70.22 -11.43 60.89 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.598 -0.689 . . . . 0.0 110.482 179.467 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -88.57 7.45 33.19 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.262 -0.899 . . . . 0.0 110.315 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 58.9 mmtt -107.02 -34.39 7.19 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.222 -0.923 . . . . 0.0 109.111 178.238 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.413 ' N ' HD12 ' A' ' 65' ' ' LEU . 6.2 mp -81.04 -4.12 54.14 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.984 -0.448 . . . . 0.0 110.342 178.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.9 tppt? -80.82 -31.53 35.54 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.264 -0.898 . . . . 0.0 109.301 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -69.23 -63.26 1.1 Allowed 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 119.876 -0.73 . . . . 0.0 109.603 179.499 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -55.2 -24.21 26.04 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.531 -0.731 . . . . 0.0 111.107 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.514 ' O ' HG22 ' A' ' 73' ' ' ILE . 29.5 t80 -79.18 -69.56 0.57 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.306 -0.871 . . . . 0.0 110.29 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -62.9 -14.06 41.93 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.551 -0.718 . . . . 0.0 111.768 -179.275 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.7 tttt -98.24 -27.02 14.34 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.104 -0.998 . . . . 0.0 110.893 -179.553 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -104.39 -24.56 13.05 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.434 -0.791 . . . . 0.0 111.079 -179.41 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.514 HG22 ' O ' ' A' ' 69' ' ' TYR . 3.2 tp -68.97 -30.29 46.26 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 O-C-N 121.407 -0.808 . . . . 0.0 110.421 -179.543 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.46 -46.83 86.74 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.648 -0.658 . . . . 0.0 109.861 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -81.99 -20.16 39.04 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.701 -0.624 . . . . 0.0 110.498 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 75.1 t80 -67.08 -35.38 79.7 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.409 -0.807 . . . . 0.0 110.129 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 43.8 mtt180 -101.4 10.1 40.85 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.56 -0.712 . . . . 0.0 110.931 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 52.5 81.26 0.08 Allowed 'General case' 0 N--CA 1.501 2.119 0 O-C-N 120.964 -1.085 . . . . 0.0 110.81 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 15.0 mttm . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 118.009 -0.996 . . . . 0.0 110.207 -179.927 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.4 ttt . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.083 0.468 . . . . 0.0 110.177 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 3.1 mttm 52.56 -169.05 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.514 -0.741 . . . . 0.0 110.888 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.1 mmtt 53.62 -163.89 0.1 Allowed 'General case' 0 N--CA 1.503 2.189 0 O-C-N 121.469 -0.769 . . . . 0.0 110.556 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.5 tttt -169.07 -155.36 0.14 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.596 -0.69 . . . . 0.0 109.873 179.856 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.548 ' HB2' ' HB3' ' A' ' 8' ' ' ALA . 1.0 OUTLIER -63.88 152.89 85.98 Favored Pre-proline 0 N--CA 1.495 1.792 0 O-C-N 121.589 -0.695 . . . . 0.0 110.431 -179.864 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -73.66 -45.12 0.42 Allowed 'Trans proline' 0 C--N 1.317 -1.081 0 O-C-N 123.468 1.247 . . . . 0.0 110.422 179.824 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -78.81 -22.7 45.85 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.606 -0.684 . . . . 0.0 110.738 -179.162 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.548 ' HB3' ' HB2' ' A' ' 5' ' ' ASP . . . -78.13 143.19 65.0 Favored Pre-proline 0 N--CA 1.495 1.777 0 O-C-N 121.225 -0.922 . . . . 0.0 109.428 179.186 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -71.58 98.9 0.89 Allowed 'Trans proline' 0 C--N 1.318 -1.062 0 O-C-N 123.258 1.136 . . . . 0.0 110.443 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.6 pttm -65.6 -155.49 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.599 -0.688 . . . . 0.0 109.658 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -55.44 145.88 46.06 Favored Pre-proline 0 N--CA 1.499 2.015 0 O-C-N 121.291 -0.881 . . . . 0.0 110.365 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -73.57 126.28 10.75 Favored 'Trans proline' 0 C--N 1.316 -1.162 0 O-C-N 123.378 1.199 . . . . 0.0 110.319 -179.679 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.476 ' C ' ' HB1' ' A' ' 62' ' ' ALA . 48.8 Cg_endo -81.57 173.44 11.41 Favored 'Trans proline' 0 C--N 1.318 -1.043 0 O-C-N 123.239 1.126 . . . . 0.0 109.799 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.579 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 33.5 t -171.83 64.57 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.429 -0.794 . . . . 0.0 111.001 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.579 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 71.32 -74.26 0.09 Allowed 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.124 -0.985 . . . . 0.0 110.876 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -46.67 -52.87 12.83 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.274 -0.891 . . . . 0.0 111.556 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -58.31 -39.24 78.84 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.575 -0.703 . . . . 0.0 109.865 179.509 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.586 HD11 ' HB2' ' A' ' 62' ' ' ALA . 48.4 mt -64.59 -42.94 95.26 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.667 -0.646 . . . . 0.0 109.814 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.501 ' CE1' ' CE1' ' A' ' 23' ' ' TYR . 80.9 t80 -68.71 -51.73 38.38 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.647 -0.658 . . . . 0.0 110.268 -179.827 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.3 m -55.7 -56.05 24.97 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.545 -0.722 . . . . 0.0 110.69 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 84.8 p -55.87 -30.78 62.07 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.48 -0.762 . . . . 0.0 110.831 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -87.54 -27.31 22.68 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.464 -0.773 . . . . 0.0 110.909 -179.567 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.501 ' CE1' ' CE1' ' A' ' 19' ' ' PHE . 9.6 m-85 -98.87 14.85 27.46 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.458 -0.776 . . . . 0.0 111.369 -179.5 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.516 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 14.2 mtp180 -87.91 -45.01 0.49 Allowed Pre-proline 0 N--CA 1.488 1.437 0 O-C-N 121.151 -0.968 . . . . 0.0 112.505 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.562 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.0 Cg_endo -65.47 -17.61 57.88 Favored 'Trans proline' 0 N--CA 1.491 1.353 0 O-C-N 122.802 0.896 . . . . 0.0 110.539 -178.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.1 tmtm? -71.71 -49.8 36.08 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 177.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 23.7 mm -55.49 -34.14 34.1 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 CA-C-O 121.322 0.582 . . . . 0.0 110.566 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.562 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.7 mmmm -70.98 -38.6 72.75 Favored 'General case' 0 N--CA 1.497 1.886 0 C-N-CA 120.167 -0.613 . . . . 0.0 110.299 -176.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.9 t -59.91 -23.52 63.57 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.461 -0.775 . . . . 0.0 110.816 -179.564 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -117.52 -21.04 8.78 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.484 -0.76 . . . . 0.0 111.116 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.753 ' HB3' HD23 ' A' ' 34' ' ' LEU . 48.5 m80 -121.96 96.45 46.79 Favored Pre-proline 0 N--CA 1.495 1.824 0 O-C-N 121.348 -0.845 . . . . 0.0 109.784 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -75.38 -28.75 8.29 Favored 'Trans proline' 0 C--N 1.315 -1.185 0 O-C-N 123.416 1.219 . . . . 0.0 110.455 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -84.14 -13.83 73.32 Favored Glycine 0 N--CA 1.488 2.127 0 N-CA-C 110.504 -1.038 . . . . 0.0 110.504 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.753 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -61.08 82.8 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.334 -1.097 . . . . 0.0 110.892 -179.522 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 33.4 t -75.05 171.54 13.93 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.506 -0.746 . . . . 0.0 109.78 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 40.8 mm -52.12 -27.73 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.175 0 O-C-N 121.284 -0.885 . . . . 0.0 110.369 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -61.42 -71.63 0.77 Allowed Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.227 -1.549 . . . . 0.0 109.227 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.423 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 8.2 t70 -67.33 -26.04 66.3 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.628 -0.925 . . . . 0.0 110.765 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 56.2 m -68.46 -28.79 67.36 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.458 -0.777 . . . . 0.0 109.926 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.58 -47.13 34.25 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.536 -0.728 . . . . 0.0 109.747 179.572 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -81.49 -14.71 56.67 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.573 -0.704 . . . . 0.0 111.366 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 6.9 tptt -76.4 -58.82 3.06 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.085 -1.009 . . . . 0.0 109.727 179.686 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.409 HD11 ' CG ' ' A' ' 24' ' ' ARG . 45.0 mt -48.28 -27.09 2.29 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.493 -0.754 . . . . 0.0 111.287 -179.7 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.92 -38.73 96.5 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 109.17 -1.572 . . . . 0.0 109.17 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -51.7 -39.34 58.14 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.524 -0.986 . . . . 0.0 110.852 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.0 mmt -72.91 -45.63 57.07 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.617 -0.677 . . . . 0.0 109.516 179.567 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 51.7 t-105 -52.14 -58.16 7.41 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.671 -0.643 . . . . 0.0 110.771 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 9.0 t -59.35 -32.6 70.26 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.453 -0.779 . . . . 0.0 110.305 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -63.68 -42.33 98.04 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.574 -0.704 . . . . 0.0 109.945 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -64.43 154.93 34.21 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.651 -0.655 . . . . 0.0 110.404 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 76.2 p -99.31 -150.15 0.37 Allowed 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.94 57.41 3.06 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.203 -0.935 . . . . 0.0 110.15 179.656 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 22.5 tttt -134.99 -43.25 0.73 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.352 -0.842 . . . . 0.0 110.212 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -63.41 -32.29 73.69 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.487 -0.758 . . . . 0.0 110.56 -179.679 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.2 ttpt -91.83 22.97 3.86 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.332 -0.855 . . . . 0.0 111.325 -179.225 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.46 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 8.0 mm-40 -96.95 -59.98 0.15 Allowed Pre-proline 0 N--CA 1.497 1.881 0 O-C-N 121.103 -0.998 . . . . 0.0 110.843 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.46 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.4 Cg_endo -80.45 -30.29 2.04 Favored 'Trans proline' 0 N--CA 1.486 1.047 0 O-C-N 122.871 0.932 . . . . 0.0 110.897 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.542 ' O ' HD12 ' A' ' 18' ' ' LEU . 3.2 m-85 -82.49 -8.92 59.6 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.492 -0.755 . . . . 0.0 112.01 -178.587 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.57 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -84.3 -25.37 29.34 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.095 -1.003 . . . . 0.0 111.113 -179.331 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -79.09 -21.94 45.96 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.461 -0.774 . . . . 0.0 110.791 -179.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 44.9 tttt -66.0 -44.05 85.92 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.336 -0.853 . . . . 0.0 109.858 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.586 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -79.9 -15.13 57.96 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.534 -0.728 . . . . 0.0 110.134 179.411 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.02 -31.33 69.85 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.269 -0.894 . . . . 0.0 109.42 179.427 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -74.1 -62.75 1.4 Allowed 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 178.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.459 HD22 ' HG3' ' A' ' 13' ' ' PRO . 0.8 OUTLIER -43.61 -25.36 0.16 Allowed 'General case' 0 N--CA 1.506 2.336 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -179.297 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -65.02 -44.22 89.89 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.223 -0.923 . . . . 0.0 109.169 178.78 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -66.24 -57.4 7.65 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.755 -0.59 . . . . 0.0 109.787 179.608 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.7 mptm? -51.31 -31.31 21.12 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.397 -0.815 . . . . 0.0 110.718 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.55 ' O ' HG22 ' A' ' 73' ' ' ILE . 34.8 t80 -75.62 -64.37 1.09 Allowed 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 179.095 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -59.67 -17.81 37.03 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.881 -0.512 . . . . 0.0 111.322 -179.668 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.4 mmmt -99.47 -23.75 15.01 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.169 -0.957 . . . . 0.0 111.45 -179.147 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -103.95 -28.66 11.43 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.27 -0.894 . . . . 0.0 110.983 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.55 HG22 ' O ' ' A' ' 69' ' ' TYR . 3.1 tp -65.74 -36.02 76.56 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 121.427 -0.796 . . . . 0.0 110.186 -179.655 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.45 -48.48 80.98 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.548 -0.72 . . . . 0.0 109.801 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.52 -22.53 57.05 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.726 -0.609 . . . . 0.0 110.104 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -67.54 -31.39 71.45 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.502 -0.749 . . . . 0.0 109.944 179.74 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 19.8 mtp85 -107.07 8.4 30.25 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.55 -0.719 . . . . 0.0 110.923 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 55.19 73.83 0.4 Allowed 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.041 -1.037 . . . . 0.0 110.598 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 117.931 -1.033 . . . . 0.0 110.3 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 36.6 ttm . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 121.17 0.51 . . . . 0.0 110.236 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.23 -169.35 2.48 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.52 -0.738 . . . . 0.0 110.149 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.6 tttt 53.99 -168.63 0.06 Allowed 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.424 -0.798 . . . . 0.0 110.611 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.548 ' NZ ' HD23 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.67 174.53 10.56 Favored 'General case' 0 C--N 1.307 -1.258 0 O-C-N 121.571 -0.706 . . . . 0.0 110.129 -179.867 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -99.68 156.67 35.1 Favored Pre-proline 0 N--CA 1.494 1.73 0 O-C-N 121.661 -0.649 . . . . 0.0 110.132 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.99 -21.04 28.29 Favored 'Trans proline' 0 C--N 1.317 -1.098 0 O-C-N 123.392 1.206 . . . . 0.0 110.858 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -96.51 -27.81 14.69 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.465 -0.772 . . . . 0.0 110.132 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -105.88 101.05 31.16 Favored Pre-proline 0 N--CA 1.493 1.713 0 O-C-N 121.501 -0.75 . . . . 0.0 110.156 179.64 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -71.87 86.63 0.89 Allowed 'Trans proline' 0 C--N 1.317 -1.113 0 O-C-N 123.167 1.088 . . . . 0.0 110.218 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.53 -155.0 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.63 -0.669 . . . . 0.0 110.323 -179.715 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -61.0 133.92 92.67 Favored Pre-proline 0 N--CA 1.497 1.899 0 O-C-N 121.492 -0.755 . . . . 0.0 110.153 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.44 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.8 Cg_endo -76.82 137.72 18.08 Favored 'Trans proline' 0 C--N 1.319 -0.992 0 O-C-N 123.192 1.101 . . . . 0.0 109.847 179.4 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.674 ' CG ' HD21 ' A' ' 18' ' ' LEU . 50.3 Cg_endo -79.29 -169.41 0.79 Allowed 'Trans proline' 0 C--N 1.316 -1.177 0 O-C-N 123.174 1.092 . . . . 0.0 110.154 -179.745 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.509 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 66.5 p -163.0 63.67 0.19 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.439 -0.788 . . . . 0.0 110.92 -179.728 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.509 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 66.49 -78.06 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.002 -1.061 . . . . 0.0 110.518 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -48.47 -48.19 37.9 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.351 -0.843 . . . . 0.0 111.447 -179.487 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -59.78 -33.99 72.42 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.583 -0.698 . . . . 0.0 109.737 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.674 HD21 ' CG ' ' A' ' 13' ' ' PRO . 42.4 mt -72.29 -33.03 67.12 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.707 -0.621 . . . . 0.0 109.488 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.492 ' CZ ' ' CZ ' ' A' ' 23' ' ' TYR . 22.9 t80 -73.3 -52.48 13.76 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.78 -0.575 . . . . 0.0 110.489 -179.758 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 17.0 p -60.81 -31.79 71.18 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.477 -0.764 . . . . 0.0 110.38 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 91.8 p -71.14 -23.86 62.16 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.781 -0.574 . . . . 0.0 112.111 -178.451 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.9 -24.71 9.39 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.022 -1.049 . . . . 0.0 112.384 -178.611 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.492 ' CZ ' ' CZ ' ' A' ' 19' ' ' PHE . 4.9 m-85 -80.33 -36.93 33.51 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 120.925 -1.109 . . . . 0.0 111.099 -179.207 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.556 ' HG2' HD11 ' A' ' 43' ' ' LEU . 10.3 mtp180 -48.0 -52.91 36.85 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.319 -0.863 . . . . 0.0 112.198 -179.61 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.562 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.2 Cg_endo -59.67 -27.7 85.57 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 O-C-N 123.274 1.144 . . . . 0.0 110.261 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.8 tmtm? -69.63 -45.95 67.33 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 177.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.2 mm -57.77 -29.67 35.72 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.28 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.562 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.4 mmmm -73.09 -35.49 66.63 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 119.968 -0.693 . . . . 0.0 110.571 -177.183 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 28.9 t -66.27 -22.6 66.31 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.445 -0.784 . . . . 0.0 110.62 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -116.19 -16.06 11.01 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.528 -0.733 . . . . 0.0 111.142 -179.614 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.692 ' HB3' HD23 ' A' ' 34' ' ' LEU . 44.6 m80 -129.83 94.75 30.76 Favored Pre-proline 0 N--CA 1.497 1.889 0 O-C-N 121.306 -0.871 . . . . 0.0 109.238 179.46 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -74.72 -36.09 3.03 Favored 'Trans proline' 0 C--N 1.316 -1.148 0 O-C-N 123.514 1.27 . . . . 0.0 110.479 -179.633 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -75.34 -19.17 79.71 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 110.051 -1.22 . . . . 0.0 110.051 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.692 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -55.11 86.28 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.522 -0.987 . . . . 0.0 111.378 -179.385 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.404 ' N ' ' O ' ' A' ' 33' ' ' GLY . 42.8 t -80.34 171.24 15.32 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.549 -0.719 . . . . 0.0 109.471 179.552 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.44 ' O ' ' HB2' ' A' ' 40' ' ' ALA . 43.3 mm -53.33 -26.2 11.92 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 O-C-N 121.326 -0.859 . . . . 0.0 110.347 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -61.08 -71.77 0.74 Allowed Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.238 -1.545 . . . . 0.0 109.238 179.619 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.429 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 16.4 t70 -69.32 -28.22 66.06 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.688 -0.889 . . . . 0.0 110.502 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.433 ' OG1' HD12 ' A' ' 34' ' ' LEU . 86.6 m -68.68 -32.27 71.98 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.413 -0.804 . . . . 0.0 109.769 179.437 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.44 ' HB2' ' O ' ' A' ' 36' ' ' ILE . . . -69.89 -39.61 76.14 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 120.073 -0.651 . . . . 0.0 109.484 179.693 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -91.51 -15.12 29.24 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.644 -0.66 . . . . 0.0 111.493 -179.399 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.429 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 30.7 tptt -83.29 1.14 42.5 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.022 -1.049 . . . . 0.0 110.526 179.378 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.556 HD11 ' HG2' ' A' ' 24' ' ' ARG . 25.7 mt -97.45 -35.1 10.77 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.12 -0.987 . . . . 0.0 108.958 178.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.35 -31.98 71.75 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 108.841 -1.704 . . . . 0.0 108.841 179.33 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -55.35 -47.63 75.45 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.595 -0.944 . . . . 0.0 110.179 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 16.2 mtp -70.61 -48.98 52.43 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 70.0 t-105 -52.92 -58.42 7.01 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.708 -0.62 . . . . 0.0 110.555 179.735 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 46.6 t -60.76 -34.34 74.31 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.472 -0.767 . . . . 0.0 110.26 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -58.02 -39.11 77.52 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.603 -0.686 . . . . 0.0 110.26 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 57.5 mm-40 -67.54 164.96 17.83 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.592 -0.692 . . . . 0.0 110.075 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.1 m -150.09 107.2 3.58 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.544 -0.723 . . . . 0.0 110.17 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 53.01 47.1 25.41 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.347 -0.845 . . . . 0.0 110.655 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.9 mtpt -149.26 -64.76 0.23 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.556 -0.715 . . . . 0.0 109.86 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -59.78 -31.28 69.53 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.5 -0.75 . . . . 0.0 110.562 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.4 tttm -96.05 22.36 7.64 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.427 -0.796 . . . . 0.0 111.191 -179.447 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.436 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 1.3 mm-40 -99.1 -55.02 0.18 Allowed Pre-proline 0 N--CA 1.496 1.842 0 O-C-N 121.195 -0.941 . . . . 0.0 110.61 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.436 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.0 Cg_endo -83.73 -36.76 0.18 Allowed 'Trans proline' 0 C--N 1.321 -0.873 0 O-C-N 122.925 0.961 . . . . 0.0 110.825 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -80.6 5.33 15.76 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.539 -0.725 . . . . 0.0 111.787 -179.306 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.492 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -97.8 -20.35 17.59 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.079 -1.013 . . . . 0.0 110.619 179.943 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -77.67 -24.33 49.38 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.441 -0.787 . . . . 0.0 110.364 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.429 ' HD3' HD13 ' A' ' 18' ' ' LEU . 26.4 tttp -58.81 -45.36 90.09 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.409 -0.807 . . . . 0.0 110.027 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.7 -10.08 59.24 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.596 -0.69 . . . . 0.0 110.58 179.416 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -86.31 2.97 45.35 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.253 -0.905 . . . . 0.0 110.503 179.027 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 24.4 mmtp -105.12 -32.86 8.49 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.231 -0.918 . . . . 0.0 109.462 179.536 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.548 HD23 ' NZ ' ' A' ' 4' ' ' LYS . 4.8 mp -80.83 4.25 19.8 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.909 -0.494 . . . . 0.0 111.039 179.553 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -97.29 -26.76 14.79 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.141 -0.974 . . . . 0.0 109.926 179.503 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -84.71 -14.52 48.13 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.521 -0.737 . . . . 0.0 110.62 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.4 mmtt -103.57 -29.19 11.28 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.309 -0.869 . . . . 0.0 109.711 179.474 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.548 ' O ' HG22 ' A' ' 73' ' ' ILE . 11.6 t80 -75.26 -53.34 8.95 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.63 -0.669 . . . . 0.0 109.628 179.71 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -63.99 -13.34 45.63 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.618 -0.676 . . . . 0.0 111.494 -179.478 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.4 mmtm -108.1 -32.42 7.53 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.129 -0.982 . . . . 0.0 110.901 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -89.69 -36.39 15.25 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.443 -0.785 . . . . 0.0 111.281 -179.079 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.548 HG22 ' O ' ' A' ' 69' ' ' TYR . 3.7 tp -65.59 -18.78 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 O-C-N 121.27 -0.894 . . . . 0.0 110.864 -179.316 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.73 -45.77 70.63 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.296 -0.877 . . . . 0.0 109.858 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -87.03 -26.03 23.93 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.633 -0.667 . . . . 0.0 110.216 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -61.96 -50.04 73.69 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.546 -0.722 . . . . 0.0 110.05 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 61.8 mtt-85 -106.04 10.32 32.21 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.54 -0.725 . . . . 0.0 111.034 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 56.63 69.82 0.71 Allowed 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.084 -1.01 . . . . 0.0 110.346 -179.629 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.7 tptt . . . . . 0 N--CA 1.494 1.736 0 CA-C-O 117.936 -1.03 . . . . 0.0 110.244 -179.967 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.0 ttp . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.054 0.454 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.26 160.89 17.84 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.595 -0.691 . . . . 0.0 110.217 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 10.2 tttt -169.97 151.66 4.14 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.545 -0.722 . . . . 0.0 110.186 179.861 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.5 -71.53 0.13 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.585 -0.697 . . . . 0.0 110.423 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -163.65 156.84 16.06 Favored Pre-proline 0 N--CA 1.493 1.715 0 O-C-N 121.583 -0.698 . . . . 0.0 110.202 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.64 -46.32 0.46 Allowed 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.457 1.241 . . . . 0.0 110.415 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -81.31 2.7 27.02 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.573 -0.704 . . . . 0.0 111.166 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -93.92 142.34 24.9 Favored Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.144 -0.973 . . . . 0.0 110.037 179.828 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.432 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 53.3 Cg_endo -78.91 87.45 1.55 Allowed 'Trans proline' 0 C--N 1.318 -1.041 0 O-C-N 123.22 1.116 . . . . 0.0 110.282 -179.798 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -110.0 26.34 10.77 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.465 -0.772 . . . . 0.0 110.98 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.5 ttm180 -159.19 94.61 1.77 Allowed Pre-proline 0 N--CA 1.493 1.681 0 O-C-N 121.734 -0.604 . . . . 0.0 110.488 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -76.98 114.05 3.74 Favored 'Trans proline' 0 C--N 1.317 -1.127 0 O-C-N 123.491 1.259 . . . . 0.0 110.491 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.736 ' CB ' HD21 ' A' ' 18' ' ' LEU . 47.2 Cg_endo -81.04 164.65 19.8 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 O-C-N 123.282 1.149 . . . . 0.0 110.251 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.544 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 94.6 p -157.06 53.9 0.51 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.43 -0.794 . . . . 0.0 110.806 -179.677 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.636 ' HB2' ' HA ' ' A' ' 59' ' ' GLU . . . 68.12 -76.57 0.05 Allowed 'General case' 0 N--CA 1.503 2.221 0 O-C-N 121.135 -0.978 . . . . 0.0 109.993 -179.613 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -48.16 -50.62 28.21 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.315 -0.866 . . . . 0.0 111.227 -179.734 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -57.52 -40.09 77.97 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.596 -0.69 . . . . 0.0 109.528 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.736 HD21 ' CB ' ' A' ' 13' ' ' PRO . 49.3 mt -64.43 -44.26 91.74 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.757 -0.589 . . . . 0.0 110.242 179.904 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -66.3 -51.81 53.59 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.573 -0.705 . . . . 0.0 110.359 -179.538 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.483 ' SG ' HD13 ' A' ' 43' ' ' LEU . 48.1 t -66.77 -21.39 66.06 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.579 -0.7 . . . . 0.0 110.299 179.582 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.9 m -73.57 -20.63 60.57 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.383 -0.823 . . . . 0.0 111.728 -179.07 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -127.15 -14.28 5.48 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.017 -1.052 . . . . 0.0 112.972 -178.456 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -88.69 16.02 7.33 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 120.774 -1.204 . . . . 0.0 111.73 -178.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.531 ' HG2' HD11 ' A' ' 43' ' ' LEU . 33.2 mtp180 -92.16 -44.27 0.35 Allowed Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.197 -0.939 . . . . 0.0 112.543 179.615 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.572 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.1 Cg_endo -66.82 -15.15 46.4 Favored 'Trans proline' 0 N--CA 1.49 1.307 0 O-C-N 122.917 0.956 . . . . 0.0 110.382 -179.299 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.76 -54.28 8.42 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 177.531 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 38.2 mm -51.2 -26.02 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.985 0 O-C-N 121.89 -0.507 . . . . 0.0 110.738 179.381 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.572 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 6.8 mmmm -78.22 -31.71 49.46 Favored 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 119.84 -0.744 . . . . 0.0 110.014 -177.853 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 15.1 t -67.09 -21.96 65.84 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.563 -0.711 . . . . 0.0 110.525 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -119.54 -13.67 9.18 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.384 -0.822 . . . . 0.0 111.282 -179.705 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.766 ' HB3' HD23 ' A' ' 34' ' ' LEU . 38.1 m80 -130.63 94.75 28.38 Favored Pre-proline 0 N--CA 1.497 1.899 0 O-C-N 121.19 -0.944 . . . . 0.0 109.502 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -75.25 -35.45 2.96 Favored 'Trans proline' 0 C--N 1.316 -1.173 0 O-C-N 123.575 1.303 . . . . 0.0 110.061 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.15 -15.33 81.5 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 179.594 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.766 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.3 OUTLIER -56.62 87.78 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.327 -1.102 . . . . 0.0 110.887 -179.611 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 80.1 p -79.91 169.19 18.25 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.594 -0.691 . . . . 0.0 109.56 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 36.9 mm -50.01 -27.02 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.237 0 O-C-N 121.449 -0.782 . . . . 0.0 110.379 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.452 ' O ' ' HD3' ' A' ' 41' ' ' LYS . . . -58.95 -68.78 1.52 Allowed Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.135 -1.586 . . . . 0.0 109.135 179.554 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -78.09 -15.97 58.41 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.719 -0.871 . . . . 0.0 111.876 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.6 ' HA ' HD12 ' A' ' 34' ' ' LEU . 51.2 m -61.49 -40.88 96.18 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.023 -1.048 . . . . 0.0 109.277 179.545 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.58 -37.69 87.4 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.32 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.452 ' HD3' ' O ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -70.15 -31.72 69.35 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.789 -0.57 . . . . 0.0 110.133 -179.481 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.51 -11.75 60.55 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.26 -0.9 . . . . 0.0 110.515 179.683 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.531 HD11 ' HG2' ' A' ' 24' ' ' ARG . 77.2 mt -97.04 -27.87 14.41 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.301 -0.874 . . . . 0.0 110.172 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -89.63 -46.34 4.32 Favored Glycine 0 N--CA 1.493 2.472 0 N-CA-C 109.629 -1.389 . . . . 0.0 109.629 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -51.43 -31.9 24.62 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.388 -1.066 . . . . 0.0 110.825 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 75.7 mtp -87.77 -41.47 13.27 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.563 -0.711 . . . . 0.0 109.817 179.582 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -57.2 -22.2 38.99 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.609 -0.682 . . . . 0.0 110.804 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -94.04 -35.67 12.48 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.381 -0.825 . . . . 0.0 110.131 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -61.38 -34.23 74.98 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.524 -0.735 . . . . 0.0 109.968 179.808 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -58.04 150.2 21.52 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.572 -0.705 . . . . 0.0 110.507 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 17.1 t -89.43 -151.63 0.23 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.616 -0.678 . . . . 0.0 109.588 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -84.01 54.66 3.0 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.249 -0.907 . . . . 0.0 110.181 179.796 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.4 mttp -136.87 -41.59 0.6 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.473 -0.767 . . . . 0.0 110.435 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -62.31 -37.45 85.63 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.522 -0.736 . . . . 0.0 110.388 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -96.28 20.41 10.45 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.371 -0.83 . . . . 0.0 110.918 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.469 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 3.7 mt-30 -88.33 -59.03 0.26 Allowed Pre-proline 0 N--CA 1.496 1.867 0 O-C-N 121.165 -0.959 . . . . 0.0 109.759 179.571 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.469 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 57.3 Cg_endo -81.58 -23.89 4.63 Favored 'Trans proline' 0 C--N 1.32 -0.971 0 O-C-N 122.99 0.995 . . . . 0.0 110.353 179.013 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -81.56 -20.31 40.19 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.59 -0.694 . . . . 0.0 111.827 -178.332 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.636 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -82.37 -22.06 35.63 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.145 -0.972 . . . . 0.0 110.79 -179.564 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -84.02 -24.09 30.65 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.379 -0.825 . . . . 0.0 110.422 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -62.39 -47.29 84.78 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.44 -0.787 . . . . 0.0 109.778 179.782 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.643 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -74.53 -9.44 58.58 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.595 -0.691 . . . . 0.0 110.916 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.64 -0.61 55.58 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.3 -0.875 . . . . 0.0 110.283 179.015 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 47.7 mmtt -105.48 -29.18 10.37 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.21 -0.931 . . . . 0.0 109.943 179.461 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.2 mp -86.85 -14.23 42.66 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.963 -0.461 . . . . 0.0 110.031 178.753 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.8 tptt -76.3 -30.35 57.7 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.284 -0.885 . . . . 0.0 109.469 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -67.42 -59.72 3.16 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.651 -0.655 . . . . 0.0 109.484 179.542 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.9 mmpt? -60.25 -25.71 65.88 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.641 -0.662 . . . . 0.0 110.511 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.633 ' O ' HG22 ' A' ' 73' ' ' ILE . 21.4 t80 -71.5 -65.14 0.79 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.37 -0.831 . . . . 0.0 109.255 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -61.29 -17.5 53.86 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.836 -0.54 . . . . 0.0 111.082 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -98.62 -20.83 16.78 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.283 -0.885 . . . . 0.0 111.568 -179.098 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -106.36 -32.69 8.03 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.23 -0.919 . . . . 0.0 111.064 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.633 HG22 ' O ' ' A' ' 69' ' ' TYR . 8.4 tp -65.72 -30.58 50.54 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 O-C-N 121.419 -0.801 . . . . 0.0 110.372 -179.573 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.9 -58.24 8.69 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.611 -0.681 . . . . 0.0 109.964 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.37 -19.84 65.91 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.572 -0.705 . . . . 0.0 110.399 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -74.51 -38.78 62.73 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.372 -0.83 . . . . 0.0 110.125 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 8.9 mtt180 -71.42 -81.05 0.05 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.559 -0.713 . . . . 0.0 110.036 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -168.92 38.17 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.285 -0.884 . . . . 0.0 110.066 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.6 mtmm . . . . . 0 N--CA 1.494 1.772 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.196 -179.921 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 37.8 ttm . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 121.099 0.476 . . . . 0.0 110.187 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.9 mttm -133.11 26.61 4.22 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.578 -0.701 . . . . 0.0 110.397 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.4 tttt -65.02 -162.0 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.58 -0.7 . . . . 0.0 110.223 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.2 mtpt -144.72 -146.86 0.2 Allowed 'General case' 0 N--CA 1.485 1.283 0 O-C-N 121.626 -0.671 . . . . 0.0 109.239 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -92.33 163.22 27.61 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.088 -1.008 . . . . 0.0 110.208 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -73.06 -29.52 11.74 Favored 'Trans proline' 0 C--N 1.317 -1.13 0 O-C-N 123.452 1.238 . . . . 0.0 110.495 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 18.3 p-10 -101.81 29.34 5.02 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.606 -0.683 . . . . 0.0 110.275 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -100.11 134.78 20.62 Favored Pre-proline 0 N--CA 1.494 1.726 0 O-C-N 121.646 -0.659 . . . . 0.0 110.178 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -72.84 69.5 3.69 Favored 'Trans proline' 0 C--N 1.318 -1.042 0 O-C-N 123.209 1.11 . . . . 0.0 110.008 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 35.87 -156.49 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.324 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 178.596 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -108.43 153.92 41.78 Favored Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.583 -0.698 . . . . 0.0 109.483 179.429 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -73.15 113.96 3.91 Favored 'Trans proline' 0 C--N 1.316 -1.155 0 O-C-N 123.316 1.166 . . . . 0.0 110.803 -179.621 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.739 ' HB2' HD21 ' A' ' 18' ' ' LEU . 49.9 Cg_endo -82.98 173.18 10.34 Favored 'Trans proline' 0 C--N 1.318 -1.045 0 O-C-N 123.37 1.194 . . . . 0.0 110.122 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.513 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 42.2 t -165.4 63.33 0.12 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.492 -0.755 . . . . 0.0 110.616 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.513 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 66.64 -77.25 0.04 OUTLIER 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.114 -0.991 . . . . 0.0 110.361 -179.78 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -47.7 -49.49 27.66 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.302 -0.874 . . . . 0.0 111.401 -179.429 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -59.07 -35.86 74.08 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.616 -0.677 . . . . 0.0 109.945 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.739 HD21 ' HB2' ' A' ' 13' ' ' PRO . 23.0 mt -74.27 -32.62 62.99 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.624 -0.673 . . . . 0.0 110.323 -179.599 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.422 ' CE1' ' CZ ' ' A' ' 23' ' ' TYR . 68.1 t80 -79.65 -55.26 5.15 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.498 -0.751 . . . . 0.0 110.647 -179.363 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.9 t -57.15 -54.58 45.13 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.526 -0.734 . . . . 0.0 110.686 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.1 t -55.74 -22.49 24.13 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.438 -0.788 . . . . 0.0 110.982 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 41.1 mm-40 -100.93 -25.1 14.2 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.406 -0.809 . . . . 0.0 110.936 -179.53 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.435 ' O ' HD21 ' A' ' 43' ' ' LEU . 10.9 m-85 -96.71 12.43 31.94 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.395 -0.815 . . . . 0.0 111.522 -179.376 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.524 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 50.9 mtt180 -87.04 -45.02 0.53 Allowed Pre-proline 0 N--CA 1.489 1.482 0 O-C-N 121.226 -0.921 . . . . 0.0 112.164 179.538 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.591 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.1 Cg_endo -66.71 -15.67 48.11 Favored 'Trans proline' 0 N--CA 1.49 1.308 0 O-C-N 122.89 0.942 . . . . 0.0 110.484 -179.231 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -72.88 -50.19 25.32 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 177.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 28.0 mm -54.62 -32.96 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 CA-C-O 121.377 0.608 . . . . 0.0 110.288 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.591 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.0 mmmm -72.3 -36.59 68.98 Favored 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.3 -177.149 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.8 t -60.02 -25.76 65.56 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.551 -0.718 . . . . 0.0 110.661 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -115.35 -22.73 9.22 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.545 -0.722 . . . . 0.0 110.766 -179.638 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.756 ' HB3' HD23 ' A' ' 34' ' ' LEU . 39.2 m80 -121.41 96.07 48.01 Favored Pre-proline 0 N--CA 1.496 1.865 0 O-C-N 121.485 -0.76 . . . . 0.0 109.596 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -75.21 -31.17 6.16 Favored 'Trans proline' 0 C--N 1.315 -1.221 0 O-C-N 123.393 1.207 . . . . 0.0 110.344 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.409 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -80.38 -16.37 76.23 Favored Glycine 0 N--CA 1.489 2.193 0 N-CA-C 110.298 -1.121 . . . . 0.0 110.298 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.756 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -59.16 82.64 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.408 -1.054 . . . . 0.0 111.222 -179.356 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.409 ' N ' ' O ' ' A' ' 33' ' ' GLY . 71.8 m -69.55 172.43 7.34 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.479 -0.763 . . . . 0.0 109.701 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.556 ' H ' HD12 ' A' ' 36' ' ' ILE . 2.5 mp -56.15 -28.39 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.108 0 O-C-N 121.273 -0.892 . . . . 0.0 109.735 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.79 -65.34 3.39 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.235 -1.546 . . . . 0.0 109.235 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.591 ' HB3' HD13 ' A' ' 34' ' ' LEU . 7.9 t0 -70.02 -30.82 68.22 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.604 -0.939 . . . . 0.0 110.466 179.642 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.442 ' HB ' ' HA ' ' A' ' 36' ' ' ILE . 54.7 m -63.97 -30.66 71.72 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.494 -0.754 . . . . 0.0 109.96 179.669 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.78 -43.29 47.19 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.562 -0.711 . . . . 0.0 110.118 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.419 ' HG2' ' HA ' ' A' ' 38' ' ' ASP . 0.5 OUTLIER -87.72 -10.02 52.38 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.62 -0.675 . . . . 0.0 111.695 -179.525 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.42 -60.99 2.11 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.05 -1.031 . . . . 0.0 109.683 179.571 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.435 HD21 ' O ' ' A' ' 23' ' ' TYR . 21.8 mt -49.23 -25.66 2.43 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.518 -0.739 . . . . 0.0 111.378 -179.719 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -66.28 -36.89 92.34 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 109.365 -1.494 . . . . 0.0 109.365 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -51.92 -34.61 42.35 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.474 -1.015 . . . . 0.0 111.016 -179.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 7.6 mtt -85.14 -43.01 14.23 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.495 -0.753 . . . . 0.0 109.998 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' TRP . . . . . 0.444 ' CH2' ' HG2' ' A' ' 55' ' ' LYS . 64.4 t-105 -51.19 -36.69 42.58 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.528 -0.733 . . . . 0.0 111.174 -179.532 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 6.9 t -85.53 -27.8 25.34 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.438 -0.789 . . . . 0.0 110.117 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -58.63 -39.04 79.39 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.479 -0.763 . . . . 0.0 110.113 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.28 167.33 16.58 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.58 -0.7 . . . . 0.0 109.749 179.523 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.4 m -146.57 101.39 3.46 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.608 -0.683 . . . . 0.0 110.498 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 51.51 48.55 22.71 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.409 -0.807 . . . . 0.0 110.969 179.724 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 14.1 tttp -141.6 -65.57 0.42 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.553 -0.717 . . . . 0.0 110.236 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -64.48 -24.88 67.77 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.524 -0.735 . . . . 0.0 110.721 -179.708 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.444 ' HG2' ' CH2' ' A' ' 47' ' ' TRP . 39.9 mtpt -80.45 -35.14 35.34 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.476 -0.765 . . . . 0.0 110.759 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -46.4 -53.22 24.88 Favored Pre-proline 0 N--CA 1.505 2.303 0 O-C-N 121.51 -0.744 . . . . 0.0 112.021 -179.097 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -77.62 -39.98 0.47 Allowed 'Trans proline' 0 C--N 1.314 -1.257 0 O-C-N 123.171 1.09 . . . . 0.0 110.956 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -80.21 5.33 14.86 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.453 -0.779 . . . . 0.0 112.07 -178.404 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.32 -18.68 16.68 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.876 -1.14 . . . . 0.0 110.727 179.466 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -79.86 -28.12 40.02 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.261 -0.9 . . . . 0.0 110.224 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.4 ' CG ' HD13 ' A' ' 18' ' ' LEU . 45.6 tttm -60.25 -41.24 92.77 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.544 -0.722 . . . . 0.0 110.097 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.443 ' HB2' ' H ' ' A' ' 15' ' ' ALA . . . -69.05 -10.93 60.03 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.596 -0.69 . . . . 0.0 110.817 179.591 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -90.27 6.17 44.04 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.122 -0.986 . . . . 0.0 110.634 179.295 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -106.2 -36.94 6.73 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.254 -0.903 . . . . 0.0 109.028 178.792 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.739 HD22 ' HG3' ' A' ' 13' ' ' PRO . 6.8 mp -76.85 -0.08 22.75 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.912 -0.493 . . . . 0.0 111.07 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 19.1 tttm -91.3 -22.83 20.35 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.062 -1.024 . . . . 0.0 110.005 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -84.02 -16.16 44.94 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.475 -0.765 . . . . 0.0 110.522 179.55 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -102.2 -27.57 12.8 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.307 -0.871 . . . . 0.0 109.981 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.544 ' O ' HG22 ' A' ' 73' ' ' ILE . 17.0 t80 -78.05 -51.05 10.92 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.62 -0.675 . . . . 0.0 109.799 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -60.67 -15.53 29.68 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.783 -0.573 . . . . 0.0 111.419 -179.48 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -107.3 -30.47 8.7 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.092 -1.005 . . . . 0.0 110.056 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -86.14 -31.27 21.92 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.559 -0.713 . . . . 0.0 110.488 -179.731 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.544 HG22 ' O ' ' A' ' 69' ' ' TYR . 6.0 tp -66.36 -29.48 46.76 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.539 -0.725 . . . . 0.0 109.993 -179.905 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -50.63 -32.77 19.94 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.603 -0.686 . . . . 0.0 110.749 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -76.08 -8.0 56.0 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.609 -0.682 . . . . 0.0 110.568 179.282 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -105.77 -2.68 22.91 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.238 -0.914 . . . . 0.0 110.713 179.195 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 13.3 mtt180 -119.64 -29.02 5.16 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.31 -0.869 . . . . 0.0 110.771 -179.643 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 52.83 74.85 0.27 Allowed 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.206 -0.934 . . . . 0.0 110.724 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.791 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.293 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.9 ttp . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 121.121 0.486 . . . . 0.0 110.187 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.5 mttm -89.02 178.89 6.28 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.576 -0.703 . . . . 0.0 110.291 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt 52.79 94.55 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.494 -0.754 . . . . 0.0 110.784 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 46.2 mttm -60.02 -70.62 0.16 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.696 -0.627 . . . . 0.0 110.389 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.527 ' HB2' ' HB3' ' A' ' 8' ' ' ALA . 4.3 m-20 -118.24 165.98 14.94 Favored Pre-proline 0 N--CA 1.494 1.736 0 O-C-N 121.62 -0.675 . . . . 0.0 110.354 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.52 -20.79 23.21 Favored 'Trans proline' 0 C--N 1.317 -1.116 0 O-C-N 123.426 1.224 . . . . 0.0 110.809 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -105.6 -24.64 12.53 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.399 -0.813 . . . . 0.0 110.322 179.824 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.604 ' HB2' ' CZ ' ' A' ' 76' ' ' TYR . . . -81.08 141.63 50.61 Favored Pre-proline 0 N--CA 1.493 1.721 0 O-C-N 121.517 -0.739 . . . . 0.0 110.114 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -74.24 138.24 24.75 Favored 'Trans proline' 0 C--N 1.317 -1.108 0 O-C-N 123.299 1.157 . . . . 0.0 110.27 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.31 -165.98 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.522 -0.736 . . . . 0.0 109.993 179.823 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -70.57 145.8 93.08 Favored Pre-proline 0 N--CA 1.496 1.874 0 O-C-N 121.429 -0.795 . . . . 0.0 110.207 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.438 ' HD3' ' CZ ' ' A' ' 69' ' ' TYR . 47.8 Cg_endo -76.25 128.85 10.8 Favored 'Trans proline' 0 C--N 1.318 -1.04 0 O-C-N 123.342 1.18 . . . . 0.0 109.993 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.589 ' CB ' HD21 ' A' ' 18' ' ' LEU . 49.1 Cg_endo -81.65 -175.82 2.77 Favored 'Trans proline' 0 C--N 1.318 -1.048 0 O-C-N 123.24 1.126 . . . . 0.0 110.181 -179.842 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.558 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 33.6 t -168.74 56.77 0.05 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.53 -0.731 . . . . 0.0 110.628 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.558 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 70.32 -76.92 0.06 Allowed 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.15 -0.969 . . . . 0.0 110.198 -179.515 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -49.19 -49.81 40.98 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.228 -0.92 . . . . 0.0 111.058 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -57.88 -37.72 74.47 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.604 -0.685 . . . . 0.0 109.457 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.773 HD11 ' HB2' ' A' ' 62' ' ' ALA . 56.3 mt -67.06 -45.48 77.24 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.725 -0.609 . . . . 0.0 109.992 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.405 ' HB2' ' CZ3' ' A' ' 47' ' ' TRP . 46.4 t80 -63.58 -50.17 70.5 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.541 -0.724 . . . . 0.0 109.728 179.826 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.9 t -62.87 -29.38 70.71 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 120.05 -0.66 . . . . 0.0 109.597 179.309 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.404 ' HG ' ' HA ' ' A' ' 18' ' ' LEU . 65.4 p -95.26 14.74 21.29 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.627 -0.671 . . . . 0.0 111.034 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -139.51 -5.02 1.41 Allowed 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.137 -0.977 . . . . 0.0 111.965 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -121.19 -29.22 4.56 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.902 -1.124 . . . . 0.0 110.895 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.746 ' HG2' HD11 ' A' ' 43' ' ' LEU . 5.9 mtt180 -47.64 -53.28 31.75 Favored Pre-proline 0 N--CA 1.498 1.944 0 O-C-N 121.284 -0.885 . . . . 0.0 112.491 -179.506 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.533 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 35.3 Cg_endo -58.61 -27.74 83.79 Favored 'Trans proline' 0 N--CA 1.495 1.611 0 O-C-N 123.188 1.099 . . . . 0.0 110.202 -179.594 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -69.23 -45.73 69.11 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 177.505 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.9 mm -60.4 -17.46 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.847 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.533 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 8.2 mmmm -86.89 -27.37 23.46 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.078 -1.014 . . . . 0.0 110.39 -177.931 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 6.6 t -70.11 -14.32 62.6 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.425 -0.797 . . . . 0.0 110.992 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -133.26 2.47 3.57 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.14 -0.975 . . . . 0.0 111.784 -179.551 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.634 ' HB3' HD23 ' A' ' 34' ' ' LEU . 31.5 m80 -142.39 93.46 7.1 Favored Pre-proline 0 N--CA 1.498 1.927 0 O-C-N 121.073 -1.017 . . . . 0.0 109.298 179.029 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -75.0 -33.98 4.18 Favored 'Trans proline' 0 C--N 1.315 -1.204 0 O-C-N 123.52 1.274 . . . . 0.0 110.29 -179.539 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.407 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -72.48 -30.93 63.73 Favored Glycine 0 N--CA 1.487 2.076 0 N-CA-C 109.304 -1.518 . . . . 0.0 109.304 179.686 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.634 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.3 OUTLIER -46.01 90.65 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.76 -0.847 . . . . 0.0 111.925 -179.487 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.407 ' N ' ' O ' ' A' ' 33' ' ' GLY . 22.8 t -88.72 170.94 10.35 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.558 -0.714 . . . . 0.0 109.596 179.728 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.618 ' H ' HD12 ' A' ' 36' ' ' ILE . 3.2 mp -53.12 -24.63 8.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.073 0 O-C-N 121.372 -0.83 . . . . 0.0 110.26 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.3 -66.4 2.62 Favored Glycine 0 N--CA 1.493 2.467 0 N-CA-C 108.958 -1.657 . . . . 0.0 108.958 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.45 ' HA ' ' HG2' ' A' ' 41' ' ' LYS . 6.1 t70 -75.16 -28.29 60.04 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.755 -0.85 . . . . 0.0 110.216 179.486 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.559 ' O ' HD12 ' A' ' 43' ' ' LEU . 88.3 m -68.87 -28.51 66.78 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.573 -0.704 . . . . 0.0 110.347 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -79.6 -25.37 41.51 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.453 -0.78 . . . . 0.0 109.975 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.45 ' HG2' ' HA ' ' A' ' 38' ' ' ASP . 3.3 ptpt -105.17 -11.94 16.33 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.617 -0.677 . . . . 0.0 111.014 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 9.4 tptt -84.77 -10.76 56.9 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.026 -1.046 . . . . 0.0 110.483 179.355 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.746 HD11 ' HG2' ' A' ' 24' ' ' ARG . 28.8 mt -90.16 -31.99 16.83 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.331 -0.856 . . . . 0.0 109.294 179.096 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.53 -32.3 71.3 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 108.717 -1.753 . . . . 0.0 108.717 179.119 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -55.96 -40.05 72.67 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.62 -0.929 . . . . 0.0 110.576 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 9.2 mmt -78.73 -46.09 19.74 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.568 -0.708 . . . . 0.0 110.209 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' TRP . . . . . 0.551 ' CZ2' ' HB1' ' A' ' 15' ' ' ALA . 67.1 t-105 -59.95 -17.3 36.89 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.543 -0.723 . . . . 0.0 111.245 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.6 t -103.48 -37.72 7.47 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.226 -0.921 . . . . 0.0 111.575 -179.095 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -75.12 -32.89 61.51 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.284 -0.885 . . . . 0.0 111.745 -178.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.401 ' CB ' ' HB2' ' A' ' 54' ' ' ASP . 13.5 mm-40 -59.27 156.78 11.86 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.21 -0.931 . . . . 0.0 110.919 -179.031 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 77.2 p -77.87 -137.8 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 179.161 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -90.5 36.1 0.89 Allowed 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.854 -1.154 . . . . 0.0 110.795 179.78 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 11.6 mptt -116.11 -35.56 4.35 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.359 -0.838 . . . . 0.0 109.67 179.483 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.401 ' HB2' ' CB ' ' A' ' 50' ' ' GLN . 1.3 t70 -92.92 53.66 2.04 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 108.485 -0.932 . . . . 0.0 108.485 178.399 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.433 ' HG2' ' CE2' ' A' ' 47' ' ' TRP . 0.0 OUTLIER -173.01 -65.18 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 179.696 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.406 ' CB ' ' CD ' ' A' ' 57' ' ' PRO . 2.2 mp0 -40.2 -58.05 2.53 Favored Pre-proline 0 N--CA 1.506 2.346 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -179.253 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.406 ' CD ' ' CB ' ' A' ' 56' ' ' GLN . 42.4 Cg_endo -67.37 -32.38 32.6 Favored 'Trans proline' 0 N--CA 1.488 1.16 0 O-C-N 123.072 1.038 . . . . 0.0 110.833 -179.285 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.53 ' O ' HD12 ' A' ' 18' ' ' LEU . 13.6 m-85 -82.99 -14.18 54.53 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.5 -0.75 . . . . 0.0 110.69 179.578 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.437 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 29.0 mm-40 -77.9 -64.03 1.25 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.348 -0.845 . . . . 0.0 110.132 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -53.05 -23.52 7.84 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.548 -0.72 . . . . 0.0 111.366 -179.486 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 66.4 tttt -63.08 -48.73 77.37 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.465 -0.772 . . . . 0.0 110.13 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.773 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -78.05 -16.31 58.16 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.559 -0.713 . . . . 0.0 110.176 179.187 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.7 -35.08 77.0 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.428 -0.795 . . . . 0.0 110.454 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 67.5 mmtt -74.58 -63.41 1.25 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.322 -0.861 . . . . 0.0 110.102 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.459 ' H ' HD12 ' A' ' 65' ' ' LEU . 4.0 mp -45.59 -26.59 0.62 Allowed 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.599 -0.688 . . . . 0.0 111.882 -179.406 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 32.4 tptt -65.68 -45.08 84.21 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.324 -0.86 . . . . 0.0 109.507 179.175 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -66.17 -55.16 17.73 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.665 -0.647 . . . . 0.0 110.121 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -55.0 -31.49 61.06 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.466 -0.771 . . . . 0.0 110.485 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.545 ' O ' HG22 ' A' ' 73' ' ' ILE . 76.5 t80 -75.92 -68.64 0.56 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.538 -0.726 . . . . 0.0 109.674 179.621 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -48.73 -28.45 3.62 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.687 -0.633 . . . . 0.0 111.284 -179.612 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.2 mmmt -86.22 -57.72 2.91 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.6 -0.687 . . . . 0.0 110.545 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -62.88 -30.92 71.9 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.504 -0.747 . . . . 0.0 110.968 -179.371 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.545 HG22 ' O ' ' A' ' 69' ' ' TYR . 2.7 tp -72.12 -35.6 53.88 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 O-C-N 121.419 -0.8 . . . . 0.0 110.496 -179.475 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.6 -42.52 78.89 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.441 -0.787 . . . . 0.0 110.493 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.33 -11.52 54.45 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.631 -0.668 . . . . 0.0 110.821 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.604 ' CZ ' ' HB2' ' A' ' 8' ' ' ALA . 71.5 t80 -79.35 -26.34 42.12 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.241 -0.912 . . . . 0.0 110.426 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 50.1 mtt180 -101.79 2.35 38.26 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.531 -0.731 . . . . 0.0 111.282 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 51.8 95.61 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.95 -1.094 . . . . 0.0 111.01 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.7 ptmt . . . . . 0 N--CA 1.493 1.723 0 CA-C-O 118.028 -0.986 . . . . 0.0 110.354 179.889 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.7 ttt . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.01 0.433 . . . . 0.0 110.188 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 3.1 mttm -106.87 94.99 5.41 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.62 -0.675 . . . . 0.0 110.222 179.918 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 71.1 tttt -170.19 132.68 1.07 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.456 -0.778 . . . . 0.0 110.247 179.926 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 38.6 mtpt -60.08 -72.28 0.11 Allowed 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.557 -0.714 . . . . 0.0 110.352 -179.96 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -163.91 157.47 15.96 Favored Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.59 -0.693 . . . . 0.0 110.34 -179.913 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -73.2 -37.87 3.1 Favored 'Trans proline' 0 C--N 1.317 -1.095 0 O-C-N 123.432 1.228 . . . . 0.0 110.444 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -79.21 -20.59 47.93 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.591 -0.693 . . . . 0.0 110.817 -179.491 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -99.38 135.26 20.74 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.379 -0.826 . . . . 0.0 109.729 179.521 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -72.05 108.59 2.5 Favored 'Trans proline' 0 C--N 1.319 -1.001 0 O-C-N 123.144 1.076 . . . . 0.0 110.561 -179.69 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -166.2 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.484 -0.76 . . . . 0.0 110.018 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.72 141.24 92.69 Favored Pre-proline 0 N--CA 1.497 1.913 0 O-C-N 121.509 -0.745 . . . . 0.0 109.938 179.943 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -74.37 132.56 16.46 Favored 'Trans proline' 0 C--N 1.317 -1.099 0 O-C-N 123.309 1.163 . . . . 0.0 109.972 179.786 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.473 ' CB ' HD21 ' A' ' 18' ' ' LEU . 49.5 Cg_endo -81.12 -173.15 1.72 Allowed 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.184 1.097 . . . . 0.0 110.004 -179.737 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.555 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 31.1 t -167.98 59.41 0.07 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.41 -0.806 . . . . 0.0 110.549 -179.898 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.555 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 69.43 -75.76 0.07 Allowed 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.256 -0.902 . . . . 0.0 110.303 -179.527 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -47.3 -52.53 16.05 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.323 -0.861 . . . . 0.0 111.439 -179.388 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -58.1 -39.98 80.01 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.578 -0.701 . . . . 0.0 109.656 179.666 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.477 HD11 ' HB2' ' A' ' 62' ' ' ALA . 51.4 mt -62.32 -45.41 93.33 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.646 -0.659 . . . . 0.0 109.84 179.833 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.497 ' CZ ' ' CE2' ' A' ' 23' ' ' TYR . 43.0 t80 -68.48 -51.62 41.39 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.757 -0.59 . . . . 0.0 110.421 -179.649 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.6 m -56.4 -54.98 39.21 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.523 -0.735 . . . . 0.0 110.813 -179.613 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 88.7 p -57.42 -30.09 64.68 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.466 -0.771 . . . . 0.0 110.856 -179.666 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 -89.95 -23.55 21.52 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.475 -0.766 . . . . 0.0 111.302 -179.29 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.497 ' CE2' ' CZ ' ' A' ' 19' ' ' PHE . 9.0 m-85 -96.02 -34.25 11.83 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.352 -0.842 . . . . 0.0 110.927 -179.423 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.518 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 29.8 mtt-85 -48.28 -53.02 37.72 Favored Pre-proline 0 N--CA 1.498 1.959 0 O-C-N 121.376 -0.828 . . . . 0.0 112.109 -179.881 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.587 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.1 Cg_endo -59.38 -28.61 88.03 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 O-C-N 123.218 1.115 . . . . 0.0 110.155 179.968 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.0 tmtt? -68.89 -45.2 71.54 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 177.918 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 47.4 mm -58.93 -27.4 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.233 179.755 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.587 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.6 mmmm -75.66 -35.23 60.46 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 119.789 -0.765 . . . . 0.0 110.214 -177.53 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 13.4 t -64.94 -21.39 66.82 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.444 -0.785 . . . . 0.0 110.591 179.932 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -121.42 -10.36 8.89 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.307 -0.871 . . . . 0.0 111.415 -179.56 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.716 ' HB3' HD23 ' A' ' 34' ' ' LEU . 41.4 m80 -134.36 94.2 17.98 Favored Pre-proline 0 N--CA 1.497 1.911 0 O-C-N 121.227 -0.92 . . . . 0.0 109.449 179.175 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -74.95 -32.63 5.29 Favored 'Trans proline' 0 C--N 1.315 -1.198 0 O-C-N 123.531 1.28 . . . . 0.0 110.193 -179.679 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.411 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -76.36 -23.11 71.69 Favored Glycine 0 N--CA 1.488 2.118 0 N-CA-C 109.767 -1.333 . . . . 0.0 109.767 179.674 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.716 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.6 OUTLIER -54.78 86.01 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.696 -0.885 . . . . 0.0 111.37 -179.548 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.411 ' N ' ' O ' ' A' ' 33' ' ' GLY . 75.7 m -77.6 172.09 13.92 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.466 -0.771 . . . . 0.0 109.523 179.573 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.2 mm -52.74 -30.02 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.133 0 O-C-N 121.31 -0.868 . . . . 0.0 110.322 -179.934 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.98 -66.64 2.55 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.197 -1.561 . . . . 0.0 109.197 179.7 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.409 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 1.2 m-20 -69.87 -31.41 69.22 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.622 -0.928 . . . . 0.0 110.381 179.639 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 91.1 m -65.26 -31.35 72.46 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.403 -0.81 . . . . 0.0 110.0 179.514 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.89 -42.63 48.55 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.551 -0.718 . . . . 0.0 110.303 179.973 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.4 ' HG2' ' HA ' ' A' ' 38' ' ' ASP . 0.6 OUTLIER -88.2 -12.58 43.41 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.522 -0.736 . . . . 0.0 111.853 -179.284 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.409 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 9.7 tptt -77.73 -58.86 3.04 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 120.941 -1.099 . . . . 0.0 109.869 179.694 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.414 HD22 ' HB3' ' A' ' 23' ' ' TYR . 39.9 mt -48.11 -28.27 2.81 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 121.528 -0.732 . . . . 0.0 111.184 -179.579 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -64.56 -37.58 94.59 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.236 -1.545 . . . . 0.0 109.236 179.6 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -49.42 -34.98 17.81 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.551 -0.97 . . . . 0.0 111.225 -179.639 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 7.9 mmt -89.63 -36.64 15.16 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.578 -0.701 . . . . 0.0 110.112 179.763 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 47' ' ' TRP . . . . . 0.439 ' CZ2' ' HG2' ' A' ' 55' ' ' LYS . 73.6 t-105 -65.27 -12.29 50.06 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.603 -0.686 . . . . 0.0 111.254 -179.596 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 27.8 t -99.94 -42.7 6.67 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.109 -0.994 . . . . 0.0 110.781 -179.684 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -66.13 -29.21 69.47 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.441 -0.787 . . . . 0.0 110.493 -179.696 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -58.37 150.36 22.39 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.506 -0.746 . . . . 0.0 110.309 179.902 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.4 t -94.13 -154.08 0.4 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.612 -0.68 . . . . 0.0 109.684 179.75 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -86.19 52.32 2.46 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.361 -0.837 . . . . 0.0 110.028 179.624 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 22.4 mttp -127.63 -46.89 1.42 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.544 -0.722 . . . . 0.0 110.302 -179.855 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -67.97 -31.32 70.96 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.577 -0.702 . . . . 0.0 111.214 -179.203 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.439 ' HG2' ' CZ2' ' A' ' 47' ' ' TRP . 34.3 mtpt -80.43 -37.64 31.65 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.344 -0.847 . . . . 0.0 111.127 -179.198 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -43.46 -56.12 7.37 Favored Pre-proline 0 N--CA 1.509 2.476 0 O-C-N 121.451 -0.781 . . . . 0.0 112.7 -178.443 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -76.2 -35.92 2.12 Favored 'Trans proline' 0 C--N 1.315 -1.203 0 O-C-N 123.049 1.026 . . . . 0.0 111.417 -179.35 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -82.04 -8.85 59.69 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.39 -0.819 . . . . 0.0 112.132 -178.314 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.07 -23.76 22.46 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.021 -1.049 . . . . 0.0 111.201 -179.193 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -78.98 -20.79 48.27 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.376 -0.828 . . . . 0.0 110.804 -179.823 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 22.1 tttp -60.43 -50.04 75.18 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.365 -0.834 . . . . 0.0 110.301 179.997 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.477 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -77.48 -10.84 59.71 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 119.839 -0.744 . . . . 0.0 110.429 179.493 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.9 -25.73 67.29 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.286 -0.884 . . . . 0.0 109.469 179.277 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -79.57 -64.8 1.1 Allowed 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.835 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.54 ' H ' HD12 ' A' ' 65' ' ' LEU . 2.8 mp -42.07 -20.52 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.279 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 -178.914 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 57.2 tttt -70.39 -32.83 70.64 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.646 -1.284 . . . . 0.0 109.067 178.491 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -85.99 -5.3 59.25 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.703 -0.623 . . . . 0.0 110.751 179.451 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.2 tptt -102.4 -37.77 7.89 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.251 -0.906 . . . . 0.0 108.952 179.234 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.628 ' CZ ' HD13 ' A' ' 73' ' ' ILE . 19.0 t80 -75.7 -56.58 4.55 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 179.149 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -57.22 -20.28 26.21 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.839 -0.538 . . . . 0.0 111.236 -179.674 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.0 mttt -98.9 -23.64 15.26 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.226 -0.921 . . . . 0.0 111.07 -179.379 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -103.3 -31.35 10.1 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.428 -0.795 . . . . 0.0 111.125 -179.216 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.628 HD13 ' CZ ' ' A' ' 69' ' ' TYR . 2.5 tp -66.96 -33.57 64.29 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 O-C-N 121.43 -0.794 . . . . 0.0 110.539 -179.422 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -55.78 -42.91 76.26 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.533 -0.729 . . . . 0.0 110.584 -179.784 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -89.73 -20.46 23.55 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.589 -0.694 . . . . 0.0 110.476 179.726 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 59.0 t80 -75.34 -30.89 60.4 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.38 -0.825 . . . . 0.0 110.352 -179.853 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 27.9 mtp180 -78.65 -83.4 0.09 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.614 -0.679 . . . . 0.0 110.32 -179.846 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -136.98 -143.1 0.17 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.252 -0.905 . . . . 0.0 109.701 -179.751 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 16.6 mtmt . . . . . 0 N--CA 1.502 2.155 0 O-C-N 120.981 -1.074 . . . . 0.0 110.793 179.823 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.2 0.524 . . . . 0.0 110.243 . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 52.82 69.78 0.65 Allowed 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.393 -0.817 . . . . 0.0 110.814 179.997 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 9.0 ttpt -170.85 -158.07 0.14 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.505 -0.747 . . . . 0.0 109.953 179.935 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 8.8 mtpt -155.64 -164.16 1.67 Allowed 'General case' 0 N--CA 1.485 1.277 0 O-C-N 121.611 -0.68 . . . . 0.0 109.64 179.838 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.68 145.65 98.2 Favored Pre-proline 0 N--CA 1.494 1.728 0 O-C-N 121.664 -0.647 . . . . 0.0 110.275 -179.992 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -73.93 -19.08 21.05 Favored 'Trans proline' 0 C--N 1.317 -1.128 0 O-C-N 123.376 1.198 . . . . 0.0 110.903 179.877 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -83.9 -26.81 29.07 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.329 -0.857 . . . . 0.0 110.477 -179.725 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -92.36 154.99 42.85 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.473 -0.767 . . . . 0.0 110.352 -179.825 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.429 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 48.0 Cg_endo -73.66 133.85 19.36 Favored 'Trans proline' 0 C--N 1.317 -1.111 0 O-C-N 123.425 1.224 . . . . 0.0 110.521 -179.94 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.4 pttm -144.18 31.37 1.24 Allowed 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.646 -0.659 . . . . 0.0 110.451 -179.966 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 43.1 mtt180 -147.17 68.78 11.49 Favored Pre-proline 0 N--CA 1.493 1.711 0 C-N-CA 120.444 -0.502 . . . . 0.0 110.183 -179.807 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -77.31 123.6 6.69 Favored 'Trans proline' 0 C--N 1.316 -1.149 0 O-C-N 123.264 1.139 . . . . 0.0 110.452 -179.932 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.766 ' HG3' HD22 ' A' ' 65' ' ' LEU . 48.2 Cg_endo -81.52 176.44 8.58 Favored 'Trans proline' 0 C--N 1.318 -1.053 0 O-C-N 123.26 1.137 . . . . 0.0 109.835 179.793 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.539 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 52.4 p -167.48 56.54 0.07 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.379 -0.826 . . . . 0.0 111.043 -179.753 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.539 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 68.94 -79.81 0.04 OUTLIER 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.143 -0.973 . . . . 0.0 110.807 -179.905 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -47.36 -51.04 20.77 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.117 -0.989 . . . . 0.0 111.412 -179.33 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -54.97 -27.73 46.14 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.523 -0.735 . . . . 0.0 110.28 179.743 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.68 HD11 ' HB2' ' A' ' 62' ' ' ALA . 21.3 mt -85.17 -24.63 27.84 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.523 -0.735 . . . . 0.0 110.386 -179.925 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.496 ' CE1' ' CE1' ' A' ' 23' ' ' TYR . 80.5 t80 -81.27 -57.45 3.49 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.469 -0.769 . . . . 0.0 110.756 -179.267 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.7 t -60.18 -48.8 80.19 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.502 -0.749 . . . . 0.0 110.403 -179.717 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 30.7 t -57.43 -21.5 37.13 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.636 -0.665 . . . . 0.0 110.881 -179.768 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -107.67 -13.61 15.0 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.35 -0.843 . . . . 0.0 111.442 -179.489 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.507 ' HB3' HD22 ' A' ' 43' ' ' LEU . 2.6 m-85 -94.69 -37.76 11.14 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.173 -0.955 . . . . 0.0 110.602 -179.592 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.527 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 5.9 mtt180 -46.88 -51.77 37.04 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.437 -0.789 . . . . 0.0 112.265 -179.625 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.539 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.5 Cg_endo -60.2 -26.52 82.77 Favored 'Trans proline' 0 N--CA 1.493 1.486 0 O-C-N 123.24 1.126 . . . . 0.0 110.089 179.779 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.0 tmtt? -69.65 -47.37 63.57 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 177.494 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.665 HG13 HD21 ' A' ' 43' ' ' LEU . 46.4 mm -57.97 -18.67 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.607 179.543 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.539 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 7.1 mmmm -85.24 -28.58 25.29 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.189 -0.944 . . . . 0.0 110.293 -177.843 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.1 t -68.55 -18.74 64.41 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.507 -0.745 . . . . 0.0 110.846 -179.979 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -127.59 -1.59 6.14 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.313 -0.867 . . . . 0.0 111.611 -179.598 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.679 ' HB3' HD23 ' A' ' 34' ' ' LEU . 26.7 m80 -140.71 93.58 8.49 Favored Pre-proline 0 N--CA 1.497 1.925 0 O-C-N 121.135 -0.978 . . . . 0.0 109.057 179.035 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -74.68 -37.32 2.32 Favored 'Trans proline' 0 C--N 1.316 -1.155 0 O-C-N 123.511 1.269 . . . . 0.0 110.384 -179.467 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.68 -26.73 73.56 Favored Glycine 0 N--CA 1.488 2.159 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 179.571 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.679 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.3 OUTLIER -48.2 90.87 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.616 -0.932 . . . . 0.0 111.704 -179.501 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.1 p -76.71 -179.67 5.49 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.533 -0.729 . . . . 0.0 109.475 179.595 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.487 ' N ' HD12 ' A' ' 36' ' ' ILE . 2.0 mp -60.54 -33.91 56.29 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 O-C-N 121.37 -0.831 . . . . 0.0 109.297 179.822 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.09 -54.61 36.6 Favored Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.024 -1.631 . . . . 0.0 109.024 179.483 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.6 ' CB ' HD13 ' A' ' 34' ' ' LEU . 23.8 m-20 -73.39 -36.9 66.1 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.763 -0.845 . . . . 0.0 110.031 179.017 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.481 ' O ' HD12 ' A' ' 43' ' ' LEU . 87.9 m -65.3 -25.13 67.49 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.238 -0.914 . . . . 0.0 110.263 179.265 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -84.43 -33.02 23.79 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.418 -0.802 . . . . 0.0 110.328 -179.942 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.429 ' HG2' ' HA ' ' A' ' 38' ' ' ASP . 3.0 ptpt -100.06 -14.7 18.5 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.442 -0.786 . . . . 0.0 111.79 -179.179 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -85.06 -5.21 59.35 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.921 -1.112 . . . . 0.0 110.547 179.338 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.665 HD21 HG13 ' A' ' 27' ' ' ILE . 86.4 mt -96.83 -38.74 9.74 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.283 -0.886 . . . . 0.0 109.237 179.337 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -59.22 -32.76 72.59 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 109.863 -1.295 . . . . 0.0 109.863 -179.943 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -55.36 -37.22 67.21 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.513 -0.992 . . . . 0.0 110.419 -179.992 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 14.3 mtt -76.14 -44.42 38.47 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.621 -0.674 . . . . 0.0 109.598 179.408 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 70.7 t-105 -54.64 -22.69 14.34 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.621 -0.674 . . . . 0.0 110.897 -179.955 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.1 t -88.82 -31.49 18.3 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.282 -0.886 . . . . 0.0 110.117 179.94 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -90.88 -4.8 56.27 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.533 -0.73 . . . . 0.0 110.995 179.674 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.414 ' HB2' ' CB ' ' A' ' 54' ' ' ASP . 4.4 pp0? -59.03 -167.35 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.217 -0.927 . . . . 0.0 110.621 179.928 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.2 t -156.75 -147.07 0.18 Allowed 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 179.897 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.88 -3.82 31.2 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.135 -0.978 . . . . 0.0 111.035 179.684 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.4 mtmt -90.89 -38.78 12.69 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.92 -1.113 . . . . 0.0 110.901 -179.524 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.414 ' CB ' ' HB2' ' A' ' 50' ' ' GLN . 0.8 OUTLIER -87.91 49.87 1.88 Allowed 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.339 -0.851 . . . . 0.0 110.777 -179.366 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.417 ' O ' ' N ' ' A' ' 59' ' ' GLU . 17.6 mtmt -159.82 -59.81 0.06 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.581 -0.699 . . . . 0.0 109.697 178.673 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.407 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 5.0 mm100 -41.15 -52.29 7.29 Favored Pre-proline 0 N--CA 1.506 2.352 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -179.097 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.407 ' HD2' ' N ' ' A' ' 56' ' ' GLN . 52.8 Cg_endo -75.29 -36.03 2.61 Favored 'Trans proline' 0 N--CA 1.489 1.213 0 O-C-N 123.129 1.068 . . . . 0.0 112.182 -179.208 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.409 ' O ' HD12 ' A' ' 18' ' ' LEU . 8.0 m-85 -87.68 -17.85 30.87 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 121.221 -0.925 . . . . 0.0 111.848 -178.611 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.417 ' N ' ' O ' ' A' ' 55' ' ' LYS . 0.2 OUTLIER -85.35 -30.9 23.3 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.25 -0.907 . . . . 0.0 110.018 -179.417 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.412 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 5.7 pt20 -77.71 -24.74 49.11 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.748 -0.595 . . . . 0.0 110.159 179.494 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 73.1 tttt -62.91 -43.1 99.71 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.46 -0.775 . . . . 0.0 109.858 179.728 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.68 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -78.94 -16.38 57.04 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.515 -0.741 . . . . 0.0 109.943 178.987 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.412 ' HB3' ' O ' ' A' ' 60' ' ' GLN . . . -58.25 -42.75 87.08 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.404 -0.81 . . . . 0.0 110.449 179.954 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -70.08 -62.27 1.45 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.306 -0.871 . . . . 0.0 110.055 -179.989 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.766 HD22 ' HG3' ' A' ' 13' ' ' PRO . 4.3 mp -45.69 -27.15 0.75 Allowed 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.688 -0.632 . . . . 0.0 111.815 -179.419 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.1 tptt -64.25 -51.85 61.56 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.42 -0.8 . . . . 0.0 109.421 179.142 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -60.82 -52.0 66.94 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.647 -0.658 . . . . 0.0 109.846 179.499 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 69.5 mttt -56.19 -26.11 49.5 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.527 -0.733 . . . . 0.0 110.536 179.926 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.495 ' O ' HG22 ' A' ' 73' ' ' ILE . 32.8 t80 -81.92 -63.37 1.4 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.396 -0.815 . . . . 0.0 109.538 179.468 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.435 ' C ' HG22 ' A' ' 73' ' ' ILE . 9.6 mt-10 -55.21 -23.87 24.36 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.475 -0.766 . . . . 0.0 110.682 179.718 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 25.3 ttmt -89.42 -59.86 2.1 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.452 -0.78 . . . . 0.0 110.426 -179.924 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -56.28 -23.09 34.29 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.529 -0.732 . . . . 0.0 111.084 -179.403 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.495 HG22 ' O ' ' A' ' 69' ' ' TYR . 7.1 tp -78.15 -32.05 16.86 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 121.342 -0.849 . . . . 0.0 109.88 179.764 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -51.9 -30.66 25.13 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.453 -0.78 . . . . 0.0 110.514 -179.86 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -83.1 -2.58 55.77 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.65 -0.656 . . . . 0.0 110.594 179.098 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.406 ' O ' ' CG ' ' A' ' 76' ' ' TYR . 83.5 t80 -106.1 20.85 18.3 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.153 -0.967 . . . . 0.0 109.963 178.858 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 40.9 mtp85 -130.5 -32.76 1.71 Allowed 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.331 -0.855 . . . . 0.0 111.301 -179.169 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 53.06 75.39 0.25 Allowed 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.187 -0.946 . . . . 0.0 110.777 -179.935 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 8.9 tttt . . . . . 0 N--CA 1.494 1.753 0 CA-C-O 118.035 -0.984 . . . . 0.0 110.196 -179.918 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 121.167 0.508 . . . . 0.0 110.116 . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.96 150.47 23.43 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.555 -0.715 . . . . 0.0 110.154 179.842 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.1 tttp 53.78 -172.09 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.459 -0.775 . . . . 0.0 110.611 -179.952 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.7 mttt -166.19 -75.83 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.626 -0.671 . . . . 0.0 110.135 179.791 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -168.28 167.21 6.61 Favored Pre-proline 0 N--CA 1.494 1.744 0 O-C-N 121.437 -0.789 . . . . 0.0 110.313 -179.939 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -72.92 -39.95 2.07 Favored 'Trans proline' 0 C--N 1.317 -1.124 0 O-C-N 123.501 1.263 . . . . 0.0 110.319 179.883 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -78.88 -14.23 59.35 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.618 -0.676 . . . . 0.0 110.996 -179.305 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -96.77 130.99 28.88 Favored Pre-proline 0 N--CA 1.493 1.724 0 O-C-N 121.238 -0.914 . . . . 0.0 109.595 179.349 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -72.47 105.49 1.89 Allowed 'Trans proline' 0 C--N 1.319 -1.005 0 O-C-N 123.161 1.085 . . . . 0.0 110.286 -179.715 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.53 -164.78 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.631 -0.668 . . . . 0.0 110.438 -179.779 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.4 mpt_? -60.6 142.27 91.5 Favored Pre-proline 0 N--CA 1.496 1.854 0 O-C-N 121.618 -0.677 . . . . 0.0 110.124 -179.989 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -75.13 131.55 14.28 Favored 'Trans proline' 0 C--N 1.318 -1.076 0 O-C-N 123.324 1.171 . . . . 0.0 110.053 179.876 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.626 ' CB ' HD21 ' A' ' 18' ' ' LEU . 48.7 Cg_endo -81.72 -177.08 3.36 Favored 'Trans proline' 0 C--N 1.318 -1.075 0 O-C-N 123.195 1.103 . . . . 0.0 110.21 -179.815 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.534 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 24.7 t -166.31 65.2 0.1 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.513 -0.742 . . . . 0.0 110.527 -179.846 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.534 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 66.91 -76.59 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.057 -1.027 . . . . 0.0 110.043 -179.388 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -48.8 -46.81 42.23 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.354 -0.841 . . . . 0.0 111.274 -179.812 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -60.38 -32.75 71.6 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.597 -0.689 . . . . 0.0 110.118 179.784 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.626 HD21 ' CB ' ' A' ' 13' ' ' PRO . 22.2 mt -79.4 -30.43 42.42 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.571 -0.706 . . . . 0.0 110.433 -179.496 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.498 ' CE2' ' CE1' ' A' ' 23' ' ' TYR . 31.0 t80 -77.41 -54.43 6.45 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.562 -0.711 . . . . 0.0 110.685 -179.392 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.716 ' SG ' HD13 ' A' ' 43' ' ' LEU . 45.3 t -57.91 -50.38 73.53 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.578 -0.702 . . . . 0.0 110.675 -179.539 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 99.5 p -59.01 -24.48 62.83 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.553 -0.717 . . . . 0.0 110.944 -179.688 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -99.36 -25.62 14.41 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.398 -0.813 . . . . 0.0 111.305 -179.251 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.498 ' CE1' ' CE2' ' A' ' 19' ' ' PHE . 4.6 m-85 -86.5 -34.41 20.03 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.345 -0.847 . . . . 0.0 111.123 -179.281 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.479 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 4.0 mtt180 -46.6 -54.45 18.95 Favored Pre-proline 0 N--CA 1.499 1.995 0 O-C-N 121.384 -0.823 . . . . 0.0 112.251 -179.59 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.55 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 37.0 Cg_endo -61.09 -25.73 81.65 Favored 'Trans proline' 0 N--CA 1.494 1.507 0 O-C-N 123.305 1.161 . . . . 0.0 110.194 179.895 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -69.87 -46.6 65.16 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.179 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 35.9 mm -57.67 -29.61 35.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 CA-C-O 121.171 0.51 . . . . 0.0 110.402 179.873 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.55 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.5 mmmm -74.04 -36.28 64.39 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 120.01 -0.676 . . . . 0.0 110.204 -177.068 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.4 t -67.51 -19.15 65.28 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.458 -0.776 . . . . 0.0 110.48 179.7 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -118.65 -12.28 9.75 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.333 -0.854 . . . . 0.0 111.356 -179.628 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.684 ' HB3' HD23 ' A' ' 34' ' ' LEU . 42.3 m80 -133.54 94.25 19.86 Favored Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 121.152 -0.967 . . . . 0.0 109.737 179.515 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -75.65 -33.73 3.78 Favored 'Trans proline' 0 C--N 1.316 -1.155 0 O-C-N 123.592 1.312 . . . . 0.0 110.109 -179.841 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.43 -21.15 75.88 Favored Glycine 0 N--CA 1.489 2.198 0 N-CA-C 109.845 -1.302 . . . . 0.0 109.845 179.643 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.684 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.2 OUTLIER -50.18 91.11 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.497 -1.002 . . . . 0.0 111.373 -179.691 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 50.6 p -77.35 165.49 24.38 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.53 -0.731 . . . . 0.0 109.757 179.707 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.584 ' H ' HD12 ' A' ' 36' ' ' ILE . 2.4 mp -52.12 -27.38 9.62 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 O-C-N 121.432 -0.793 . . . . 0.0 110.171 -179.953 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.15 -61.44 6.65 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.054 -1.618 . . . . 0.0 109.054 179.607 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.445 ' HA ' ' HB2' ' A' ' 41' ' ' LYS . 32.8 t0 -76.86 -25.26 52.91 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.735 -0.862 . . . . 0.0 110.584 179.865 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.623 ' HA ' HD12 ' A' ' 34' ' ' LEU . 49.3 m -52.93 -45.55 67.7 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 120.867 -1.146 . . . . 0.0 110.072 179.451 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.637 ' HA ' HD12 ' A' ' 43' ' ' LEU . . . -76.15 -44.04 40.08 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 178.475 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.445 ' HB2' ' HA ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -57.74 -30.3 65.46 Favored 'General case' 0 N--CA 1.497 1.924 0 CA-C-O 121.378 0.609 . . . . 0.0 110.034 179.272 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.422 ' N ' ' O ' ' A' ' 38' ' ' ASP . 2.7 tptt -88.19 -3.02 58.93 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.636 -0.665 . . . . 0.0 110.964 -179.583 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.716 HD13 ' SG ' ' A' ' 20' ' ' CYS . 9.9 mt -90.17 -42.79 10.85 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.261 -0.9 . . . . 0.0 109.064 179.322 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -70.7 -32.24 67.25 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 108.762 -1.735 . . . . 0.0 108.762 179.264 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -58.58 -54.28 48.84 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.65 -0.912 . . . . 0.0 109.835 179.522 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 58.4 mtt -65.86 -54.59 24.69 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.643 -0.661 . . . . 0.0 109.438 179.206 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 68.2 t-105 -51.21 -56.45 12.78 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.605 -0.684 . . . . 0.0 110.787 -179.858 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 35.1 t -61.41 -34.34 75.2 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.436 -0.79 . . . . 0.0 110.252 -179.972 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -61.71 -39.84 92.92 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.578 -0.701 . . . . 0.0 110.114 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 31.4 mm-40 -57.97 155.69 10.38 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.62 -0.675 . . . . 0.0 110.614 -179.906 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.0 t -92.75 -149.58 0.26 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.69 -0.631 . . . . 0.0 109.41 179.527 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.04 50.33 1.99 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.211 -0.931 . . . . 0.0 110.312 179.726 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.59 -42.91 1.28 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.445 -0.784 . . . . 0.0 110.044 179.944 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -60.08 -29.79 68.8 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.454 -0.779 . . . . 0.0 110.584 -179.671 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 44.2 tttt -95.3 22.7 6.55 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.283 -0.886 . . . . 0.0 111.214 -179.368 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.436 ' HB2' ' HD3' ' A' ' 57' ' ' PRO . 10.0 mp0 -100.36 -61.09 0.1 OUTLIER Pre-proline 0 N--CA 1.497 1.876 0 O-C-N 121.349 -0.844 . . . . 0.0 111.047 179.683 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.436 ' HD3' ' HB2' ' A' ' 56' ' ' GLN . 55.5 Cg_endo -76.96 -36.76 1.33 Allowed 'Trans proline' 0 N--CA 1.485 0.987 0 O-C-N 122.618 0.799 . . . . 0.0 110.7 179.884 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -79.79 3.6 19.02 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.407 -0.808 . . . . 0.0 111.916 -178.929 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.416 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -98.31 -18.86 18.12 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.075 -1.016 . . . . 0.0 110.882 179.983 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -77.64 -24.39 49.5 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.286 -0.884 . . . . 0.0 110.363 179.817 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.441 ' HD3' HD13 ' A' ' 18' ' ' LEU . 55.0 tttt -59.82 -40.02 87.04 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.462 -0.774 . . . . 0.0 109.718 179.456 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.401 ' CB ' ' HA ' ' A' ' 14' ' ' SER . . . -69.42 -10.71 59.2 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.626 -0.671 . . . . 0.0 110.537 179.312 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.85 6.78 33.78 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.163 -0.961 . . . . 0.0 110.439 179.218 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 38.1 mmtt -105.78 -35.04 7.48 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.255 -0.903 . . . . 0.0 109.078 178.86 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.1 mp -78.38 -0.0 27.38 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.936 -0.478 . . . . 0.0 110.888 179.44 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 59.5 tttt -89.3 -26.16 21.28 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.168 -0.958 . . . . 0.0 109.805 179.292 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -83.27 -15.77 48.96 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.573 -0.704 . . . . 0.0 110.478 179.425 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 32.8 mtpt -101.48 -27.17 13.27 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.307 -0.87 . . . . 0.0 109.992 179.688 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.442 ' O ' HG22 ' A' ' 73' ' ' ILE . 23.0 t80 -77.68 -51.47 10.55 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.557 -0.714 . . . . 0.0 109.642 179.627 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -70.51 -6.82 38.95 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.685 -0.634 . . . . 0.0 111.589 -179.632 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 47.8 mttt -110.66 -33.9 6.43 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.077 -1.014 . . . . 0.0 110.174 179.868 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -87.34 -29.88 21.23 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.556 -0.715 . . . . 0.0 110.833 -179.47 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.442 HG22 ' O ' ' A' ' 69' ' ' TYR . 3.2 tp -66.8 -24.22 32.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 O-C-N 121.401 -0.812 . . . . 0.0 110.436 -179.69 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -55.48 -30.54 60.77 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.394 -0.816 . . . . 0.0 110.225 179.934 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -84.19 -10.81 57.43 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.688 -0.632 . . . . 0.0 110.501 179.201 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -105.46 26.33 9.6 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.248 -0.908 . . . . 0.0 109.984 179.531 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 6.2 mtt180 -128.39 -33.19 2.14 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.55 -0.719 . . . . 0.0 111.151 -179.468 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 53.24 72.83 0.4 Allowed 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.119 -0.988 . . . . 0.0 110.652 -179.865 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.229 -179.974 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.7 tpt . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 121.129 0.49 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -137.2 71.23 1.4 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.576 -0.703 . . . . 0.0 110.26 -179.982 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -170.02 -48.8 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.49 -0.756 . . . . 0.0 110.323 179.842 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.5 mttt -168.53 -165.69 0.61 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.477 -0.764 . . . . 0.0 110.36 179.966 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -118.61 174.28 2.8 Favored Pre-proline 0 N--CA 1.494 1.748 0 O-C-N 121.551 -0.718 . . . . 0.0 110.171 -179.825 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.4 -34.35 12.62 Favored 'Trans proline' 0 N--CA 1.486 1.086 0 O-C-N 123.36 1.189 . . . . 0.0 110.205 179.821 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 29.0 m120 -78.4 -10.19 59.59 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.598 -0.689 . . . . 0.0 110.876 -179.356 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -100.61 133.46 21.24 Favored Pre-proline 0 N--CA 1.493 1.692 0 O-C-N 121.127 -0.983 . . . . 0.0 109.278 179.07 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -73.2 107.71 2.44 Favored 'Trans proline' 0 C--N 1.318 -1.05 0 O-C-N 123.078 1.041 . . . . 0.0 110.628 -179.519 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.56 -163.08 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.803 -0.56 . . . . 0.0 110.302 -179.821 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 7.1 mpt_? -55.22 154.62 10.62 Favored Pre-proline 0 N--CA 1.5 2.045 0 O-C-N 121.37 -0.831 . . . . 0.0 110.768 -179.889 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -73.74 121.9 7.38 Favored 'Trans proline' 0 C--N 1.317 -1.122 0 O-C-N 123.541 1.285 . . . . 0.0 110.01 179.795 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.76 ' HB2' HD21 ' A' ' 18' ' ' LEU . 47.8 Cg_endo -82.23 162.48 17.62 Favored 'Trans proline' 0 C--N 1.317 -1.099 0 O-C-N 123.208 1.11 . . . . 0.0 110.353 -179.614 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.535 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 0.9 OUTLIER -162.75 65.76 0.21 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.554 -0.716 . . . . 0.0 110.223 -179.758 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.535 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 66.83 -76.58 0.05 OUTLIER 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.171 -0.956 . . . . 0.0 109.926 -179.35 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.439 ' CD1' ' CD1' ' A' ' 47' ' ' TRP . 11.7 t80 -51.64 -42.16 61.85 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.206 -0.934 . . . . 0.0 110.807 179.878 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -65.16 -26.34 68.13 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 120.085 -0.646 . . . . 0.0 109.824 179.716 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.76 HD21 ' HB2' ' A' ' 13' ' ' PRO . 35.9 mt -84.03 -39.2 19.92 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.5 -0.75 . . . . 0.0 110.064 -179.736 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -67.16 -49.77 63.56 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.557 -0.715 . . . . 0.0 110.223 -179.862 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 9.0 t -67.2 -28.29 67.96 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.62 -0.675 . . . . 0.0 109.964 179.561 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 42.0 t -87.57 4.23 44.46 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.491 -0.756 . . . . 0.0 111.632 -179.415 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 50.8 mm-40 -141.51 2.58 1.64 Allowed 'General case' 0 N--CA 1.499 1.997 0 O-C-N 120.974 -1.079 . . . . 0.0 112.367 -179.568 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 33.9 m-85 -122.27 22.2 10.17 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 120.826 -1.171 . . . . 0.0 111.129 -179.671 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.507 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 15.3 mtp180 -87.82 -45.49 0.49 Allowed Pre-proline 0 N--CA 1.489 1.49 0 O-C-N 121.361 -0.837 . . . . 0.0 112.403 179.815 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.582 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.4 Cg_endo -66.83 -14.68 44.71 Favored 'Trans proline' 0 N--CA 1.492 1.393 0 O-C-N 122.917 0.956 . . . . 0.0 110.686 -179.035 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -74.25 -52.58 11.92 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 177.837 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 30.2 mm -52.46 -31.26 15.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 CA-C-O 121.297 0.57 . . . . 0.0 110.454 179.649 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.582 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.9 mmmm -72.54 -33.45 66.84 Favored 'General case' 0 N--CA 1.496 1.855 0 C-N-CA 120.123 -0.631 . . . . 0.0 110.176 -177.303 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.7 t -62.03 -25.98 67.98 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.589 -0.694 . . . . 0.0 110.508 -179.922 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -115.7 -24.55 8.19 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.551 -0.718 . . . . 0.0 110.79 -179.669 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.768 ' HB3' HD23 ' A' ' 34' ' ' LEU . 38.3 m80 -119.3 96.75 50.13 Favored Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.476 -0.765 . . . . 0.0 109.543 -179.889 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -75.33 -28.79 8.36 Favored 'Trans proline' 0 C--N 1.313 -1.293 0 O-C-N 123.444 1.234 . . . . 0.0 110.49 -179.813 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -83.88 -13.94 73.81 Favored Glycine 0 N--CA 1.488 2.129 0 N-CA-C 110.506 -1.037 . . . . 0.0 110.506 -179.947 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.768 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -61.71 79.56 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.413 -1.051 . . . . 0.0 111.273 -179.333 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.404 ' N ' ' O ' ' A' ' 33' ' ' GLY . 79.5 p -69.48 174.79 4.55 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.394 -0.816 . . . . 0.0 109.581 179.847 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 40.3 mm -54.33 -29.9 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 O-C-N 121.308 -0.87 . . . . 0.0 110.15 179.895 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.7 -65.91 3.1 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 179.906 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.463 ' HB3' HD13 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -69.83 -29.72 67.05 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.622 -0.928 . . . . 0.0 110.757 179.857 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 73.7 m -64.65 -31.0 72.02 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.393 -0.817 . . . . 0.0 110.133 179.707 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.38 -43.78 48.41 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.584 -0.698 . . . . 0.0 110.158 -179.983 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.23 -12.06 47.87 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.596 -0.69 . . . . 0.0 111.822 -179.403 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 9.4 tptt -77.59 -59.64 2.7 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.987 -1.071 . . . . 0.0 109.797 179.529 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 43.8 mt -48.95 -26.08 2.3 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.413 -0.805 . . . . 0.0 111.336 -179.729 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.1 -37.87 82.79 Favored Glycine 0 N--CA 1.492 2.425 0 N-CA-C 109.277 -1.529 . . . . 0.0 109.277 179.673 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -50.9 -35.04 30.94 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.462 -1.022 . . . . 0.0 110.919 -179.839 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 22.8 mmt -81.84 -42.85 19.05 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.66 -0.65 . . . . 0.0 109.591 179.587 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 47' ' ' TRP . . . . . 0.439 ' CD1' ' CD1' ' A' ' 16' ' ' PHE . 45.4 t-105 -51.86 -52.66 47.93 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.526 -0.734 . . . . 0.0 110.788 -179.862 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.9 t -68.17 -32.1 72.11 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.381 -0.824 . . . . 0.0 110.506 -179.572 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -58.68 -38.84 79.1 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.516 -0.74 . . . . 0.0 110.252 -179.86 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -73.63 172.09 12.04 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.514 -0.741 . . . . 0.0 109.944 179.668 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 88.6 p -164.17 110.86 1.07 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.486 -0.758 . . . . 0.0 110.507 -179.918 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 51.6 35.34 14.49 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.429 -0.794 . . . . 0.0 111.054 179.611 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 70.8 mttt -135.39 -73.51 0.46 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.547 -0.721 . . . . 0.0 110.302 179.961 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -66.87 -20.67 65.96 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.511 -0.743 . . . . 0.0 110.687 -179.937 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.437 ' HG2' ' CH2' ' A' ' 47' ' ' TRP . 50.3 mttt -82.99 -35.27 26.0 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.368 -0.833 . . . . 0.0 110.678 -179.763 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -45.78 -51.55 29.26 Favored Pre-proline 0 N--CA 1.507 2.395 0 O-C-N 121.569 -0.707 . . . . 0.0 111.759 -179.176 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -79.09 -39.29 0.35 Allowed 'Trans proline' 0 C--N 1.314 -1.239 0 O-C-N 123.186 1.098 . . . . 0.0 110.747 179.889 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -81.51 4.68 20.38 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.605 -0.684 . . . . 0.0 112.104 -178.657 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.84 -20.35 17.56 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 120.996 -1.065 . . . . 0.0 110.358 179.387 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -77.72 -26.35 49.97 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.442 -0.786 . . . . 0.0 110.085 179.598 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 50.4 tttt -61.89 -40.38 95.24 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.571 -0.706 . . . . 0.0 110.092 179.855 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.636 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -79.34 -14.0 59.27 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.482 -0.761 . . . . 0.0 110.539 179.606 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -81.16 0.34 36.84 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.313 -0.867 . . . . 0.0 110.299 179.159 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 24.0 mmtp -105.72 -29.81 9.84 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.164 -0.96 . . . . 0.0 109.93 179.4 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.9 mp -87.15 -2.47 58.65 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.882 -0.511 . . . . 0.0 110.361 178.834 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.5 tptt -83.98 -35.64 23.79 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.299 -0.876 . . . . 0.0 108.771 178.916 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -66.95 -59.57 3.38 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 119.939 -0.704 . . . . 0.0 109.324 179.323 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -58.85 -20.3 49.56 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.607 -0.683 . . . . 0.0 111.02 -179.888 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.462 ' O ' HG22 ' A' ' 73' ' ' ILE . 32.6 t80 -77.5 -61.25 2.05 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.158 -0.964 . . . . 0.0 109.579 179.471 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -64.2 -12.49 41.03 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.613 -0.679 . . . . 0.0 111.334 -179.955 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.1 mmtm -102.49 -29.31 11.67 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.131 -0.981 . . . . 0.0 110.516 -179.949 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -99.78 -26.96 13.87 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.528 -0.732 . . . . 0.0 110.95 -179.612 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.462 HG22 ' O ' ' A' ' 69' ' ' TYR . 4.3 tp -61.5 -27.19 41.51 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.886 0 O-C-N 121.276 -0.89 . . . . 0.0 109.907 179.891 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -50.56 -43.98 56.42 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.474 -0.766 . . . . 0.0 110.576 179.841 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.38 -15.29 63.6 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.416 -0.803 . . . . 0.0 110.112 178.625 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -107.88 -1.23 20.94 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.406 -0.809 . . . . 0.0 109.755 176.727 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -148.03 75.01 1.32 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.476 -0.765 . . . . 0.0 111.328 -178.311 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.98 -1.39 43.57 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.414 -0.803 . . . . 0.0 110.918 178.991 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.494 1.732 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.333 -179.914 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 121.069 0.462 . . . . 0.0 110.194 . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.62 153.09 36.52 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.536 -0.727 . . . . 0.0 110.371 -179.914 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.7 tttt -169.93 163.31 9.51 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.552 -0.717 . . . . 0.0 110.22 179.806 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.837 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 11.9 mttp -60.04 -26.83 66.44 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.556 -0.715 . . . . 0.0 110.487 -179.821 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 59.3 163.13 0.09 OUTLIER Pre-proline 0 N--CA 1.501 2.111 0 O-C-N 121.338 -0.851 . . . . 0.0 110.363 -179.633 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -73.04 -19.47 22.98 Favored 'Trans proline' 0 C--N 1.316 -1.137 0 O-C-N 123.355 1.187 . . . . 0.0 111.205 -179.416 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -78.93 -29.94 44.42 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.281 -0.887 . . . . 0.0 110.605 -179.034 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.837 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -95.33 176.27 2.35 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.268 -0.895 . . . . 0.0 109.879 179.709 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.715 ' HD2' ' HB1' ' A' ' 8' ' ' ALA . 45.8 Cg_endo -73.92 134.83 20.36 Favored 'Trans proline' 0 C--N 1.318 -1.065 0 O-C-N 123.323 1.17 . . . . 0.0 110.123 179.806 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.35 -166.43 0.09 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.616 -0.678 . . . . 0.0 110.326 -179.706 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -58.37 146.34 72.06 Favored Pre-proline 0 N--CA 1.497 1.883 0 O-C-N 121.551 -0.718 . . . . 0.0 110.408 -179.92 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -74.35 125.3 9.57 Favored 'Trans proline' 0 C--N 1.317 -1.113 0 O-C-N 123.433 1.228 . . . . 0.0 110.009 179.783 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.729 ' HB2' HD21 ' A' ' 18' ' ' LEU . 49.4 Cg_endo -82.21 174.81 9.67 Favored 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.232 1.122 . . . . 0.0 110.181 -179.731 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.535 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 0.6 OUTLIER -169.59 69.07 0.06 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.556 -0.715 . . . . 0.0 110.495 -179.956 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.535 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 67.11 -77.64 0.04 OUTLIER 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.045 -1.035 . . . . 0.0 110.574 -179.794 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -47.79 -47.87 30.69 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.237 -0.914 . . . . 0.0 111.508 -179.34 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -61.83 -29.92 70.49 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.621 -0.674 . . . . 0.0 109.87 179.812 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.729 HD21 ' HB2' ' A' ' 13' ' ' PRO . 18.2 mt -83.16 -29.9 28.26 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.479 -0.763 . . . . 0.0 109.989 -179.82 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.498 ' CE2' ' CE1' ' A' ' 23' ' ' TYR . 55.8 t80 -77.56 -54.58 6.24 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.542 -0.724 . . . . 0.0 110.481 -179.463 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.444 ' SG ' HD13 ' A' ' 43' ' ' LEU . 7.7 t -58.43 -50.93 71.93 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.535 -0.728 . . . . 0.0 110.646 -179.704 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.1 t -58.23 -21.67 48.95 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.518 -0.739 . . . . 0.0 110.916 -179.798 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -101.63 -23.63 14.23 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.343 -0.848 . . . . 0.0 111.003 -179.662 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.498 ' CE1' ' CE2' ' A' ' 19' ' ' PHE . 2.4 m-85 -86.7 -33.87 19.9 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.479 -0.763 . . . . 0.0 110.681 -179.61 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.53 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 4.4 mtt-85 -48.35 -52.23 44.46 Favored Pre-proline 0 N--CA 1.498 1.93 0 O-C-N 121.318 -0.864 . . . . 0.0 111.85 179.903 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.571 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.2 Cg_endo -60.28 -27.9 85.8 Favored 'Trans proline' 0 N--CA 1.492 1.431 0 O-C-N 123.218 1.115 . . . . 0.0 109.933 179.797 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.8 tmtm? -69.64 -46.64 65.73 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 177.872 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.601 HG13 HD21 ' A' ' 43' ' ' LEU . 44.5 mm -56.42 -31.2 32.76 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.032 179.711 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.571 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 4.7 mmmm -72.95 -37.58 67.07 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 120.079 -0.649 . . . . 0.0 110.449 -177.552 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.4 t -60.56 -24.43 65.4 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.501 -0.749 . . . . 0.0 110.649 -179.633 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -117.62 -17.03 10.04 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.49 -0.756 . . . . 0.0 111.158 -179.625 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.716 ' HB3' HD23 ' A' ' 34' ' ' LEU . 39.8 m80 -127.77 95.15 35.54 Favored Pre-proline 0 N--CA 1.496 1.865 0 O-C-N 121.297 -0.877 . . . . 0.0 109.528 179.736 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -75.1 -36.14 2.66 Favored 'Trans proline' 0 C--N 1.315 -1.197 0 O-C-N 123.54 1.284 . . . . 0.0 110.307 -179.736 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.402 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -75.58 -18.46 79.77 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 179.771 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.824 HD13 ' HB3' ' A' ' 38' ' ' ASP . 0.3 OUTLIER -53.79 88.14 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.465 -1.021 . . . . 0.0 111.375 -179.507 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.402 ' N ' ' O ' ' A' ' 33' ' ' GLY . 45.2 t -70.88 175.91 4.7 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.517 -0.739 . . . . 0.0 109.741 179.722 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.463 ' N ' HD12 ' A' ' 36' ' ' ILE . 2.1 mp -59.64 -34.23 54.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.306 -0.871 . . . . 0.0 109.513 179.953 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.13 -58.83 12.53 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 109.104 -1.598 . . . . 0.0 109.104 179.63 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.824 ' HB3' HD13 ' A' ' 34' ' ' LEU . 6.5 t70 -70.21 -37.76 75.13 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.742 -0.858 . . . . 0.0 110.063 179.107 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.9 m -61.78 -31.08 71.26 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.159 -0.963 . . . . 0.0 110.107 179.268 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.94 -43.03 46.84 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.568 -0.708 . . . . 0.0 110.398 -179.845 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.42 ' HG2' ' HA ' ' A' ' 38' ' ' ASP . 2.3 ptpt -89.44 -12.97 38.69 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.595 -0.691 . . . . 0.0 111.979 -178.925 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.472 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -88.98 5.7 42.98 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 120.892 -1.13 . . . . 0.0 110.602 179.721 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.601 HD21 HG13 ' A' ' 27' ' ' ILE . 91.0 mt -107.92 -31.23 8.08 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.133 -0.979 . . . . 0.0 109.546 179.486 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.56 -31.9 82.34 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -61.76 -53.84 50.51 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.564 -0.963 . . . . 0.0 109.895 179.918 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 23.6 mtt -64.19 -23.55 67.36 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.589 -0.694 . . . . 0.0 110.345 179.803 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 77.0 t-105 -78.08 -38.92 43.12 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.46 -0.775 . . . . 0.0 110.121 179.794 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.9 m -80.14 -25.07 40.01 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.514 -0.741 . . . . 0.0 110.58 -179.899 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -70.21 -43.86 69.8 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.42 -0.8 . . . . 0.0 109.774 179.72 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 16.3 mm-40 -56.27 154.39 8.14 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.514 -0.742 . . . . 0.0 110.579 -179.92 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.4 m -93.52 -149.76 0.27 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.653 -0.654 . . . . 0.0 109.571 179.698 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -92.26 41.81 1.08 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.262 -0.899 . . . . 0.0 110.259 179.685 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -119.46 -49.06 2.38 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.529 -0.732 . . . . 0.0 110.109 179.899 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -61.62 -27.5 68.7 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.584 -0.698 . . . . 0.0 110.533 -179.831 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.8 ttpt -82.92 -34.38 26.61 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.434 -0.791 . . . . 0.0 110.638 -179.747 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -43.33 -53.09 11.84 Favored Pre-proline 0 N--CA 1.507 2.407 0 O-C-N 121.472 -0.768 . . . . 0.0 112.317 -178.861 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -79.12 -36.44 0.71 Allowed 'Trans proline' 0 C--N 1.315 -1.19 0 O-C-N 123.14 1.074 . . . . 0.0 111.273 179.999 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -85.21 0.02 53.16 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.454 -0.779 . . . . 0.0 112.319 -178.065 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.84 -25.41 15.04 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 120.938 -1.101 . . . . 0.0 110.699 -179.384 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.462 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 3.9 pt20 -73.99 -21.56 59.95 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.468 -0.77 . . . . 0.0 110.644 179.94 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.428 ' CG ' HD13 ' A' ' 18' ' ' LEU . 31.7 tttt -60.32 -43.11 96.67 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.49 -0.756 . . . . 0.0 110.233 179.877 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.23 -12.32 59.93 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.4 -0.813 . . . . 0.0 110.131 179.153 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' A' ' 60' ' ' GLN . . . -58.38 -38.99 78.42 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.244 -0.91 . . . . 0.0 109.229 179.223 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.6 ttpt -67.52 -61.47 1.88 Allowed 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 178.513 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.57 HD22 ' HG3' ' A' ' 13' ' ' PRO . 0.7 OUTLIER -44.74 -23.63 0.14 Allowed 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.798 -0.564 . . . . 0.0 112.328 -179.582 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 58.9 tttt -71.89 -44.43 63.76 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.256 -0.902 . . . . 0.0 108.658 178.241 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -82.26 -9.93 59.31 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.738 -0.601 . . . . 0.0 110.058 178.597 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.94 -32.56 11.6 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.309 -0.869 . . . . 0.0 109.153 179.267 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.463 ' O ' HG22 ' A' ' 73' ' ' ILE . 58.8 t80 -77.28 -51.13 11.42 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.131 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -70.91 -8.31 51.99 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.606 -0.684 . . . . 0.0 111.113 179.837 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.7 ttmm -108.87 -34.35 6.67 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.063 -1.023 . . . . 0.0 110.596 -179.907 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -82.24 -31.11 30.36 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.466 -0.772 . . . . 0.0 110.502 -179.853 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.463 HG22 ' O ' ' A' ' 69' ' ' TYR . 4.4 tp -68.72 -19.23 23.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.517 -0.739 . . . . 0.0 110.447 179.964 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.25 -33.5 75.95 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.48 -0.763 . . . . 0.0 109.011 179.427 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -83.09 -14.35 53.88 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.888 -0.507 . . . . 0.0 110.117 178.824 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.436 ' CD2' ' HB2' ' A' ' 8' ' ' ALA . 32.1 t80 -93.81 30.7 1.75 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.242 -0.911 . . . . 0.0 110.605 179.844 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 76.4 mtp85 -137.76 -104.76 0.19 Allowed 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.041 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -145.17 51.78 1.21 Allowed 'General case' 0 N--CA 1.496 1.825 0 O-C-N 120.763 -1.21 . . . . 0.0 110.239 -179.969 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.779 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.031 -179.992 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.5 ptp . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.124 0.487 . . . . 0.0 110.3 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -97.59 41.73 1.11 Allowed 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.519 -0.738 . . . . 0.0 110.233 179.984 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 27.8 ttmt -59.2 -56.39 22.71 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.523 -0.736 . . . . 0.0 110.357 -179.982 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.4 mtpt -153.45 -167.92 2.84 Favored 'General case' 0 N--CA 1.484 1.253 0 O-C-N 121.605 -0.684 . . . . 0.0 109.731 179.597 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -57.19 145.06 67.91 Favored Pre-proline 0 N--CA 1.497 1.896 0 O-C-N 121.55 -0.719 . . . . 0.0 110.488 -179.9 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -73.75 -25.29 14.77 Favored 'Trans proline' 0 C--N 1.317 -1.098 0 O-C-N 123.377 1.199 . . . . 0.0 110.459 179.96 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -79.21 -16.83 55.95 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.534 -0.728 . . . . 0.0 111.0 -179.359 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -105.4 134.14 19.82 Favored Pre-proline 0 N--CA 1.494 1.734 0 O-C-N 121.25 -0.906 . . . . 0.0 109.566 179.327 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -72.68 113.63 3.8 Favored 'Trans proline' 0 N--CA 1.486 1.033 0 O-C-N 123.097 1.051 . . . . 0.0 110.722 -179.712 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.7 pttt -59.47 -160.38 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.644 -0.66 . . . . 0.0 110.452 -179.724 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -57.05 149.35 45.96 Favored Pre-proline 0 N--CA 1.499 1.995 0 O-C-N 121.282 -0.886 . . . . 0.0 110.786 -179.884 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.408 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.6 Cg_endo -76.41 124.37 7.68 Favored 'Trans proline' 0 C--N 1.317 -1.114 0 O-C-N 123.455 1.24 . . . . 0.0 109.651 179.31 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.513 ' C ' ' HB1' ' A' ' 62' ' ' ALA . 47.6 Cg_endo -81.2 177.08 8.17 Favored 'Trans proline' 0 C--N 1.316 -1.139 0 O-C-N 123.261 1.137 . . . . 0.0 110.158 -179.644 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.566 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 8.9 t -167.77 60.13 0.07 Allowed 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.458 -0.776 . . . . 0.0 110.684 -179.766 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.593 ' HB2' ' HA ' ' A' ' 59' ' ' GLU . . . 70.14 -74.79 0.08 Allowed 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.199 -0.938 . . . . 0.0 110.1 -179.469 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -48.76 -50.42 33.97 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.347 -0.846 . . . . 0.0 111.241 -179.643 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -58.91 -40.96 86.11 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.593 -0.692 . . . . 0.0 109.477 179.431 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.743 HD11 ' HB2' ' A' ' 62' ' ' ALA . 53.2 mt -61.67 -46.61 89.01 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.681 -0.637 . . . . 0.0 109.884 179.732 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.499 ' CE2' ' CE2' ' A' ' 23' ' ' TYR . 23.6 t80 -65.88 -50.43 64.56 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.715 -0.616 . . . . 0.0 110.252 -179.891 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.3 m -65.71 -29.1 69.59 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.673 -0.642 . . . . 0.0 110.057 179.981 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.7 m -67.85 -23.68 65.18 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.559 -0.713 . . . . 0.0 110.75 -179.749 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -110.2 -27.76 8.97 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.38 -0.825 . . . . 0.0 111.42 -179.104 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.499 ' CE2' ' CE2' ' A' ' 19' ' ' PHE . 7.2 m-85 -81.6 -37.23 27.96 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.18 -0.95 . . . . 0.0 110.849 -179.238 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.534 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 11.2 mtt85 -48.76 -51.75 51.27 Favored Pre-proline 0 N--CA 1.495 1.802 0 O-C-N 121.305 -0.872 . . . . 0.0 111.823 -179.974 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.534 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 36.0 Cg_endo -59.71 -27.62 85.39 Favored 'Trans proline' 0 N--CA 1.492 1.421 0 O-C-N 123.137 1.072 . . . . 0.0 109.821 179.455 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.88 -48.09 48.23 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 177.349 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.643 HG13 HD21 ' A' ' 43' ' ' LEU . 41.6 mm -54.71 -33.02 26.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.479 179.826 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.553 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER -68.23 -31.26 70.63 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.569 -0.707 . . . . 0.0 110.399 -177.579 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.9 t -82.11 -17.86 45.02 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.505 -0.747 . . . . 0.0 111.195 -179.853 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -114.72 -15.94 11.85 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.179 -0.951 . . . . 0.0 111.362 -179.485 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.567 ' HB3' ' CB ' ' A' ' 34' ' ' LEU . 25.0 m80 -117.26 91.92 38.43 Favored Pre-proline 0 N--CA 1.499 1.977 0 O-C-N 121.27 -0.894 . . . . 0.0 109.634 -179.702 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -77.43 -71.74 0.01 OUTLIER 'Trans proline' 0 N--CA 1.484 0.969 0 O-C-N 123.378 1.199 . . . . 0.0 111.689 -179.199 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -56.26 -21.93 34.89 Favored Glycine 0 N--CA 1.499 2.867 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 -179.752 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.786 ' O ' HD23 ' A' ' 34' ' ' LEU . 7.8 tt -53.41 92.85 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.48 -1.012 . . . . 0.0 110.845 179.506 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 18.8 m -57.7 175.53 0.18 Allowed 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.461 -0.774 . . . . 0.0 110.116 -179.386 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.414 HD13 ' HA ' ' A' ' 36' ' ' ILE . 14.7 mm -56.19 -61.32 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 O-C-N 121.351 -0.843 . . . . 0.0 110.312 -179.897 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.444 ' O ' ' HE2' ' A' ' 41' ' ' LYS . . . -48.59 -38.19 21.15 Favored Glycine 0 N--CA 1.497 2.701 0 N-CA-C 110.319 -1.112 . . . . 0.0 110.319 -179.12 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.42 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 33.4 m-20 -65.39 -36.5 84.15 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.558 -0.966 . . . . 0.0 109.737 178.755 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.599 ' CA ' HD21 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -60.95 -36.43 79.36 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.571 -0.705 . . . . 0.0 110.678 179.743 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.98 -49.64 17.12 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.526 -0.734 . . . . 0.0 110.242 -179.713 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.444 ' HE2' ' O ' ' A' ' 37' ' ' GLY . 0.9 OUTLIER -74.71 -13.41 60.61 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.602 -0.686 . . . . 0.0 111.294 -179.621 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.42 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 5.4 tptt -84.63 -59.73 2.28 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 120.933 -1.104 . . . . 0.0 109.836 179.339 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.643 HD21 HG13 ' A' ' 27' ' ' ILE . 16.3 mt -49.15 -29.25 5.17 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.541 -0.724 . . . . 0.0 111.043 -179.819 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.27 -38.58 96.69 Favored Glycine 0 N--CA 1.493 2.444 0 N-CA-C 109.425 -1.47 . . . . 0.0 109.425 179.934 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -50.56 -33.89 23.57 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.445 -1.032 . . . . 0.0 111.041 -179.708 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 31.9 mtt -86.69 -41.31 14.29 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.536 -0.728 . . . . 0.0 110.495 -179.793 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 72.3 t-105 -55.55 -21.21 16.05 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.502 -0.749 . . . . 0.0 111.136 -179.421 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.6 t -93.01 -33.46 14.12 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.324 -0.86 . . . . 0.0 110.239 -179.979 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -63.27 -36.32 83.28 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.637 -0.665 . . . . 0.0 110.067 179.891 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -62.56 150.68 39.82 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.587 -0.696 . . . . 0.0 110.201 179.949 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 83.9 p -98.22 -152.08 0.39 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.611 -0.681 . . . . 0.0 109.588 179.677 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -82.58 56.57 3.38 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.305 -0.872 . . . . 0.0 110.053 179.794 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -134.98 -46.03 0.72 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.444 -0.785 . . . . 0.0 110.198 179.932 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -63.72 -31.14 72.22 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.545 -0.722 . . . . 0.0 110.457 -179.708 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.401 ' O ' ' HB3' ' A' ' 59' ' ' GLU . 19.8 ttpt -99.09 22.75 9.92 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.46 -0.775 . . . . 0.0 110.824 -179.73 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.453 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 4.9 mt-30 -93.44 -59.79 0.2 Allowed Pre-proline 0 N--CA 1.495 1.807 0 O-C-N 121.146 -0.971 . . . . 0.0 110.787 -179.659 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.453 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.5 Cg_endo -79.28 -27.3 4.44 Favored 'Trans proline' 0 N--CA 1.486 1.071 0 O-C-N 122.953 0.975 . . . . 0.0 111.468 -179.58 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.432 ' CE2' ' HB3' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -84.48 -21.12 30.74 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.354 -0.841 . . . . 0.0 111.914 -178.163 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.593 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.2 OUTLIER -69.61 -27.08 64.77 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.245 -0.909 . . . . 0.0 111.033 -179.287 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -78.14 -20.03 52.87 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.42 -0.8 . . . . 0.0 110.508 179.923 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 58.1 tttt -64.05 -46.38 84.63 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.462 -0.773 . . . . 0.0 109.803 179.717 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.743 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -77.5 -13.14 59.99 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.555 -0.715 . . . . 0.0 110.532 179.578 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -78.21 -3.0 40.49 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.325 -0.86 . . . . 0.0 110.081 178.832 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 26.2 mmtm -105.25 -25.31 12.49 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.108 -0.995 . . . . 0.0 110.068 179.507 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.2 mp -88.8 -16.21 32.66 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.749 -0.595 . . . . 0.0 109.926 178.704 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.5 tptt -74.7 -35.89 62.72 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.46 -0.775 . . . . 0.0 109.482 179.397 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -67.2 -57.48 6.65 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.686 -0.634 . . . . 0.0 109.829 179.776 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -58.28 -26.72 63.32 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.601 -0.687 . . . . 0.0 110.593 -179.955 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.631 ' HE1' HD13 ' A' ' 73' ' ' ILE . 37.0 t80 -73.63 -68.25 0.52 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.473 -0.767 . . . . 0.0 109.445 179.503 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -55.34 -21.15 13.95 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.798 -0.564 . . . . 0.0 111.211 -179.772 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -95.46 -19.1 20.14 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.423 -0.798 . . . . 0.0 111.316 -179.485 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -109.73 -31.93 7.27 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.242 -0.911 . . . . 0.0 110.907 -179.537 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.631 HD13 ' HE1' ' A' ' 69' ' ' TYR . 2.5 tp -67.05 -33.13 61.3 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 C-N-CA 119.822 -0.751 . . . . 0.0 110.024 -179.733 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.19 -35.68 74.01 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.615 -0.678 . . . . 0.0 109.907 179.702 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -91.62 -20.0 22.1 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.659 -0.651 . . . . 0.0 110.241 179.469 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -73.14 -41.13 64.3 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.409 -0.807 . . . . 0.0 110.198 179.813 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 36.1 mtt180 -94.04 6.02 49.86 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.511 -0.743 . . . . 0.0 111.081 179.982 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 56.32 68.14 0.9 Allowed 'General case' 0 N--CA 1.502 2.126 0 O-C-N 120.982 -1.074 . . . . 0.0 110.419 -179.738 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.2 ptmm? . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.365 179.81 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.1 tpt . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.051 0.453 . . . . 0.0 110.199 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.56 175.36 5.52 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.543 -0.723 . . . . 0.0 110.26 179.904 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 66.7 tttt -169.94 34.43 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.601 -0.687 . . . . 0.0 110.23 179.857 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.7 mttt 53.89 -161.42 0.13 Allowed 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.469 -0.769 . . . . 0.0 110.677 179.837 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -133.36 177.23 2.35 Favored Pre-proline 0 N--CA 1.494 1.729 0 O-C-N 121.583 -0.698 . . . . 0.0 110.125 -179.765 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.19 -28.27 18.91 Favored 'Trans proline' 0 N--CA 1.487 1.091 0 O-C-N 123.415 1.219 . . . . 0.0 110.376 -179.856 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -78.67 -23.28 45.79 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.61 -0.682 . . . . 0.0 110.399 -179.389 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.453 ' HB2' ' CZ ' ' A' ' 76' ' ' TYR . . . -99.1 133.69 21.95 Favored Pre-proline 0 N--CA 1.492 1.675 0 O-C-N 121.384 -0.823 . . . . 0.0 109.395 179.15 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -71.65 111.64 3.18 Favored 'Trans proline' 0 C--N 1.318 -1.043 0 O-C-N 123.138 1.072 . . . . 0.0 110.517 -179.517 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.7 pttt -67.97 -160.17 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.541 -0.725 . . . . 0.0 109.751 179.815 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -60.44 141.03 91.86 Favored Pre-proline 0 N--CA 1.497 1.898 0 O-C-N 121.359 -0.838 . . . . 0.0 109.88 179.769 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.411 ' HD3' ' CZ ' ' A' ' 69' ' ' TYR . 46.8 Cg_endo -73.77 129.87 14.0 Favored 'Trans proline' 0 C--N 1.317 -1.094 0 O-C-N 123.248 1.131 . . . . 0.0 110.193 -179.897 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.612 ' HB2' HD21 ' A' ' 18' ' ' LEU . 49.1 Cg_endo -81.26 -179.59 5.13 Favored 'Trans proline' 0 C--N 1.318 -1.051 0 O-C-N 123.271 1.143 . . . . 0.0 110.08 -179.94 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.557 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 32.2 t -170.01 62.51 0.05 OUTLIER 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.505 -0.747 . . . . 0.0 110.828 -179.928 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.557 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 70.88 -75.98 0.07 Allowed 'General case' 0 N--CA 1.505 2.308 0 O-C-N 121.043 -1.035 . . . . 0.0 110.504 -179.601 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -50.78 -45.83 59.31 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.23 -0.919 . . . . 0.0 110.952 -179.823 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -61.45 -34.35 75.27 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 120.183 -0.607 . . . . 0.0 109.71 179.622 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.612 HD21 ' HB2' ' A' ' 13' ' ' PRO . 29.8 mt -76.44 -40.16 51.38 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.486 -0.759 . . . . 0.0 110.404 -179.539 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.494 ' CE2' ' CZ ' ' A' ' 23' ' ' TYR . 32.0 t80 -66.45 -51.18 59.61 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.554 -0.716 . . . . 0.0 110.586 -179.43 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 2.2 t -65.7 -28.94 69.44 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.453 -0.78 . . . . 0.0 110.051 179.707 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.9 m -70.06 -15.87 63.06 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.647 -0.658 . . . . 0.0 111.54 -179.273 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -125.65 -25.72 3.64 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.068 -1.02 . . . . 0.0 112.133 -179.116 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.494 ' CZ ' ' CE2' ' A' ' 19' ' ' PHE . 10.6 m-85 -76.95 -38.47 53.25 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.165 -0.959 . . . . 0.0 110.798 -179.448 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.491 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 2.1 mtt180 -48.08 -53.33 33.86 Favored Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 121.359 -0.838 . . . . 0.0 112.415 -179.527 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.534 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.2 Cg_endo -59.61 -27.66 85.49 Favored 'Trans proline' 0 N--CA 1.494 1.517 0 O-C-N 123.221 1.116 . . . . 0.0 110.185 -179.624 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.0 tmtm? -70.46 -46.78 63.16 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 177.542 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.655 HG13 HD21 ' A' ' 43' ' ' LEU . 46.1 mm -57.71 -21.68 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.632 179.724 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.535 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 4.9 mmmm -81.06 -26.96 35.91 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.141 -0.974 . . . . 0.0 110.426 -177.573 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.8 t -86.28 -3.23 58.94 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.482 -0.761 . . . . 0.0 111.119 179.627 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -132.51 -2.01 3.45 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.062 -1.024 . . . . 0.0 112.018 -179.464 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.59 ' CB ' HD13 ' A' ' 34' ' ' LEU . 54.4 m80 -126.33 95.65 38.15 Favored Pre-proline 0 N--CA 1.499 2.015 0 O-C-N 120.915 -1.116 . . . . 0.0 109.779 179.924 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -78.34 -75.41 0.01 OUTLIER 'Trans proline' 0 N--CA 1.485 0.979 0 O-C-N 123.43 1.226 . . . . 0.0 111.708 -179.301 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -51.35 -28.71 20.91 Favored Glycine 0 N--CA 1.503 3.113 0 N-CA-C 110.343 -1.103 . . . . 0.0 110.343 -179.483 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.746 ' O ' HD23 ' A' ' 34' ' ' LEU . 7.8 tt -46.59 96.04 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.792 -0.828 . . . . 0.0 111.455 179.844 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 44.8 m -66.52 178.3 1.3 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.675 -0.64 . . . . 0.0 109.863 -179.77 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.403 ' HA ' HD13 ' A' ' 36' ' ' ILE . 13.8 mm -58.72 -61.44 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.053 0 O-C-N 121.46 -0.775 . . . . 0.0 110.201 179.908 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.457 ' O ' ' HE2' ' A' ' 41' ' ' LYS . . . -46.9 -38.34 10.18 Favored Glycine 0 N--CA 1.498 2.777 0 N-CA-C 110.617 -0.993 . . . . 0.0 110.617 -178.806 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.462 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 1.6 m-20 -68.57 -33.44 74.09 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.585 -0.95 . . . . 0.0 110.055 178.917 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.536 HG23 HD21 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -67.34 -38.63 85.14 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.333 -0.854 . . . . 0.0 110.776 179.69 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.2 -38.36 78.58 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.65 -0.656 . . . . 0.0 110.121 -179.226 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.457 ' HE2' ' O ' ' A' ' 37' ' ' GLY . 1.2 ptpm? -89.72 -13.8 36.06 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 119.988 -0.685 . . . . 0.0 111.167 -179.69 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 3.4 tptt -87.66 -9.33 54.5 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.006 -1.058 . . . . 0.0 110.556 179.015 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.655 HD21 HG13 ' A' ' 27' ' ' ILE . 22.4 mt -95.11 -32.82 12.91 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.39 -0.819 . . . . 0.0 109.287 179.362 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.91 -35.42 72.36 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 108.605 -1.798 . . . . 0.0 108.605 179.178 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -57.13 -39.26 74.8 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.633 -0.922 . . . . 0.0 110.363 179.881 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 30.5 mtt -77.69 -48.69 16.12 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.54 -0.725 . . . . 0.0 110.355 179.991 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 68.8 t-105 -58.3 -25.46 61.87 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.539 -0.726 . . . . 0.0 110.659 -179.712 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 62.5 p -85.9 -37.26 19.3 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.394 -0.816 . . . . 0.0 110.054 179.963 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -63.92 -31.95 73.31 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.523 -0.736 . . . . 0.0 109.967 179.873 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 89.4 mm-40 -62.28 148.73 44.06 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.58 -0.7 . . . . 0.0 110.134 179.889 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.8 m -101.41 -153.01 0.44 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.58 -0.7 . . . . 0.0 109.621 179.724 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -82.52 56.34 3.27 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.344 -0.847 . . . . 0.0 110.119 179.753 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 17.6 tptt -132.25 -49.29 0.93 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.449 -0.782 . . . . 0.0 110.133 -179.994 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -66.8 -35.7 80.68 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.57 -0.706 . . . . 0.0 110.46 -179.948 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.419 ' O ' ' N ' ' A' ' 59' ' ' GLU . 17.6 tttt -71.59 -37.78 70.96 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.552 -0.718 . . . . 0.0 110.864 -179.669 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.402 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 5.0 mm-40 -43.53 -57.19 5.9 Favored Pre-proline 0 N--CA 1.507 2.406 0 O-C-N 121.318 -0.864 . . . . 0.0 112.751 -178.674 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.402 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.0 Cg_endo -77.19 -36.21 1.44 Allowed 'Trans proline' 0 N--CA 1.489 1.255 0 O-C-N 123.071 1.037 . . . . 0.0 111.903 -179.52 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -83.46 -12.28 56.53 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.352 -0.843 . . . . 0.0 112.561 -177.645 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.419 ' N ' ' O ' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -82.72 -27.47 31.13 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.033 -1.042 . . . . 0.0 111.112 -179.165 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -74.01 -20.04 60.45 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.343 -0.848 . . . . 0.0 110.751 -179.987 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 43.5 tttm -65.8 -42.08 91.11 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.286 -0.883 . . . . 0.0 109.962 179.796 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.566 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -81.34 -16.79 51.29 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.599 -0.688 . . . . 0.0 110.224 179.385 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.27 -36.86 78.77 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.343 -0.848 . . . . 0.0 110.306 179.89 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -70.82 -62.34 1.43 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.239 -0.913 . . . . 0.0 110.003 179.858 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.436 ' H ' HD12 ' A' ' 65' ' ' LEU . 4.7 mp -46.88 -24.15 0.55 Allowed 'General case' 0 N--CA 1.505 2.291 0 O-C-N 121.555 -0.716 . . . . 0.0 112.157 -179.453 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.8 tptm -68.23 -48.14 65.95 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.299 -0.876 . . . . 0.0 109.506 179.189 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -65.0 -55.49 18.7 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.735 -0.603 . . . . 0.0 109.953 179.718 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 60.3 mttm -56.67 -26.89 57.56 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.467 -0.771 . . . . 0.0 110.481 179.888 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.449 ' O ' HG22 ' A' ' 73' ' ' ILE . 50.1 t80 -75.91 -67.99 0.62 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.499 -0.751 . . . . 0.0 109.296 179.385 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -51.36 -24.34 4.66 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.662 -0.648 . . . . 0.0 111.478 -179.548 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 46.8 mttp -92.62 -62.53 1.38 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.439 -0.788 . . . . 0.0 110.917 -179.44 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -58.1 -31.04 66.74 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.609 -0.682 . . . . 0.0 111.135 -179.078 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.449 HG22 ' O ' ' A' ' 69' ' ' TYR . 4.6 tp -62.48 -35.84 71.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 O-C-N 121.342 -0.849 . . . . 0.0 110.457 -179.474 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.98 -52.5 65.13 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.571 -0.706 . . . . 0.0 110.095 -179.949 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.89 -25.92 61.25 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.656 -0.653 . . . . 0.0 110.122 179.682 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.453 ' CZ ' ' HB2' ' A' ' 8' ' ' ALA . 75.5 t80 -66.27 -31.52 72.37 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.569 -0.707 . . . . 0.0 110.073 179.92 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 17.7 mtt-85 -84.23 -80.84 0.19 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.65 -0.656 . . . . 0.0 110.082 -179.958 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -168.71 44.8 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.264 -0.897 . . . . 0.0 110.076 -179.932 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 15.2 mtmt . . . . . 0 N--CA 1.494 1.735 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.232 -179.972 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.5 ttt . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.035 0.445 . . . . 0.0 110.26 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -100.89 108.32 20.05 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.667 -0.645 . . . . 0.0 110.197 179.977 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -70.6 68.24 0.38 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.604 -0.685 . . . . 0.0 110.423 -179.782 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.407 ' HB2' ' HD2' ' A' ' 10' ' ' LYS . 5.3 mtpt -66.66 -137.11 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.524 -0.735 . . . . 0.0 109.843 179.99 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -171.01 175.01 1.41 Allowed Pre-proline 0 N--CA 1.496 1.842 0 O-C-N 120.695 -1.253 . . . . 0.0 109.681 179.978 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -69.84 -34.68 13.85 Favored 'Trans proline' 0 N--CA 1.488 1.154 0 O-C-N 123.273 1.144 . . . . 0.0 109.926 179.744 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.7 p30 -76.92 5.85 7.22 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.777 -0.577 . . . . 0.0 112.056 -177.591 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -98.4 155.74 36.52 Favored Pre-proline 0 N--CA 1.492 1.665 0 O-C-N 120.927 -1.108 . . . . 0.0 108.304 177.68 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.424 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 53.7 Cg_endo -84.73 43.37 1.3 Allowed 'Trans proline' 0 C--N 1.315 -1.202 0 O-C-N 123.047 1.025 . . . . 0.0 112.123 -179.264 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.407 ' HD2' ' HB2' ' A' ' 4' ' ' LYS . 9.5 mtpt -43.3 139.91 1.78 Allowed 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.396 -0.815 . . . . 0.0 112.872 -179.065 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.7 tpt180 49.79 99.82 0.04 OUTLIER Pre-proline 0 N--CA 1.497 1.923 0 O-C-N 121.795 -0.566 . . . . 0.0 112.156 178.911 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.408 ' HB3' ' CD2' ' A' ' 69' ' ' TYR . 47.1 Cg_endo -75.79 132.21 14.17 Favored 'Trans proline' 0 C--N 1.318 -1.028 0 O-C-N 123.248 1.131 . . . . 0.0 109.321 178.581 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.55 ' HG3' HD22 ' A' ' 65' ' ' LEU . 50.1 Cg_endo -80.06 155.88 23.02 Favored 'Trans proline' 0 C--N 1.316 -1.152 0 O-C-N 123.161 1.085 . . . . 0.0 110.196 -179.576 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.573 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 7.6 t -158.73 51.43 0.39 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.515 -0.741 . . . . 0.0 110.961 -179.584 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.573 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 71.58 -73.83 0.09 Allowed 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.348 -0.845 . . . . 0.0 110.403 -179.518 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -46.71 -53.72 11.16 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.327 -0.858 . . . . 0.0 111.442 -179.561 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -55.61 -40.93 72.75 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.518 -0.739 . . . . 0.0 109.965 179.512 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.503 HD11 ' HB2' ' A' ' 62' ' ' ALA . 56.4 mt -62.09 -41.41 98.16 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.719 -0.613 . . . . 0.0 109.834 179.819 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -75.19 -53.89 8.05 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.592 -0.692 . . . . 0.0 110.232 -179.996 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 3.7 m -55.44 -55.96 25.7 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.435 -0.791 . . . . 0.0 110.434 -179.976 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 62.9 p -53.6 -29.92 39.97 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.467 -0.771 . . . . 0.0 110.521 179.994 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -88.56 -32.51 18.1 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.618 -0.677 . . . . 0.0 110.74 -179.781 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -94.63 13.61 23.7 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.451 -0.781 . . . . 0.0 111.513 -179.446 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.551 ' CG ' HD11 ' A' ' 43' ' ' LEU . 8.5 mtt180 -88.37 -42.92 0.47 Allowed Pre-proline 0 N--CA 1.488 1.434 0 O-C-N 121.192 -0.942 . . . . 0.0 112.367 179.471 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.58 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.1 Cg_endo -67.04 -16.95 50.68 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 O-C-N 122.711 0.848 . . . . 0.0 110.427 -179.203 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.41 -50.78 23.91 Favored 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 177.859 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 39.0 mm -52.93 -32.7 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 CA-C-O 121.49 0.662 . . . . 0.0 110.281 179.641 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.58 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.6 mmmm -72.37 -37.43 68.77 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.252 -177.215 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.0 t -59.91 -24.57 64.43 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.377 -0.827 . . . . 0.0 110.619 -179.699 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -116.37 -21.83 9.08 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.455 -0.778 . . . . 0.0 110.903 -179.609 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.775 ' HB3' HD23 ' A' ' 34' ' ' LEU . 43.7 m80 -121.71 96.32 47.34 Favored Pre-proline 0 N--CA 1.495 1.788 0 O-C-N 121.342 -0.849 . . . . 0.0 109.682 179.93 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -74.98 -33.27 4.74 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.366 1.193 . . . . 0.0 110.361 -179.817 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -79.48 -11.8 84.46 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 110.35 -1.1 . . . . 0.0 110.35 179.805 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.775 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -62.46 81.64 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.287 -1.125 . . . . 0.0 110.753 -179.668 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.1 t -74.89 177.9 5.94 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.425 -0.797 . . . . 0.0 109.721 179.721 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 37.3 mm -51.33 -37.25 18.21 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.207 0 O-C-N 121.234 -0.916 . . . . 0.0 110.586 -179.899 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -55.57 -68.94 1.43 Allowed Glycine 0 N--CA 1.494 2.502 0 N-CA-C 109.328 -1.509 . . . . 0.0 109.328 179.824 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.533 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 1.9 m-20 -66.19 -29.65 69.97 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.786 -0.832 . . . . 0.0 110.724 179.475 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 75.1 m -66.58 -29.26 69.27 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.164 -0.96 . . . . 0.0 110.291 179.648 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.11 -45.05 59.27 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.553 -0.717 . . . . 0.0 109.948 179.848 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -82.92 -17.72 42.66 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.668 -0.645 . . . . 0.0 112.213 -178.897 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.533 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -82.18 3.18 28.25 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 120.762 -1.211 . . . . 0.0 110.818 179.665 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.551 HD11 ' CG ' ' A' ' 24' ' ' ARG . 34.1 mt -105.79 -29.44 10.04 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.268 -0.895 . . . . 0.0 109.632 179.502 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.09 -37.8 82.85 Favored Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -179.79 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -50.16 -36.02 28.46 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.428 -1.043 . . . . 0.0 110.906 -179.644 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 64.2 mtm -87.27 -39.24 15.58 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.518 -0.739 . . . . 0.0 109.946 179.614 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 67.3 t-105 -55.56 -31.07 61.85 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.605 -0.684 . . . . 0.0 110.994 -179.643 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.2 t -87.35 -32.84 19.4 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.276 -0.89 . . . . 0.0 110.229 -179.802 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -63.66 -37.06 85.92 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.509 -0.744 . . . . 0.0 109.915 179.869 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.0 mm-40 -59.7 149.68 29.99 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.628 -0.67 . . . . 0.0 110.336 179.919 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 85.6 p -92.83 -152.15 0.31 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.688 -0.633 . . . . 0.0 109.613 179.679 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -83.67 55.55 3.27 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.313 -0.867 . . . . 0.0 110.151 179.82 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -135.95 -43.61 0.65 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.453 -0.779 . . . . 0.0 110.255 -179.936 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -62.49 -33.85 75.7 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.457 -0.777 . . . . 0.0 110.336 -179.904 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -96.87 22.35 8.41 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.442 -0.786 . . . . 0.0 111.092 -179.556 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.464 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 2.6 mm100 -92.19 -57.46 0.24 Allowed Pre-proline 0 N--CA 1.496 1.852 0 O-C-N 121.072 -1.017 . . . . 0.0 110.278 179.889 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.464 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 57.5 Cg_endo -82.96 -26.35 2.42 Favored 'Trans proline' 0 N--CA 1.484 0.945 0 O-C-N 122.929 0.963 . . . . 0.0 110.748 179.568 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -83.21 -18.54 38.92 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.456 -0.777 . . . . 0.0 111.955 -178.149 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.436 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.3 OUTLIER -77.2 -26.14 52.48 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.175 -0.953 . . . . 0.0 110.944 -179.288 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -79.45 -21.31 45.64 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.501 -0.75 . . . . 0.0 110.648 179.947 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 62.2 tttt -65.9 -44.33 85.57 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.455 -0.778 . . . . 0.0 109.74 179.643 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.503 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -79.99 -15.13 57.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.581 -0.699 . . . . 0.0 110.161 179.174 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.08 -32.97 72.61 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.351 -0.843 . . . . 0.0 109.942 179.592 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -77.59 -63.9 1.27 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.579 -0.701 . . . . 0.0 109.73 179.45 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.55 HD22 ' HG3' ' A' ' 13' ' ' PRO . 5.0 mp -50.1 -25.68 3.72 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.48 -0.762 . . . . 0.0 111.114 -179.807 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -67.19 -49.95 62.74 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.523 -0.736 . . . . 0.0 109.373 179.307 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -61.98 -49.31 76.61 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.68 -0.637 . . . . 0.0 109.351 179.298 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 37.1 mttp -60.33 -27.37 67.3 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.719 -0.613 . . . . 0.0 110.067 179.444 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.598 ' O ' HG22 ' A' ' 73' ' ' ILE . 19.8 t80 -74.2 -65.11 0.89 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.378 -0.826 . . . . 0.0 109.13 179.024 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -58.1 -25.5 61.42 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.784 -0.572 . . . . 0.0 111.115 -179.495 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.2 mmmt -91.83 -14.25 30.06 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.354 -0.841 . . . . 0.0 111.89 -179.102 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -111.84 -30.13 7.41 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.057 -1.027 . . . . 0.0 110.902 -179.624 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.598 HG22 ' O ' ' A' ' 69' ' ' TYR . 2.5 tp -66.99 -36.21 76.57 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.529 -0.732 . . . . 0.0 110.115 -179.787 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.02 -49.83 76.4 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.527 -0.733 . . . . 0.0 110.019 179.809 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.49 -17.87 60.0 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.656 -0.653 . . . . 0.0 110.377 179.453 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 62.2 t80 -77.6 -34.95 53.29 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.396 -0.815 . . . . 0.0 110.043 179.809 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 35.0 mtt180 -84.54 6.87 21.99 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.644 -0.66 . . . . 0.0 111.153 -179.98 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 51.12 88.5 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.08 -1.013 . . . . 0.0 110.982 179.844 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.79 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.191 179.897 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.1 ttt . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 121.124 0.488 . . . . 0.0 110.183 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.79 37.58 4.05 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.564 -0.71 . . . . 0.0 110.246 179.981 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 68.6 tttt -169.47 121.95 0.74 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.571 -0.706 . . . . 0.0 109.991 179.885 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 25.0 mtmm -61.25 -83.45 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.67 -0.644 . . . . 0.0 110.624 -179.55 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -138.6 163.86 43.97 Favored Pre-proline 0 N--CA 1.495 1.785 0 O-C-N 121.16 -0.963 . . . . 0.0 111.332 -179.339 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -73.01 -9.49 23.61 Favored 'Trans proline' 0 N--CA 1.49 1.277 0 O-C-N 123.709 1.373 . . . . 0.0 111.729 179.698 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -108.52 -25.3 11.0 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.377 -0.827 . . . . 0.0 109.751 179.264 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -95.25 140.87 22.58 Favored Pre-proline 0 N--CA 1.494 1.743 0 O-C-N 121.628 -0.67 . . . . 0.0 110.046 179.777 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.403 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 46.5 Cg_endo -74.99 124.48 8.66 Favored 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.28 1.147 . . . . 0.0 110.499 -179.816 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.3 pttt -70.82 -154.84 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.529 -0.732 . . . . 0.0 109.73 179.651 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.26 141.65 87.0 Favored Pre-proline 0 N--CA 1.498 1.956 0 O-C-N 121.374 -0.829 . . . . 0.0 109.806 179.661 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -74.1 133.39 17.97 Favored 'Trans proline' 0 C--N 1.318 -1.076 0 O-C-N 123.305 1.16 . . . . 0.0 110.321 -179.811 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.553 ' HB2' HD21 ' A' ' 18' ' ' LEU . 50.8 Cg_endo -80.94 173.7 11.71 Favored 'Trans proline' 0 C--N 1.319 -1.004 0 O-C-N 123.299 1.157 . . . . 0.0 109.903 179.909 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.562 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 37.2 t -170.53 62.9 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.44 -0.787 . . . . 0.0 110.868 -179.899 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.562 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 69.7 -76.31 0.06 Allowed 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.041 -1.037 . . . . 0.0 110.452 -179.62 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -47.67 -50.22 25.36 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.267 -0.896 . . . . 0.0 111.267 -179.463 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -58.73 -35.78 73.25 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.67 -0.643 . . . . 0.0 110.108 179.785 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.662 HD11 ' HB2' ' A' ' 62' ' ' ALA . 24.1 mt -74.4 -35.01 63.43 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.501 -0.749 . . . . 0.0 110.228 -179.581 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 19' ' ' PHE . . . . . 0.502 ' CE2' ' CZ ' ' A' ' 23' ' ' TYR . 54.9 t80 -74.28 -54.2 8.17 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.599 -0.688 . . . . 0.0 110.626 -179.373 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.458 ' SG ' HD13 ' A' ' 43' ' ' LEU . 1.8 t -59.54 -48.77 80.36 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.583 -0.698 . . . . 0.0 110.489 -179.744 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.7 t -58.63 -26.05 63.32 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.509 -0.744 . . . . 0.0 110.671 -179.694 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -99.13 -22.03 15.87 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.519 -0.738 . . . . 0.0 111.212 -179.316 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.502 ' CZ ' ' CE2' ' A' ' 19' ' ' PHE . 7.1 m-85 -92.68 -36.38 12.98 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.389 -0.819 . . . . 0.0 110.829 -179.466 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.49 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 9.6 mtt180 -47.59 -53.56 29.34 Favored Pre-proline 0 N--CA 1.499 1.986 0 O-C-N 121.38 -0.825 . . . . 0.0 112.215 -179.55 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.529 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.8 Cg_endo -60.64 -26.93 83.93 Favored 'Trans proline' 0 N--CA 1.494 1.544 0 O-C-N 123.198 1.104 . . . . 0.0 110.021 179.997 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.06 -47.13 63.25 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 177.726 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.463 HG22 ' HG ' ' A' ' 34' ' ' LEU . 46.5 mm -55.97 -22.7 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.328 179.551 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.716 ' NZ ' HD12 ' A' ' 34' ' ' LEU . 16.1 mmmt -82.74 -29.64 29.6 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.327 -0.858 . . . . 0.0 111.34 -176.717 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.9 t -72.91 -34.73 66.81 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.177 -0.952 . . . . 0.0 110.18 -179.627 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -97.67 -4.43 37.36 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.72 -0.612 . . . . 0.0 111.226 -179.258 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.454 ' CB ' ' HB2' ' A' ' 34' ' ' LEU . 27.8 m80 -140.08 96.46 8.14 Favored Pre-proline 0 N--CA 1.493 1.703 0 O-C-N 121.26 -0.9 . . . . 0.0 108.698 179.016 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -75.03 -47.36 0.2 Allowed 'Trans proline' 0 C--N 1.315 -1.205 0 O-C-N 123.481 1.253 . . . . 0.0 110.662 -179.306 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.59 -20.59 63.92 Favored Glycine 0 N--CA 1.494 2.513 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 179.03 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.716 HD12 ' NZ ' ' A' ' 28' ' ' LYS . 0.2 OUTLIER -48.01 92.22 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.471 -1.017 . . . . 0.0 111.705 -179.769 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.8 m -66.89 -179.3 0.88 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.497 -0.752 . . . . 0.0 109.461 179.3 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.421 HD13 ' HA ' ' A' ' 36' ' ' ILE . 17.8 mm -60.78 -56.39 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.382 -0.824 . . . . 0.0 109.843 179.946 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.43 ' O ' ' HE2' ' A' ' 41' ' ' LYS . . . -49.89 -43.41 39.48 Favored Glycine 0 N--CA 1.497 2.754 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 -179.018 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.637 ' HB2' HD13 ' A' ' 34' ' ' LEU . 40.5 m-20 -61.5 -36.17 79.73 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.636 -0.92 . . . . 0.0 109.993 178.949 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.52 ' O ' HD12 ' A' ' 43' ' ' LEU . 10.9 m -60.08 -36.9 78.4 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.28 -0.887 . . . . 0.0 110.785 179.573 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.54 -54.02 6.91 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.624 -0.673 . . . . 0.0 110.357 -179.695 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.43 ' HE2' ' O ' ' A' ' 37' ' ' GLY . 1.8 ptpm? -67.39 -28.34 67.84 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.63 -0.669 . . . . 0.0 111.458 -179.23 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.486 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -81.5 -2.01 48.18 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.911 -1.118 . . . . 0.0 110.916 179.697 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.52 HD12 ' O ' ' A' ' 39' ' ' THR . 26.2 mt -106.6 -34.12 7.44 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.203 -0.935 . . . . 0.0 110.174 -179.904 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.5 -40.93 96.45 Favored Glycine 0 N--CA 1.494 2.504 0 N-CA-C 109.885 -1.286 . . . . 0.0 109.885 -179.653 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -55.88 -34.12 65.22 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.544 -0.974 . . . . 0.0 110.732 -179.628 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 47.1 mmm -80.65 -46.88 14.91 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.542 -0.724 . . . . 0.0 110.358 -179.876 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 74.2 t-105 -56.76 -22.11 33.3 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.53 -0.731 . . . . 0.0 110.989 -179.621 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 16.5 t -91.83 -35.52 14.04 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.269 -0.894 . . . . 0.0 110.231 179.976 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -65.02 -34.66 78.97 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.551 -0.718 . . . . 0.0 110.041 179.89 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 63.2 mm-40 -59.01 150.58 24.27 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.556 -0.715 . . . . 0.0 110.417 179.999 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 10.5 t -89.91 -151.53 0.24 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.637 -0.665 . . . . 0.0 109.545 179.744 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -85.74 53.6 2.83 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.258 -0.901 . . . . 0.0 110.192 179.849 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 67.4 mttt -132.17 -43.16 0.96 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.438 -0.789 . . . . 0.0 110.208 179.97 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -59.61 -31.42 69.47 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.488 -0.757 . . . . 0.0 110.626 -179.673 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 69.8 tttt -101.0 25.54 7.96 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.467 -0.771 . . . . 0.0 110.964 -179.503 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.434 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 1.7 mm-40 -97.64 -53.43 0.21 Allowed Pre-proline 0 N--CA 1.496 1.842 0 O-C-N 121.213 -0.929 . . . . 0.0 110.786 -179.836 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.434 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.6 Cg_endo -85.11 -31.86 0.35 Allowed 'Trans proline' 0 C--N 1.321 -0.908 0 O-C-N 122.92 0.958 . . . . 0.0 111.33 -179.634 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.34 -11.63 57.46 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.417 -0.802 . . . . 0.0 111.775 -178.579 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.556 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.5 OUTLIER -79.22 -26.71 42.49 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.075 -1.016 . . . . 0.0 110.856 -179.421 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -76.12 -20.06 57.97 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.487 -0.758 . . . . 0.0 110.871 -179.9 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 36.7 tttt -65.02 -44.23 89.83 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.387 -0.821 . . . . 0.0 110.109 179.977 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.662 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -82.44 -15.51 52.33 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.51 -0.744 . . . . 0.0 110.11 179.283 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.36 -28.17 67.98 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.29 -0.881 . . . . 0.0 109.362 178.923 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -81.5 -64.99 1.07 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.61 -0.681 . . . . 0.0 109.472 179.175 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.511 ' H ' HD12 ' A' ' 65' ' ' LEU . 3.8 mp -50.65 -24.23 3.17 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.573 -0.704 . . . . 0.0 111.318 -179.732 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.3 tttt -63.18 -53.07 59.0 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.443 -0.785 . . . . 0.0 109.663 179.292 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -62.51 -48.78 78.07 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.682 -0.636 . . . . 0.0 110.25 -179.996 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 24.2 mmtp -60.32 -27.18 67.13 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.543 -0.723 . . . . 0.0 110.466 -179.674 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.48 ' O ' HG22 ' A' ' 73' ' ' ILE . 3.7 m-85 -80.72 -64.69 1.13 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.518 -0.739 . . . . 0.0 109.894 179.845 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -50.56 -35.2 28.69 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.5 -0.75 . . . . 0.0 111.163 -179.697 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 41.5 mmtt -76.11 -50.82 13.62 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.546 -0.721 . . . . 0.0 110.778 -179.754 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -74.52 -23.91 58.89 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.45 -0.781 . . . . 0.0 111.302 -179.103 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 73' ' ' ILE . . . . . 0.48 HG22 ' O ' ' A' ' 69' ' ' TYR . 9.1 tp -80.37 -37.8 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.266 -0.896 . . . . 0.0 109.904 -179.983 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -41.57 -34.53 0.59 Allowed 'General case' 0 N--CA 1.509 2.494 0 CA-C-O 121.164 0.507 . . . . 0.0 111.371 -179.499 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.82 -49.93 64.23 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 178.208 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -70.95 -59.88 2.54 Favored 'General case' 0 N--CA 1.494 1.736 0 CA-C-O 121.437 0.637 . . . . 0.0 109.614 178.901 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.25 -57.49 12.81 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.863 -0.523 . . . . 0.0 110.238 179.917 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 56.19 65.34 1.46 Allowed 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.438 -0.789 . . . . 0.0 110.395 -179.881 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.496 1.859 0 CA-C-O 118.083 -0.96 . . . . 0.0 110.235 179.996 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.2 ttt . . . . . 0 N--CA 1.491 1.625 0 CA-C-O 121.111 0.481 . . . . 0.0 110.224 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -98.43 95.97 7.69 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.563 -0.711 . . . . 0.0 110.186 179.977 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 31.6 ttmt -170.08 71.28 0.06 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.556 -0.715 . . . . 0.0 110.159 179.867 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 50.8 mtpt -60.17 -59.58 5.19 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.453 -0.779 . . . . 0.0 110.319 -179.897 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.714 ' HB2' ' HB2' ' A' ' 8' ' ' ALA . 1.6 m-20 -162.57 163.16 18.42 Favored Pre-proline 0 N--CA 1.493 1.724 0 O-C-N 121.604 -0.685 . . . . 0.0 110.211 -179.908 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -73.01 -47.18 0.33 Allowed 'Trans proline' 0 C--N 1.317 -1.091 0 O-C-N 123.399 1.21 . . . . 0.0 110.468 179.984 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -93.45 25.83 3.26 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.622 -0.674 . . . . 0.0 110.856 -179.705 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.714 ' HB2' ' HB2' ' A' ' 5' ' ' ASP . . . -96.86 131.58 27.63 Favored Pre-proline 0 N--CA 1.493 1.71 0 O-C-N 121.405 -0.81 . . . . 0.0 109.863 179.683 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.426 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 48.6 Cg_endo -73.13 79.78 1.99 Allowed 'Trans proline' 0 N--CA 1.485 1.001 0 O-C-N 123.145 1.076 . . . . 0.0 110.725 -179.755 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -108.2 26.27 10.62 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.585 -0.697 . . . . 0.0 110.784 179.815 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -163.27 95.62 1.08 Allowed Pre-proline 0 N--CA 1.494 1.767 0 O-C-N 121.702 -0.624 . . . . 0.0 110.16 -179.906 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -75.56 114.77 4.04 Favored 'Trans proline' 0 C--N 1.316 -1.14 0 O-C-N 123.352 1.185 . . . . 0.0 110.66 -179.843 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.579 ' HB2' HD21 ' A' ' 18' ' ' LEU . 47.4 Cg_endo -81.23 157.57 19.93 Favored 'Trans proline' 0 C--N 1.319 -1.013 0 O-C-N 123.303 1.159 . . . . 0.0 110.026 179.779 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.537 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 32.6 t -151.82 55.78 0.84 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.467 -0.771 . . . . 0.0 110.91 -179.625 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.537 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 67.87 -74.94 0.07 Allowed 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.194 -0.942 . . . . 0.0 110.152 -179.65 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -47.77 -51.26 23.06 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.416 -0.802 . . . . 0.0 111.402 -179.605 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -57.82 -41.67 82.73 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.455 -0.778 . . . . 0.0 109.743 179.548 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.639 HD11 ' HB2' ' A' ' 62' ' ' ALA . 61.9 mt -59.73 -46.65 88.46 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.576 -0.703 . . . . 0.0 109.947 179.9 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -69.67 -51.33 35.64 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.679 -0.638 . . . . 0.0 110.284 -179.729 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.5 m -56.24 -54.33 46.56 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.54 -0.725 . . . . 0.0 110.787 -179.658 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 34.7 t -57.94 -30.75 66.22 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.358 -0.839 . . . . 0.0 110.539 -179.807 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 -86.66 -29.42 22.51 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.534 -0.729 . . . . 0.0 110.721 -179.651 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -99.62 9.76 42.57 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.35 -0.844 . . . . 0.0 111.519 -179.401 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.516 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 3.6 mtt180 -79.75 -50.12 1.27 Allowed Pre-proline 0 N--CA 1.49 1.567 0 O-C-N 121.222 -0.924 . . . . 0.0 111.522 179.453 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.567 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 37.5 Cg_endo -63.74 -15.61 49.88 Favored 'Trans proline' 0 N--CA 1.491 1.362 0 O-C-N 122.918 0.957 . . . . 0.0 110.609 -179.631 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 9.1 tmtt? -72.69 -49.84 28.79 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 177.93 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.534 ' CG1' HD21 ' A' ' 43' ' ' LEU . 16.2 mm -55.65 -38.11 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 CA-C-O 121.51 0.671 . . . . 0.0 110.204 179.804 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.567 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 4.2 mmmm -68.15 -40.93 82.27 Favored 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.183 -177.101 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.4 t -58.04 -24.08 56.93 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.398 -0.814 . . . . 0.0 110.88 -179.527 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -114.32 -23.6 9.32 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.478 -0.764 . . . . 0.0 110.686 -179.679 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.771 ' HB3' HD23 ' A' ' 34' ' ' LEU . 53.8 m80 -119.67 96.79 49.79 Favored Pre-proline 0 N--CA 1.494 1.75 0 O-C-N 121.483 -0.761 . . . . 0.0 109.519 -179.783 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -75.08 -27.94 9.45 Favored 'Trans proline' 0 C--N 1.314 -1.28 0 O-C-N 123.525 1.276 . . . . 0.0 110.542 -179.855 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -85.72 -11.34 74.37 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 110.449 -1.06 . . . . 0.0 110.449 179.951 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.771 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -62.18 81.72 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.282 -1.128 . . . . 0.0 110.747 -179.608 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.5 m -70.98 171.0 11.58 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.407 -0.808 . . . . 0.0 109.904 -179.977 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 38.6 mm -51.76 -29.55 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.175 0 O-C-N 121.262 -0.899 . . . . 0.0 110.315 179.976 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.35 -69.06 1.39 Allowed Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.31 -1.516 . . . . 0.0 109.31 179.802 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.651 ' HB3' HD13 ' A' ' 34' ' ' LEU . 13.7 t70 -67.26 -28.5 68.09 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.591 -0.946 . . . . 0.0 110.698 179.723 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 85.3 m -65.26 -27.8 68.9 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.344 -0.848 . . . . 0.0 110.131 179.775 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.59 -47.27 19.83 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.44 -0.788 . . . . 0.0 109.948 179.76 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -82.57 -12.37 57.77 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.602 -0.686 . . . . 0.0 111.578 -179.603 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.1 OUTLIER -78.85 -60.5 2.35 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.985 -1.072 . . . . 0.0 109.641 179.55 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.534 HD21 ' CG1' ' A' ' 27' ' ' ILE . 52.7 mt -50.96 -25.17 4.32 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.428 -0.795 . . . . 0.0 111.07 -179.873 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.47 -40.43 91.18 Favored Glycine 0 N--CA 1.493 2.435 0 N-CA-C 109.173 -1.571 . . . . 0.0 109.173 179.553 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -54.98 -37.34 66.41 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.507 -0.996 . . . . 0.0 110.676 -179.875 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 10.9 mmt -70.4 -53.09 17.94 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.531 -0.73 . . . . 0.0 109.988 179.872 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 47' ' ' TRP . . . . . 0.409 ' CH2' ' HB3' ' A' ' 55' ' ' LYS . 63.9 t-105 -49.47 -54.58 16.95 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.475 -0.765 . . . . 0.0 111.115 -179.677 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 26.6 t -57.44 -36.56 71.54 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.376 -0.828 . . . . 0.0 110.304 179.993 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -63.82 -41.41 97.86 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.544 -0.722 . . . . 0.0 109.743 179.69 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -60.14 156.76 14.45 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.583 -0.698 . . . . 0.0 110.268 179.814 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.0 m -100.52 -151.93 0.41 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.681 -0.637 . . . . 0.0 109.395 179.485 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.42 51.15 2.15 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.329 -0.857 . . . . 0.0 109.993 179.613 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 42.1 mtmt -130.46 -49.92 1.08 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.431 -0.793 . . . . 0.0 110.523 -179.84 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -70.83 -16.37 62.72 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.553 -0.717 . . . . 0.0 111.481 -179.102 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.414 ' HG3' ' N ' ' A' ' 56' ' ' GLN . 32.2 pttt -107.07 -37.31 6.34 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.152 -0.967 . . . . 0.0 111.116 -179.592 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.414 ' N ' ' HG3' ' A' ' 55' ' ' LYS . 5.9 mm100 -42.87 -56.52 6.02 Favored Pre-proline 0 N--CA 1.508 2.444 0 O-C-N 121.402 -0.811 . . . . 0.0 112.438 -178.847 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.403 ' CD ' ' CB ' ' A' ' 56' ' ' GLN . 48.6 Cg_endo -72.52 -34.15 7.74 Favored 'Trans proline' 0 C--N 1.316 -1.172 0 O-C-N 123.061 1.032 . . . . 0.0 109.891 179.624 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -75.66 -8.16 56.11 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.647 -0.658 . . . . 0.0 110.667 179.818 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.422 ' OE1' ' HB2' ' A' ' 15' ' ' ALA . 5.6 mm-40 -77.49 -58.39 3.3 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.18 -0.95 . . . . 0.0 109.96 179.776 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.401 ' HG3' ' N ' ' A' ' 61' ' ' LYS . 11.1 pt20 -47.75 -28.2 2.38 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.697 -0.627 . . . . 0.0 111.535 -179.413 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.401 ' N ' ' HG3' ' A' ' 60' ' ' GLN . 70.1 tttt -60.35 -50.35 73.97 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.319 -0.863 . . . . 0.0 109.886 179.648 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.639 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -72.64 -8.25 54.35 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.654 -0.654 . . . . 0.0 110.575 179.426 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.58 0.3 52.93 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.175 -0.953 . . . . 0.0 110.215 178.895 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 48.8 mmtt -105.28 -29.34 10.36 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.105 -0.997 . . . . 0.0 109.695 179.398 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.5 mp -88.47 -9.72 51.53 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.78 -0.575 . . . . 0.0 110.157 178.758 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.3 tptm -81.53 -31.17 32.88 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.3 -0.875 . . . . 0.0 109.204 179.154 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -67.89 -61.34 1.92 Allowed 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 120.114 -0.634 . . . . 0.0 109.359 179.411 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.9 mtpp -57.59 -23.9 53.35 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.573 -0.705 . . . . 0.0 110.72 179.887 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.426 ' CD2' ' HB2' ' A' ' 9' ' ' PRO . 23.9 t80 -74.22 -60.28 2.34 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.263 -0.898 . . . . 0.0 109.857 179.662 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -80.2 -17.81 51.32 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.698 -0.627 . . . . 0.0 112.046 -178.723 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.0 ttmm -98.93 -23.76 15.2 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.102 -0.999 . . . . 0.0 112.052 -178.621 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -102.25 -31.98 10.28 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.151 -0.968 . . . . 0.0 111.457 -179.149 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.9 tp -55.55 -33.86 33.77 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.13 0 O-C-N 121.242 -0.911 . . . . 0.0 110.666 -179.492 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.88 -55.34 34.18 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.476 -0.765 . . . . 0.0 109.148 179.275 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.3 -38.08 89.74 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 178.045 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.415 ' O ' ' N ' ' A' ' 78' ' ' ALA . 2.6 t80 -73.85 -150.2 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 178.43 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.421 ' O ' ' HB3' ' A' ' 78' ' ' ALA . 0.6 OUTLIER 66.91 -61.87 0.32 Allowed 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.307 -0.87 . . . . 0.0 109.807 179.476 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.421 ' HB3' ' O ' ' A' ' 77' ' ' ARG . . . 59.41 47.75 10.78 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.856 -0.528 . . . . 0.0 110.136 -179.592 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 16.7 mttm . . . . . 0 N--CA 1.494 1.725 0 CA-C-O 118.052 -0.975 . . . . 0.0 110.115 179.998 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo . . . . . 0 N--CA 1.483 0.902 0 N-CA-C 110.568 -0.589 . . . . 0.0 110.568 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.8 mtpt -56.07 -171.57 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.662 -0.649 . . . . 0.0 110.711 -179.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.2 mtt85 -56.64 139.46 75.94 Favored Pre-proline 0 N--CA 1.498 1.933 0 O-C-N 121.412 -0.805 . . . . 0.0 110.456 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.422 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 50.0 Cg_endo -77.03 133.27 13.48 Favored 'Trans proline' 0 C--N 1.318 -1.039 0 O-C-N 123.382 1.201 . . . . 0.0 110.252 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.78 ' CG ' HD21 ' A' ' 18' ' ' LEU . 50.3 Cg_endo -82.42 -162.5 0.18 Allowed 'Trans proline' 0 C--N 1.319 -0.993 0 O-C-N 123.236 1.124 . . . . 0.0 109.903 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.539 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 31.0 t -165.82 63.52 0.11 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.445 -0.784 . . . . 0.0 110.458 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.539 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 67.63 -75.54 0.06 Allowed 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.21 -0.931 . . . . 0.0 109.958 -179.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -47.19 -50.48 20.71 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.424 -0.798 . . . . 0.0 111.386 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -59.18 -39.53 82.82 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.614 -0.679 . . . . 0.0 109.746 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.78 HD21 ' CG ' ' A' ' 13' ' ' PRO . 45.0 mt -65.94 -37.19 85.39 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.594 -0.691 . . . . 0.0 109.891 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.492 ' CE2' ' CZ ' ' A' ' 23' ' ' TYR . 28.0 t80 -77.37 -54.06 6.91 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.634 -0.666 . . . . 0.0 110.654 -179.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 14.6 t -56.91 -53.07 62.14 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.459 -0.776 . . . . 0.0 110.707 -179.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 82.7 p -57.77 -25.4 60.44 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.577 -0.702 . . . . 0.0 110.859 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -96.55 -26.44 15.26 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.378 -0.826 . . . . 0.0 111.143 -179.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.492 ' CZ ' ' CE2' ' A' ' 19' ' ' PHE . 6.2 m-85 -88.5 -34.66 17.35 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.322 -0.861 . . . . 0.0 110.96 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.521 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 25.5 mtt180 -48.18 -52.83 38.61 Favored Pre-proline 0 N--CA 1.498 1.947 0 O-C-N 121.338 -0.851 . . . . 0.0 112.12 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.564 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.3 Cg_endo -59.64 -27.62 85.4 Favored 'Trans proline' 0 N--CA 1.494 1.541 0 O-C-N 123.184 1.097 . . . . 0.0 110.233 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.9 tmtt? -69.76 -45.9 67.02 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.1 mm -57.77 -31.59 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.246 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.564 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 4.8 mmmm -71.26 -36.23 71.67 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 120.004 -0.678 . . . . 0.0 110.427 -177.283 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 39.7 t -63.09 -23.38 67.42 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.393 -0.817 . . . . 0.0 110.8 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -117.14 -18.87 9.9 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.447 -0.783 . . . . 0.0 111.122 -179.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.701 ' HB3' HD23 ' A' ' 34' ' ' LEU . 52.0 m80 -123.25 96.1 44.74 Favored Pre-proline 0 N--CA 1.496 1.85 0 O-C-N 121.374 -0.829 . . . . 0.0 109.676 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -74.87 -36.73 2.49 Favored 'Trans proline' 0 C--N 1.316 -1.171 0 O-C-N 123.461 1.242 . . . . 0.0 110.303 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.403 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -74.37 -16.89 79.73 Favored Glycine 0 N--CA 1.49 2.261 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.701 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -59.74 80.17 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.529 -0.983 . . . . 0.0 111.335 -179.354 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.403 ' N ' ' O ' ' A' ' 33' ' ' GLY . 75.8 p -74.57 173.0 11.01 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.311 -0.868 . . . . 0.0 109.521 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 40.4 mm -52.13 -30.39 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.173 0 O-C-N 121.322 -0.862 . . . . 0.0 110.399 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.22 -68.81 1.5 Allowed Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.338 -1.505 . . . . 0.0 109.338 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.428 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 0.4 OUTLIER -67.82 -28.59 67.7 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.686 -0.891 . . . . 0.0 110.655 179.745 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 78.4 m -66.45 -29.75 69.95 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.297 -0.877 . . . . 0.0 110.014 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.53 -46.09 34.21 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.592 -0.692 . . . . 0.0 109.87 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.86 -13.01 54.69 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.621 -0.674 . . . . 0.0 111.774 -179.446 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.428 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 3.7 tppt? -77.46 -59.58 2.72 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 120.986 -1.071 . . . . 0.0 109.825 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.508 HD22 ' HG3' ' A' ' 24' ' ' ARG . 1.2 mp -53.33 -28.88 30.88 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.419 -0.801 . . . . 0.0 110.578 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -71.24 -44.57 52.57 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.114 -1.595 . . . . 0.0 109.114 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -55.31 -33.63 63.47 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.605 -0.938 . . . . 0.0 110.532 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 65.5 mmm -76.81 -49.62 15.4 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.634 -0.666 . . . . 0.0 109.564 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 70.1 t-105 -50.37 -53.02 32.24 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.563 -0.711 . . . . 0.0 110.964 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.4 t -62.74 -34.6 77.55 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.46 -0.775 . . . . 0.0 110.129 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -63.9 -39.72 94.83 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.558 -0.714 . . . . 0.0 110.141 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -57.54 157.52 6.84 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.602 -0.686 . . . . 0.0 110.594 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 17.5 t -88.51 -148.91 0.17 Allowed 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -89.31 47.58 1.5 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.154 -0.967 . . . . 0.0 110.257 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 40.7 mttp -126.94 -42.51 1.74 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.464 -0.772 . . . . 0.0 110.095 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -54.9 -26.64 37.17 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.42 -0.8 . . . . 0.0 110.926 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 40.9 tttm -107.29 26.85 9.68 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.43 -0.794 . . . . 0.0 110.963 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.432 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 3.9 mm-40 -99.91 -55.24 0.16 Allowed Pre-proline 0 N--CA 1.497 1.897 0 O-C-N 121.338 -0.851 . . . . 0.0 110.966 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.432 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.1 Cg_endo -83.37 -37.2 0.18 Allowed 'Trans proline' 0 C--N 1.322 -0.851 0 O-C-N 122.935 0.966 . . . . 0.0 110.692 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -80.51 4.9 16.79 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.523 -0.735 . . . . 0.0 111.579 -179.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.07 -19.98 18.33 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.178 -0.951 . . . . 0.0 110.567 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -77.48 -24.63 50.11 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.46 -0.775 . . . . 0.0 110.267 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.431 ' HD3' HD13 ' A' ' 18' ' ' LEU . 35.1 tttt -60.76 -41.52 95.64 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.482 -0.761 . . . . 0.0 109.863 179.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.1 -10.41 59.74 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.564 -0.71 . . . . 0.0 110.939 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -98.01 4.3 49.34 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.246 -0.908 . . . . 0.0 110.83 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.66 -40.7 5.67 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.126 -0.984 . . . . 0.0 109.787 179.569 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.746 HD11 ' HD2' ' A' ' 13' ' ' PRO . 3.4 pp -78.88 -0.16 29.64 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.831 -0.543 . . . . 0.0 110.737 179.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.0 ttpt -92.55 -21.06 20.32 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.243 -0.911 . . . . 0.0 109.871 179.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -83.29 -12.42 56.7 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.46 -0.775 . . . . 0.0 110.196 178.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -105.31 -30.39 9.67 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.327 -0.858 . . . . 0.0 109.347 178.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.67 ' O ' HG22 ' A' ' 73' ' ' ILE . 4.4 t80 -74.8 -53.59 8.88 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.716 -0.615 . . . . 0.0 109.577 179.435 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -56.44 -19.43 15.08 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.614 -0.679 . . . . 0.0 111.405 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.8 mttt -105.95 -29.0 10.24 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.262 -0.899 . . . . 0.0 110.802 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -86.7 -39.57 15.9 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.466 -0.771 . . . . 0.0 111.099 -179.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.67 HG22 ' O ' ' A' ' 69' ' ' TYR . 6.6 tp . . . . . 0 N--CA 1.497 1.888 0 O-C-N 121.378 -0.826 . . . . 0.0 110.919 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.416 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 50.0 Cg_endo . . . . . 0 N--CA 1.485 1.004 0 N-CA-C 110.578 -0.585 . . . . 0.0 110.578 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.02 -168.25 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.494 -0.754 . . . . 0.0 110.016 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -60.15 137.21 91.32 Favored Pre-proline 0 N--CA 1.498 1.936 0 O-C-N 121.447 -0.783 . . . . 0.0 110.208 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -76.5 136.21 17.21 Favored 'Trans proline' 0 C--N 1.318 -1.063 0 O-C-N 123.36 1.19 . . . . 0.0 109.808 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.661 ' CB ' HD21 ' A' ' 18' ' ' LEU . 49.4 Cg_endo -79.94 -169.84 0.88 Allowed 'Trans proline' 0 C--N 1.317 -1.107 0 O-C-N 123.28 1.147 . . . . 0.0 110.213 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.495 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 1.0 OUTLIER -163.22 61.33 0.18 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.491 -0.756 . . . . 0.0 110.773 -179.787 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.495 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 65.77 -78.88 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.166 -0.959 . . . . 0.0 110.64 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -46.02 -52.26 12.15 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.237 -0.915 . . . . 0.0 111.729 -179.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -57.42 -33.75 68.22 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.499 -0.75 . . . . 0.0 110.131 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.661 HD21 ' CB ' ' A' ' 13' ' ' PRO . 47.8 mt -70.48 -38.3 74.37 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.613 -0.679 . . . . 0.0 110.204 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.497 ' CE2' ' CE1' ' A' ' 23' ' ' TYR . 52.7 t80 -77.21 -54.91 5.91 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.688 -0.632 . . . . 0.0 110.478 -179.537 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -56.81 -53.06 62.13 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.572 -0.705 . . . . 0.0 110.505 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.7 t -59.49 -17.99 36.23 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.578 -0.702 . . . . 0.0 111.131 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -107.89 -11.73 15.3 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.25 -0.906 . . . . 0.0 111.663 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.497 ' CE1' ' CE2' ' A' ' 19' ' ' PHE . 2.5 m-85 -100.35 -33.9 10.2 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.065 -1.022 . . . . 0.0 110.869 -179.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.523 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 27.7 mtt180 -47.8 -51.7 44.44 Favored Pre-proline 0 N--CA 1.498 1.943 0 O-C-N 121.31 -0.869 . . . . 0.0 112.3 -179.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.567 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.3 Cg_endo -60.43 -26.23 82.26 Favored 'Trans proline' 0 N--CA 1.494 1.539 0 O-C-N 123.252 1.133 . . . . 0.0 110.343 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.2 tmtt? -70.31 -45.38 66.35 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 178.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 47.8 mm -58.83 -28.79 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 CA-C-O 121.173 0.511 . . . . 0.0 110.309 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.567 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.7 mmmm -73.27 -33.65 65.36 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.593 -0.692 . . . . 0.0 110.547 -177.247 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 13.1 t -67.69 -23.53 65.31 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.397 -0.814 . . . . 0.0 110.636 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -116.09 -14.42 11.18 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.414 -0.804 . . . . 0.0 111.247 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.671 ' HB3' HD23 ' A' ' 34' ' ' LEU . 44.4 m80 -130.62 94.7 28.54 Favored Pre-proline 0 N--CA 1.496 1.834 0 O-C-N 121.301 -0.874 . . . . 0.0 109.376 179.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -74.95 -38.72 1.49 Allowed 'Trans proline' 0 C--N 1.315 -1.192 0 O-C-N 123.465 1.245 . . . . 0.0 110.401 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.416 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -71.99 -22.57 78.74 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 109.864 -1.294 . . . . 0.0 109.864 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.671 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -52.07 86.79 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.627 -0.925 . . . . 0.0 111.775 -179.312 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.416 ' N ' ' O ' ' A' ' 33' ' ' GLY . 17.2 m -76.27 172.06 13.5 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.513 -0.742 . . . . 0.0 109.653 179.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 44.9 mm -56.87 -27.49 26.45 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.975 0 O-C-N 121.407 -0.808 . . . . 0.0 110.095 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.32 -63.78 4.72 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.412 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 17.7 t70 -74.07 -32.35 63.24 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.574 -0.956 . . . . 0.0 110.61 179.796 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.44 ' OG1' HD12 ' A' ' 34' ' ' LEU . 89.8 m -66.34 -33.86 76.68 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.304 -0.872 . . . . 0.0 110.162 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.1 -31.65 68.06 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.629 -0.669 . . . . 0.0 109.956 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -102.2 -8.05 21.65 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.604 -0.685 . . . . 0.0 111.543 -179.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.1 OUTLIER -87.38 3.64 46.19 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.001 -1.062 . . . . 0.0 110.203 179.062 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.8 mt -102.21 -33.87 9.47 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.023 -1.048 . . . . 0.0 109.493 179.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -68.48 -31.0 73.3 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.427 -1.469 . . . . 0.0 109.427 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -56.93 -45.8 82.49 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.501 -0.999 . . . . 0.0 110.241 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 25.8 mtt -77.25 -49.6 14.71 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.642 -0.661 . . . . 0.0 109.646 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 73.3 t-105 -54.93 -22.14 14.02 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.613 -0.679 . . . . 0.0 110.879 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.0 p -88.87 -35.26 16.65 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.322 -0.861 . . . . 0.0 109.885 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.13 -34.98 77.39 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.629 -0.669 . . . . 0.0 109.821 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 87.3 mm-40 -63.08 157.6 21.77 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.59 -0.694 . . . . 0.0 109.809 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.2 m -147.33 103.65 3.58 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.514 -0.741 . . . . 0.0 110.339 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 52.95 51.95 14.84 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.472 -0.768 . . . . 0.0 110.994 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.6 tppt? -150.77 -69.77 0.18 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.498 -0.751 . . . . 0.0 109.939 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -64.39 -36.31 83.74 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.353 -0.842 . . . . 0.0 110.437 -179.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -93.28 19.44 8.16 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.436 -0.79 . . . . 0.0 111.358 -179.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.402 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 4.3 mt-30 -92.23 -52.13 0.28 Allowed Pre-proline 0 N--CA 1.496 1.831 0 O-C-N 121.398 -0.814 . . . . 0.0 110.415 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.402 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 55.8 Cg_endo -83.23 -28.53 1.47 Allowed 'Trans proline' 0 C--N 1.319 -0.975 0 O-C-N 123.074 1.039 . . . . 0.0 110.275 179.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -84.28 1.83 42.98 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.543 -0.723 . . . . 0.0 111.649 -179.051 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.07 -24.65 16.23 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.082 -1.012 . . . . 0.0 110.704 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -75.87 -21.42 57.21 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.413 -0.804 . . . . 0.0 110.217 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 20.0 tttp -59.93 -44.66 94.22 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.46 -0.775 . . . . 0.0 109.932 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.68 -10.41 59.33 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.532 -0.73 . . . . 0.0 110.511 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.09 5.38 37.97 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.235 -0.916 . . . . 0.0 110.383 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 19.9 mmmt -105.48 -33.13 8.23 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.246 -0.909 . . . . 0.0 109.334 179.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.7 mp -80.03 2.87 22.11 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.881 -0.512 . . . . 0.0 111.052 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -95.92 -26.0 15.76 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.081 -1.012 . . . . 0.0 110.009 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -84.88 -15.13 45.68 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.545 -0.722 . . . . 0.0 110.588 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -103.19 -28.83 11.68 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.38 -0.825 . . . . 0.0 109.715 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.453 ' O ' HG22 ' A' ' 73' ' ' ILE . 20.6 t80 -74.61 -53.47 9.3 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.752 -0.593 . . . . 0.0 109.868 179.653 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -68.78 -9.63 51.99 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.737 -0.602 . . . . 0.0 111.587 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 38.5 mttm -104.29 -31.81 9.39 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.143 -0.973 . . . . 0.0 110.779 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -93.99 -28.68 15.64 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.494 -0.754 . . . . 0.0 111.136 -179.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.453 HG22 ' O ' ' A' ' 69' ' ' TYR . 3.5 tp . . . . . 0 N--CA 1.497 1.877 0 O-C-N 121.426 -0.796 . . . . 0.0 110.917 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo . . . . . 0 N--CA 1.483 0.857 0 N-CA-C 110.412 -0.649 . . . . 0.0 110.412 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.3 pttt -59.93 -163.65 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.615 -0.678 . . . . 0.0 110.363 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -64.3 141.05 98.09 Favored Pre-proline 0 N--CA 1.496 1.837 0 O-C-N 121.543 -0.723 . . . . 0.0 110.236 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -75.66 132.11 14.24 Favored 'Trans proline' 0 C--N 1.318 -1.063 0 O-C-N 123.26 1.137 . . . . 0.0 109.852 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.691 ' CB ' HD21 ' A' ' 18' ' ' LEU . 49.2 Cg_endo -81.23 -171.2 1.17 Allowed 'Trans proline' 0 C--N 1.317 -1.116 0 O-C-N 123.237 1.125 . . . . 0.0 110.352 -179.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.498 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 32.1 t -166.32 63.02 0.1 Allowed 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.524 -0.735 . . . . 0.0 110.582 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 65.75 -79.0 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.173 -0.954 . . . . 0.0 110.329 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.5 ' CE2' ' CD1' ' A' ' 47' ' ' TRP . 2.8 t80 -47.56 -49.07 27.39 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.217 -0.927 . . . . 0.0 111.403 -179.421 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -58.01 -30.25 65.95 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.658 -0.651 . . . . 0.0 110.074 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.691 HD21 ' CB ' ' A' ' 13' ' ' PRO . 36.0 mt -79.04 -31.76 44.7 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.48 -0.763 . . . . 0.0 110.489 -179.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.5 ' CE1' ' CZ ' ' A' ' 23' ' ' TYR . 59.4 t80 -79.2 -55.04 5.39 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.518 -0.739 . . . . 0.0 110.669 -179.349 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.438 ' SG ' HD13 ' A' ' 43' ' ' LEU . 5.7 t -56.7 -54.63 43.98 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.406 -0.809 . . . . 0.0 110.581 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 84.2 p -55.88 -21.52 20.54 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.444 -0.785 . . . . 0.0 110.967 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.5 mm-40 -101.23 -24.87 14.17 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.398 -0.814 . . . . 0.0 110.828 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.5 ' CZ ' ' CE1' ' A' ' 19' ' ' PHE . 8.0 m-85 -95.58 11.83 31.79 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.43 -0.794 . . . . 0.0 111.456 -179.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.524 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 4.5 mtt180 -87.1 -45.13 0.53 Allowed Pre-proline 0 N--CA 1.488 1.454 0 O-C-N 121.173 -0.955 . . . . 0.0 112.263 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.598 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.0 Cg_endo -66.76 -16.93 51.67 Favored 'Trans proline' 0 N--CA 1.49 1.275 0 O-C-N 122.899 0.947 . . . . 0.0 110.449 -179.203 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.8 tmtt? -71.69 -48.74 45.37 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 178.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 26.9 mm -56.67 -33.38 40.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 CA-C-O 121.376 0.608 . . . . 0.0 110.315 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.598 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 4.6 mmmm -72.1 -38.42 69.35 Favored 'General case' 0 N--CA 1.497 1.92 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.337 -177.072 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.7 t -57.81 -26.29 61.77 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.401 -0.812 . . . . 0.0 110.693 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -114.92 -22.68 9.48 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.53 -0.731 . . . . 0.0 110.721 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.741 ' HB3' HD23 ' A' ' 34' ' ' LEU . 36.5 m80 -122.1 95.7 47.17 Favored Pre-proline 0 N--CA 1.496 1.86 0 O-C-N 121.393 -0.817 . . . . 0.0 109.649 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -75.29 -36.2 2.51 Favored 'Trans proline' 0 C--N 1.316 -1.155 0 O-C-N 123.418 1.22 . . . . 0.0 110.346 -179.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.403 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -75.5 -17.87 80.02 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 110.203 -1.159 . . . . 0.0 110.203 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.741 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -55.79 86.99 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.253 0 O-C-N 121.563 -0.963 . . . . 0.0 111.191 -179.469 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.403 ' N ' ' O ' ' A' ' 33' ' ' GLY . 40.6 t -72.44 171.57 12.04 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.581 -0.7 . . . . 0.0 110.011 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.7 mm -55.84 -28.99 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.072 0 O-C-N 121.411 -0.806 . . . . 0.0 110.125 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.91 -64.15 4.45 Favored Glycine 0 N--CA 1.493 2.471 0 N-CA-C 109.178 -1.569 . . . . 0.0 109.178 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.593 ' HB3' HD13 ' A' ' 34' ' ' LEU . 13.7 t70 -72.19 -34.01 68.09 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.546 -0.973 . . . . 0.0 110.438 179.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 96.4 m -64.21 -33.15 75.15 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.338 -0.851 . . . . 0.0 110.151 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.01 -36.97 69.88 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.638 -0.664 . . . . 0.0 110.062 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -96.24 -9.56 30.09 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.581 -0.699 . . . . 0.0 111.888 -179.332 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -88.8 7.33 34.63 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 120.986 -1.072 . . . . 0.0 110.258 179.158 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.438 HD13 ' SG ' ' A' ' 20' ' ' CYS . 16.2 mt -105.6 -30.18 9.66 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.053 -1.029 . . . . 0.0 109.584 179.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.65 -28.83 73.53 Favored Glycine 0 N--CA 1.493 2.44 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -55.02 -44.16 74.33 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.437 -1.037 . . . . 0.0 110.556 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 34.5 mtm -82.31 -46.74 13.23 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.541 -0.725 . . . . 0.0 109.912 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . 0.5 ' CD1' ' CE2' ' A' ' 16' ' ' PHE . 74.6 t-105 -54.68 -22.03 12.53 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.628 -0.67 . . . . 0.0 111.06 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 11.1 t -97.5 -33.16 11.47 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.359 -0.838 . . . . 0.0 110.216 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -62.73 -36.35 82.73 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.566 -0.709 . . . . 0.0 110.032 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 13.4 mm-40 -58.9 156.98 10.5 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.521 -0.737 . . . . 0.0 110.504 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.8 t -86.6 -148.43 0.13 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.671 -0.643 . . . . 0.0 109.369 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.67 49.26 1.77 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.201 -0.937 . . . . 0.0 110.335 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 17.3 mtmm -126.64 -40.19 1.94 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.523 -0.735 . . . . 0.0 110.29 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -55.79 -32.66 63.7 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.366 -0.834 . . . . 0.0 110.845 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.5 tttm -103.24 26.28 8.5 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.41 -0.806 . . . . 0.0 110.931 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.441 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 3.9 mt-30 -99.0 -55.0 0.18 Allowed Pre-proline 0 N--CA 1.495 1.823 0 O-C-N 121.288 -0.882 . . . . 0.0 110.655 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.441 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.0 Cg_endo -83.94 -35.15 0.23 Allowed 'Trans proline' 0 C--N 1.321 -0.912 0 O-C-N 122.918 0.957 . . . . 0.0 110.779 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -81.54 4.33 21.72 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.411 -0.806 . . . . 0.0 111.446 -179.302 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.408 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -96.71 -23.0 16.65 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.976 -1.077 . . . . 0.0 110.731 -179.806 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -75.61 -22.65 56.69 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.458 -0.777 . . . . 0.0 110.239 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 66.0 tttt -60.93 -41.67 96.64 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.426 -0.796 . . . . 0.0 109.93 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.78 -11.34 60.76 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.586 -0.696 . . . . 0.0 110.58 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.68 6.13 36.29 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.327 -0.858 . . . . 0.0 110.503 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 24.7 mmtp -106.12 -33.85 7.73 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.216 -0.928 . . . . 0.0 109.281 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.1 mp -79.42 0.64 28.5 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.881 -0.512 . . . . 0.0 111.004 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 31.7 tttm -91.53 -26.03 18.96 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.171 -0.956 . . . . 0.0 109.839 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -85.06 -14.44 47.24 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.5 -0.75 . . . . 0.0 110.656 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 20.4 mtpt -102.92 -29.92 11.13 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.327 -0.858 . . . . 0.0 109.854 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.447 ' O ' HG22 ' A' ' 73' ' ' ILE . 21.0 t80 -75.1 -53.24 9.22 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.631 -0.668 . . . . 0.0 109.684 179.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -69.28 -9.02 51.3 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.639 -0.663 . . . . 0.0 111.47 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 43.8 mttm -109.02 -33.71 6.82 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.085 -1.009 . . . . 0.0 110.697 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -87.02 -33.95 19.39 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.418 -0.801 . . . . 0.0 111.003 -179.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.447 HG22 ' O ' ' A' ' 69' ' ' TYR . 3.2 tp . . . . . 0 N--CA 1.496 1.873 0 O-C-N 121.433 -0.792 . . . . 0.0 110.909 -179.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo . . . . . 0 N--CA 1.484 0.968 0 N-CA-C 110.406 -0.652 . . . . 0.0 110.406 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -103.86 33.28 3.49 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.513 -0.742 . . . . 0.0 110.399 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -169.63 100.75 0.47 Allowed Pre-proline 0 N--CA 1.495 1.797 0 O-C-N 121.795 -0.566 . . . . 0.0 110.584 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.42 ' HB3' ' CD2' ' A' ' 69' ' ' TYR . 46.6 Cg_endo -75.26 116.46 4.55 Favored 'Trans proline' 0 C--N 1.319 -1.018 0 O-C-N 123.305 1.161 . . . . 0.0 110.168 179.616 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.649 ' HB2' HD21 ' A' ' 18' ' ' LEU . 46.7 Cg_endo -81.5 163.82 19.06 Favored 'Trans proline' 0 C--N 1.317 -1.087 0 O-C-N 123.255 1.134 . . . . 0.0 110.38 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.504 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 24.7 t -164.98 62.44 0.13 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.582 -0.699 . . . . 0.0 110.518 -179.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.504 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 65.48 -78.1 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.167 -0.958 . . . . 0.0 110.048 -179.504 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -47.66 -50.11 25.62 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.347 -0.845 . . . . 0.0 111.435 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -58.42 -37.23 74.94 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.538 -0.726 . . . . 0.0 109.924 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.77 HD11 ' HB2' ' A' ' 62' ' ' ALA . 43.7 mt -67.95 -39.71 83.38 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.642 -0.661 . . . . 0.0 110.104 -179.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.497 ' CE2' ' CE1' ' A' ' 23' ' ' TYR . 37.9 t80 -72.69 -52.88 13.4 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.667 -0.645 . . . . 0.0 110.868 -179.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.57 ' SG ' HD13 ' A' ' 43' ' ' LEU . 23.3 t -57.57 -50.51 72.86 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.527 -0.733 . . . . 0.0 110.716 -179.638 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 94.4 p -60.19 -26.97 66.76 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.525 -0.734 . . . . 0.0 110.844 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -95.36 -23.84 17.0 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.407 -0.808 . . . . 0.0 111.372 -179.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.497 ' CE1' ' CE2' ' A' ' 19' ' ' PHE . 7.0 m-85 -91.53 -33.64 15.08 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.278 -0.889 . . . . 0.0 111.003 -179.308 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.523 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 17.9 mtt180 -48.5 -52.72 41.57 Favored Pre-proline 0 N--CA 1.498 1.938 0 O-C-N 121.313 -0.867 . . . . 0.0 112.138 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.573 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.2 Cg_endo -59.65 -28.36 87.18 Favored 'Trans proline' 0 N--CA 1.495 1.597 0 O-C-N 123.265 1.14 . . . . 0.0 110.134 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.67 -44.42 74.1 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 178.109 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.3 mm -59.63 -31.09 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.112 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.573 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.4 mmmm -72.78 -38.24 67.35 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 120.032 -0.667 . . . . 0.0 110.575 -177.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.9 t -57.7 -26.43 61.72 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.384 -0.822 . . . . 0.0 110.756 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -115.25 -22.85 9.21 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.519 -0.738 . . . . 0.0 110.822 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.702 ' HB3' HD23 ' A' ' 34' ' ' LEU . 33.7 m80 -122.18 95.57 47.16 Favored Pre-proline 0 N--CA 1.496 1.87 0 O-C-N 121.452 -0.78 . . . . 0.0 109.635 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -75.13 -40.49 0.85 Allowed 'Trans proline' 0 C--N 1.315 -1.193 0 O-C-N 123.464 1.244 . . . . 0.0 110.189 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.405 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -70.21 -19.33 75.69 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.702 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -56.63 85.3 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.527 -0.984 . . . . 0.0 111.11 -179.509 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.405 ' N ' ' O ' ' A' ' 33' ' ' GLY . 66.3 m -73.4 174.45 8.14 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.432 -0.792 . . . . 0.0 109.836 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 41.3 mm -54.57 -33.22 26.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 O-C-N 121.393 -0.817 . . . . 0.0 110.238 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.05 -64.89 3.93 Favored Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.445 ' HB3' HD13 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -69.1 -36.06 77.13 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.613 -0.934 . . . . 0.0 110.267 179.516 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.0 m -62.66 -30.7 71.57 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.356 -0.84 . . . . 0.0 110.209 179.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.22 -44.26 38.47 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.51 -0.743 . . . . 0.0 110.119 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.403 ' HG2' ' HA ' ' A' ' 38' ' ' ASP . 0.7 OUTLIER -86.65 -14.15 43.49 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.542 -0.724 . . . . 0.0 111.784 -179.158 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.3 OUTLIER -87.04 6.95 29.88 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.92 -1.113 . . . . 0.0 110.453 179.319 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.57 HD13 ' SG ' ' A' ' 20' ' ' CYS . 14.6 mt -103.89 -29.58 10.89 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.089 -1.007 . . . . 0.0 109.664 179.355 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -66.83 -29.41 74.63 Favored Glycine 0 N--CA 1.492 2.427 0 N-CA-C 109.449 -1.46 . . . . 0.0 109.449 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -52.4 -44.23 65.24 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.474 -1.015 . . . . 0.0 110.731 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 17.4 mtt -86.32 -42.12 13.98 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.631 -0.668 . . . . 0.0 109.873 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . 0.424 ' CH2' ' HG3' ' A' ' 55' ' ' LYS . 73.8 t-105 -55.21 -23.18 20.81 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.577 -0.702 . . . . 0.0 110.894 -179.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 38.1 t -94.55 -32.89 13.26 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.44 -0.788 . . . . 0.0 110.006 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -62.69 -37.08 85.04 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.589 -0.694 . . . . 0.0 109.677 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -63.22 156.4 25.48 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.669 -0.645 . . . . 0.0 109.903 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.2 m -104.94 -152.3 0.46 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.733 -0.604 . . . . 0.0 109.382 179.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -84.61 54.19 2.94 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.389 -0.819 . . . . 0.0 109.92 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 52.5 mttm -130.04 -51.56 1.12 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.466 -0.771 . . . . 0.0 110.251 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -75.21 -23.46 57.62 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.478 -0.764 . . . . 0.0 111.347 -179.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.424 ' HG3' ' CH2' ' A' ' 47' ' ' TRP . 3.5 mppt? -89.89 -40.23 12.54 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.239 -0.913 . . . . 0.0 110.911 -179.396 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.401 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 7.7 mm100 -43.72 -56.71 6.8 Favored Pre-proline 0 N--CA 1.508 2.437 0 O-C-N 121.585 -0.697 . . . . 0.0 112.497 -178.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.401 ' HD2' ' N ' ' A' ' 56' ' ' GLN . 45.6 Cg_endo -70.47 -35.77 10.02 Favored 'Trans proline' 0 C--N 1.316 -1.164 0 O-C-N 122.993 0.996 . . . . 0.0 110.194 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -76.04 -9.86 58.96 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.608 -0.682 . . . . 0.0 110.786 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -76.5 -58.47 3.26 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.218 -0.926 . . . . 0.0 110.005 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -48.81 -27.95 3.36 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.6 -0.688 . . . . 0.0 111.491 -179.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 41.5 tttt -58.35 -53.33 59.55 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.395 -0.815 . . . . 0.0 109.984 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.77 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -73.52 -9.92 59.18 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.581 -0.7 . . . . 0.0 110.436 179.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.92 -0.16 47.19 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.355 -0.841 . . . . 0.0 110.081 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 20.2 mmtt -105.49 -28.12 11.0 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.136 -0.977 . . . . 0.0 109.733 179.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.6 mp -88.24 -10.39 49.86 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.837 -0.54 . . . . 0.0 110.18 178.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 5.3 tppt? -80.55 -32.75 36.6 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.388 -0.82 . . . . 0.0 109.202 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -67.94 -60.23 2.66 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 120.071 -0.652 . . . . 0.0 109.401 179.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.0 mmmt -57.37 -24.78 57.41 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.604 -0.685 . . . . 0.0 110.598 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.578 ' O ' HG22 ' A' ' 73' ' ' ILE . 12.8 t80 -73.27 -66.58 0.67 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.388 -0.82 . . . . 0.0 109.48 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -61.43 -16.23 44.8 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.848 -0.533 . . . . 0.0 111.38 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.8 ttmm -97.76 -24.19 15.57 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.176 -0.952 . . . . 0.0 111.231 -179.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -103.83 -30.1 10.58 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.398 -0.814 . . . . 0.0 110.862 -179.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.578 HG22 ' O ' ' A' ' 69' ' ' TYR . 7.7 tp . . . . . 0 N--CA 1.496 1.839 0 O-C-N 121.368 -0.832 . . . . 0.0 110.313 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo . . . . . 0 N--CA 1.484 0.956 0 N-CA-C 110.419 -0.647 . . . . 0.0 110.419 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.97 -170.0 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.531 -0.731 . . . . 0.0 110.67 -179.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.72 145.61 98.15 Favored Pre-proline 0 N--CA 1.497 1.884 0 O-C-N 121.498 -0.751 . . . . 0.0 110.437 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -76.28 129.65 11.39 Favored 'Trans proline' 0 C--N 1.318 -1.027 0 O-C-N 123.393 1.207 . . . . 0.0 109.883 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.692 ' CB ' HD21 ' A' ' 18' ' ' LEU . 50.4 Cg_endo -81.8 -173.65 1.86 Allowed 'Trans proline' 0 C--N 1.317 -1.113 0 O-C-N 123.264 1.139 . . . . 0.0 110.428 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.523 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 60.6 p -161.7 59.64 0.26 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.567 -0.708 . . . . 0.0 110.516 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.523 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 66.82 -76.88 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.083 -1.011 . . . . 0.0 110.169 -179.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.428 ' CE2' ' CD1' ' A' ' 47' ' ' TRP . 5.5 t80 -47.74 -49.88 26.97 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.298 -0.876 . . . . 0.0 111.348 -179.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -57.99 -35.98 71.98 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.643 -0.661 . . . . 0.0 109.982 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.692 HD21 ' CB ' ' A' ' 13' ' ' PRO . 41.6 mt -70.9 -36.85 72.9 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.532 -0.73 . . . . 0.0 110.265 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.503 ' CZ ' ' CE2' ' A' ' 23' ' ' TYR . 50.8 t80 -76.15 -54.23 7.12 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.563 -0.71 . . . . 0.0 110.497 -179.412 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.46 ' SG ' HD13 ' A' ' 43' ' ' LEU . 48.8 t -58.03 -51.78 68.25 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.565 -0.709 . . . . 0.0 110.616 -179.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 72.2 p -57.84 -22.95 50.46 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.536 -0.728 . . . . 0.0 111.036 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.4 mm-40 -102.6 -24.98 13.73 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.354 -0.841 . . . . 0.0 111.446 -179.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.503 ' CE2' ' CZ ' ' A' ' 19' ' ' PHE . 10.4 m-85 -93.09 12.61 23.59 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.308 -0.87 . . . . 0.0 111.595 -179.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.532 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 3.6 mtp180 -85.76 -45.33 0.61 Allowed Pre-proline 0 N--CA 1.489 1.478 0 O-C-N 121.145 -0.972 . . . . 0.0 112.03 179.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.589 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 37.7 Cg_endo -65.83 -15.41 48.94 Favored 'Trans proline' 0 N--CA 1.49 1.318 0 O-C-N 122.883 0.938 . . . . 0.0 110.483 -179.13 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.5 tmtm? -73.4 -51.64 16.6 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 177.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 37.5 mm -52.61 -33.71 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 CA-C-O 121.465 0.65 . . . . 0.0 110.317 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.589 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.7 mmmm -72.18 -37.49 69.3 Favored 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.279 -177.243 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.9 t -59.13 -25.48 63.89 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.466 -0.771 . . . . 0.0 110.753 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -116.8 -23.37 8.13 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.421 -0.8 . . . . 0.0 110.873 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.727 ' HB3' HD23 ' A' ' 34' ' ' LEU . 37.4 m80 -120.65 96.33 48.87 Favored Pre-proline 0 N--CA 1.496 1.87 0 O-C-N 121.403 -0.81 . . . . 0.0 109.574 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -75.32 -32.66 4.86 Favored 'Trans proline' 0 C--N 1.316 -1.16 0 O-C-N 123.465 1.245 . . . . 0.0 110.464 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -80.45 -13.44 81.7 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.727 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -60.83 83.19 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.381 -1.07 . . . . 0.0 110.987 -179.5 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 78.2 p -74.72 170.64 15.44 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.541 -0.724 . . . . 0.0 109.78 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.2 mm -52.6 -27.7 11.79 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.155 0 O-C-N 121.218 -0.926 . . . . 0.0 110.369 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -61.56 -71.67 0.77 Allowed Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.118 -1.593 . . . . 0.0 109.118 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.426 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 7.1 t70 -67.33 -25.01 65.8 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.642 -0.917 . . . . 0.0 110.623 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 64.5 m -71.64 -46.98 57.37 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.549 -0.719 . . . . 0.0 109.962 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -52.55 -41.79 63.85 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.545 -0.722 . . . . 0.0 110.069 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -86.03 -10.15 55.52 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.72 -0.613 . . . . 0.0 111.231 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.426 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -74.21 -59.48 2.71 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.004 -1.06 . . . . 0.0 109.449 179.236 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.46 HD13 ' SG ' ' A' ' 20' ' ' CYS . 14.5 mt -53.51 -27.74 27.31 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.806 -0.559 . . . . 0.0 110.899 -179.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -60.34 -45.44 96.15 Favored Glycine 0 N--CA 1.496 2.669 0 N-CA-C 109.614 -1.394 . . . . 0.0 109.614 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -62.32 -48.89 77.84 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.567 -0.96 . . . . 0.0 109.878 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 17.5 mmt -60.13 -24.5 64.75 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.588 -0.695 . . . . 0.0 110.551 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . 0.428 ' CD1' ' CE2' ' A' ' 16' ' ' PHE . 72.4 t-105 -79.71 -48.93 12.84 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.537 -0.727 . . . . 0.0 109.473 179.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.1 t -67.66 -26.96 66.46 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.64 -0.663 . . . . 0.0 110.007 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -68.22 -44.72 75.13 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.557 -0.714 . . . . 0.0 109.596 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 19.7 mm-40 -57.17 153.3 12.06 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.618 -0.676 . . . . 0.0 110.372 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.4 t -98.34 -152.47 0.4 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.649 -0.657 . . . . 0.0 109.533 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -88.01 49.55 1.82 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.38 -0.825 . . . . 0.0 110.082 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -127.48 -49.14 1.41 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.512 -0.743 . . . . 0.0 110.289 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -67.2 -27.4 67.23 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.461 -0.774 . . . . 0.0 110.74 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.3 tttt -81.43 -36.53 29.34 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.414 -0.804 . . . . 0.0 110.713 -179.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -43.83 -52.95 13.73 Favored Pre-proline 0 N--CA 1.507 2.386 0 O-C-N 121.507 -0.745 . . . . 0.0 112.324 -178.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -78.53 -37.19 0.73 Allowed 'Trans proline' 0 C--N 1.315 -1.206 0 O-C-N 123.172 1.09 . . . . 0.0 111.073 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.59 1.42 46.1 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.433 -0.792 . . . . 0.0 112.102 -178.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.469 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -97.69 -23.86 15.76 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.023 -1.048 . . . . 0.0 110.601 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -77.85 -22.56 49.72 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.442 -0.786 . . . . 0.0 110.29 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 65.4 tttt -61.32 -43.14 99.37 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.411 -0.806 . . . . 0.0 109.944 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -74.2 -10.84 60.01 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.619 -0.676 . . . . 0.0 110.658 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -86.08 3.06 44.17 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.299 -0.875 . . . . 0.0 110.451 179.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 36.7 mmtm -105.64 -31.61 8.84 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.181 -0.949 . . . . 0.0 109.741 179.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.5 mp -82.38 1.73 35.83 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.802 -0.561 . . . . 0.0 110.624 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 65.7 tttt -91.49 -28.46 17.59 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.205 -0.934 . . . . 0.0 109.629 179.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -87.07 -10.89 51.81 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.61 -0.681 . . . . 0.0 110.613 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 34.3 mmtt -103.73 -34.19 8.67 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.336 -0.853 . . . . 0.0 109.551 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.421 ' O ' HG22 ' A' ' 73' ' ' ILE . 24.8 t80 -73.78 -53.83 9.41 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.74 -0.6 . . . . 0.0 109.685 179.488 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -68.41 -12.31 60.96 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.7 -0.625 . . . . 0.0 111.219 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.83 -31.73 8.7 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.288 -0.882 . . . . 0.0 110.972 -179.471 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -91.22 -35.64 14.39 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.403 -0.811 . . . . 0.0 111.096 -179.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.421 HG22 ' O ' ' A' ' 69' ' ' TYR . 4.5 tp . . . . . 0 N--CA 1.5 2.064 0 O-C-N 121.308 -0.87 . . . . 0.0 110.95 -179.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo . . . . . 0 N--CA 1.485 0.995 0 N-CA-C 110.688 -0.543 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.61 -161.03 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.638 -0.663 . . . . 0.0 109.974 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.33 140.96 93.13 Favored Pre-proline 0 N--CA 1.497 1.921 0 O-C-N 121.236 -0.915 . . . . 0.0 110.099 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -75.24 135.52 18.75 Favored 'Trans proline' 0 C--N 1.318 -1.077 0 O-C-N 123.314 1.165 . . . . 0.0 109.767 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.543 ' CB ' HD21 ' A' ' 18' ' ' LEU . 49.8 Cg_endo -80.04 -177.32 3.73 Favored 'Trans proline' 0 C--N 1.317 -1.092 0 O-C-N 123.285 1.15 . . . . 0.0 110.262 -179.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.532 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 23.2 t -159.36 59.5 0.4 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.418 -0.801 . . . . 0.0 110.47 -179.668 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.532 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 67.6 -75.53 0.06 Allowed 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.196 -0.94 . . . . 0.0 110.172 -179.508 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -48.49 -48.73 37.82 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.333 -0.855 . . . . 0.0 111.271 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -59.66 -41.41 90.53 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.511 -0.743 . . . . 0.0 109.189 179.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.543 HD21 ' CB ' ' A' ' 13' ' ' PRO . 57.1 mt -62.05 -46.3 89.75 Favored 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.993 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -64.31 -50.37 68.09 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.603 -0.686 . . . . 0.0 110.006 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.596 ' SG ' HD13 ' A' ' 43' ' ' LEU . 6.6 t -68.64 -19.01 64.4 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.59 -0.693 . . . . 0.0 110.28 179.289 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.7 t -76.95 -17.69 58.74 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.286 -0.884 . . . . 0.0 111.725 -178.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -128.58 -14.45 4.65 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.02 -1.05 . . . . 0.0 112.776 -178.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.4 ' HB3' ' CD2' ' A' ' 43' ' ' LEU . 12.4 m-85 -87.92 13.85 10.06 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 120.944 -1.097 . . . . 0.0 111.671 -179.19 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.641 ' HG2' HD11 ' A' ' 43' ' ' LEU . 11.2 mtp180 -87.53 -45.97 0.5 Allowed Pre-proline 0 N--CA 1.49 1.556 0 O-C-N 121.162 -0.961 . . . . 0.0 112.386 179.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.578 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.1 Cg_endo -65.92 -15.97 50.9 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 O-C-N 122.981 0.99 . . . . 0.0 110.663 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.9 tmtt? -73.28 -52.34 14.31 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 177.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 42.1 mm -52.53 -30.98 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 CA-C-O 121.36 0.6 . . . . 0.0 110.439 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.578 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 6.2 mmmm -73.11 -36.78 66.82 Favored 'General case' 0 N--CA 1.498 1.945 0 C-N-CA 120.111 -0.636 . . . . 0.0 110.334 -177.246 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.2 t -58.7 -25.26 62.69 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.429 -0.795 . . . . 0.0 110.679 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -118.26 -22.84 7.52 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.515 -0.741 . . . . 0.0 110.949 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.72 ' HB3' HD23 ' A' ' 34' ' ' LEU . 34.4 m80 -121.11 96.54 48.34 Favored Pre-proline 0 N--CA 1.496 1.863 0 O-C-N 121.281 -0.887 . . . . 0.0 109.669 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -75.23 -35.58 2.91 Favored 'Trans proline' 0 C--N 1.315 -1.192 0 O-C-N 123.426 1.224 . . . . 0.0 110.513 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.78 -11.27 85.59 Favored Glycine 0 N--CA 1.492 2.409 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.72 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -64.44 80.91 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.209 -1.171 . . . . 0.0 110.55 -179.818 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.4 t -75.03 173.69 10.38 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.522 -0.737 . . . . 0.0 109.485 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 39.0 mm -51.08 -32.02 11.59 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.213 0 O-C-N 121.187 -0.946 . . . . 0.0 110.503 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.6 -74.4 0.37 Allowed Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.223 -1.551 . . . . 0.0 109.223 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.97 -23.24 67.33 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.657 -0.908 . . . . 0.0 110.85 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 38.9 m -72.24 -46.22 56.93 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.366 -0.834 . . . . 0.0 109.904 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -53.34 -49.48 67.01 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.416 -0.803 . . . . 0.0 110.073 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.97 -12.37 60.33 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.763 -0.586 . . . . 0.0 111.152 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.57 -57.93 3.66 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.154 -0.966 . . . . 0.0 109.631 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.641 HD11 ' HG2' ' A' ' 24' ' ' ARG . 22.2 mt -54.5 -34.6 61.94 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.725 -0.609 . . . . 0.0 111.064 -179.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -61.02 -49.68 75.86 Favored Glycine 0 N--CA 1.494 2.558 0 N-CA-C 109.974 -1.25 . . . . 0.0 109.974 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -53.69 -35.59 61.27 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.401 -1.058 . . . . 0.0 110.833 -179.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 20.2 mmt -69.1 -50.95 43.55 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.621 -0.674 . . . . 0.0 109.488 179.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 31.2 t-105 -51.37 -58.31 6.59 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.708 -0.62 . . . . 0.0 110.818 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 12.6 t -60.97 -34.57 74.97 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.517 -0.739 . . . . 0.0 110.382 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -58.48 -41.6 85.65 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.576 -0.702 . . . . 0.0 110.432 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 41.7 mm-40 -67.17 167.79 11.47 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.46 -0.775 . . . . 0.0 110.029 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.1 m -141.06 96.09 2.94 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.53 -0.731 . . . . 0.0 110.506 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 51.84 46.4 26.63 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.409 -0.807 . . . . 0.0 111.133 179.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 11.3 tmtt? -141.48 -63.03 0.46 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.538 -0.726 . . . . 0.0 110.254 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -61.89 -17.45 56.64 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.581 -0.699 . . . . 0.0 110.904 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 53.1 tttm -99.29 -32.38 11.22 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.238 -0.913 . . . . 0.0 110.765 -179.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.427 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 7.4 mt-30 -43.51 -56.72 6.54 Favored Pre-proline 0 N--CA 1.508 2.461 0 O-C-N 121.469 -0.769 . . . . 0.0 112.273 -178.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.427 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.4 Cg_endo -78.75 -35.14 1.11 Allowed 'Trans proline' 0 C--N 1.316 -1.18 0 O-C-N 123.059 1.031 . . . . 0.0 110.658 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -83.85 5.8 23.85 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.445 -0.784 . . . . 0.0 112.186 -178.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.528 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -101.35 -21.36 14.86 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 120.965 -1.084 . . . . 0.0 110.625 179.808 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -78.88 -23.55 44.77 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.422 -0.798 . . . . 0.0 110.277 179.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 48.3 tttm -62.91 -41.35 99.43 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.479 -0.763 . . . . 0.0 109.985 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.406 ' HB1' ' HA ' ' A' ' 14' ' ' SER . . . -71.12 -9.21 57.67 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.596 -0.69 . . . . 0.0 110.896 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -89.07 4.57 47.94 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.232 -0.917 . . . . 0.0 110.646 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -105.89 -32.61 8.27 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.128 -0.982 . . . . 0.0 109.611 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.9 mp -79.3 1.18 25.88 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.826 -0.546 . . . . 0.0 111.034 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 72.7 tttt -93.2 -23.37 18.57 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.161 -0.962 . . . . 0.0 109.957 179.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -85.24 -12.66 52.0 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.377 -0.827 . . . . 0.0 110.654 179.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -102.8 -31.24 10.4 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.327 -0.858 . . . . 0.0 109.52 179.474 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.487 ' O ' HG22 ' A' ' 73' ' ' ILE . 22.2 t80 -74.65 -55.08 6.27 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.799 -0.563 . . . . 0.0 109.671 179.532 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -66.3 -12.31 55.74 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.756 -0.59 . . . . 0.0 111.437 -179.433 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -103.68 -31.13 10.03 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.187 -0.945 . . . . 0.0 110.612 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -92.38 -31.12 15.45 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.445 -0.785 . . . . 0.0 110.955 -179.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.487 HG22 ' O ' ' A' ' 69' ' ' TYR . 2.6 tp . . . . . 0 N--CA 1.496 1.858 0 O-C-N 121.361 -0.837 . . . . 0.0 110.839 -179.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.415 ' O ' ' CD1' ' A' ' 69' ' ' TYR . 55.6 Cg_endo . . . . . 0 N--CA 1.488 1.174 0 N-CA-C 111.515 -0.225 . . . . 0.0 111.515 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.5 tptt -71.97 164.22 26.48 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.021 -1.05 . . . . 0.0 110.228 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 49.17 94.83 0.04 OUTLIER Pre-proline 0 N--CA 1.5 2.056 0 O-C-N 121.579 -0.701 . . . . 0.0 111.604 179.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -73.52 136.51 23.83 Favored 'Trans proline' 0 C--N 1.316 -1.176 0 O-C-N 123.431 1.227 . . . . 0.0 109.769 179.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.736 ' HB2' HD21 ' A' ' 18' ' ' LEU . 49.6 Cg_endo -79.96 167.89 19.63 Favored 'Trans proline' 0 C--N 1.316 -1.134 0 O-C-N 123.273 1.144 . . . . 0.0 110.362 -179.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.517 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 57.5 p -161.37 66.38 0.28 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.569 -0.707 . . . . 0.0 110.456 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 65.79 -77.5 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.166 -0.958 . . . . 0.0 110.015 -179.589 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -51.13 -42.63 60.86 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.246 -0.908 . . . . 0.0 110.924 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -63.99 -25.04 67.95 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.617 -0.677 . . . . 0.0 109.966 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.736 HD21 ' HB2' ' A' ' 13' ' ' PRO . 41.7 mt -84.6 -39.06 19.16 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.508 -0.745 . . . . 0.0 110.363 -179.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.501 ' CE2' ' CZ ' ' A' ' 23' ' ' TYR . 44.5 t80 -69.32 -50.44 46.52 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.578 -0.701 . . . . 0.0 110.464 -179.5 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 35.5 t -65.95 -33.46 75.86 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.541 -0.724 . . . . 0.0 110.083 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 29.4 t -82.16 1.17 37.51 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.513 -0.742 . . . . 0.0 111.599 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -133.96 1.9 3.33 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.975 -1.078 . . . . 0.0 111.881 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.501 ' CZ ' ' CE2' ' A' ' 19' ' ' PHE . 8.6 m-85 -110.88 -27.02 9.01 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 120.969 -1.082 . . . . 0.0 110.878 -179.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.523 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 18.5 mtp180 -49.14 -52.03 51.41 Favored Pre-proline 0 N--CA 1.497 1.916 0 O-C-N 121.326 -0.859 . . . . 0.0 112.252 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.571 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 35.7 Cg_endo -59.37 -29.11 89.34 Favored 'Trans proline' 0 N--CA 1.495 1.576 0 O-C-N 123.171 1.09 . . . . 0.0 110.28 -179.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.8 tmtm? -68.26 -43.75 77.13 Favored 'General case' 0 N--CA 1.493 1.675 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 178.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.1 mm -60.99 -30.27 47.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.177 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.571 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.1 mmmm -73.14 -38.2 66.35 Favored 'General case' 0 N--CA 1.497 1.881 0 C-N-CA 119.937 -0.705 . . . . 0.0 110.633 -177.113 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 13.8 t -56.94 -26.83 60.32 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.324 -0.86 . . . . 0.0 110.707 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -114.86 -24.65 8.56 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.567 -0.708 . . . . 0.0 110.738 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.712 ' HB3' HD23 ' A' ' 34' ' ' LEU . 30.5 m80 -120.63 95.69 48.96 Favored Pre-proline 0 N--CA 1.497 1.897 0 O-C-N 121.464 -0.773 . . . . 0.0 109.649 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -75.06 -41.49 0.64 Allowed 'Trans proline' 0 C--N 1.315 -1.193 0 O-C-N 123.409 1.215 . . . . 0.0 110.19 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.416 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -69.07 -19.93 74.31 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 110.077 -1.209 . . . . 0.0 110.077 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.712 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -56.42 84.98 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.528 -0.983 . . . . 0.0 111.175 -179.397 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.416 ' N ' ' O ' ' A' ' 33' ' ' GLY . 71.9 p -73.27 175.81 6.52 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.452 -0.78 . . . . 0.0 109.657 179.732 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 43.5 mm -56.31 -32.64 35.8 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 O-C-N 121.395 -0.816 . . . . 0.0 110.128 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.7 -65.18 3.67 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.26 -1.536 . . . . 0.0 109.26 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.406 ' HB3' HD13 ' A' ' 34' ' ' LEU . 0.7 OUTLIER -68.37 -36.55 79.36 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.56 -0.965 . . . . 0.0 110.299 179.573 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 93.8 m -63.29 -29.93 71.16 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.448 -0.782 . . . . 0.0 110.063 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.75 -44.89 39.44 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.559 -0.713 . . . . 0.0 109.795 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -86.71 -11.78 50.19 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.606 -0.684 . . . . 0.0 111.892 -179.22 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.404 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 11.5 tptt -87.83 6.75 33.81 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 120.813 -1.18 . . . . 0.0 110.495 179.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.9 mt -101.08 -27.76 13.08 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.193 -0.942 . . . . 0.0 109.515 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -68.96 -28.25 73.19 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.168 -1.573 . . . . 0.0 109.168 179.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -57.5 -54.9 41.62 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.445 -1.032 . . . . 0.0 109.875 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 33.6 mtt -68.48 -52.33 33.53 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 120.125 -0.63 . . . . 0.0 109.398 179.203 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . 0.438 ' CH2' ' HG2' ' A' ' 55' ' ' LYS . 54.6 t-105 -50.77 -58.02 6.96 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.49 -0.756 . . . . 0.0 110.936 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 26.6 t -59.19 -34.2 71.85 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.435 -0.791 . . . . 0.0 110.39 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -61.73 -40.88 96.64 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.596 -0.69 . . . . 0.0 109.973 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -60.0 155.52 16.63 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.635 -0.666 . . . . 0.0 110.307 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.6 m -106.49 -152.12 0.47 Allowed 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.01 58.72 3.01 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.332 -0.855 . . . . 0.0 109.953 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 8.8 tttp -139.93 -52.6 0.52 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.401 -0.812 . . . . 0.0 110.211 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -62.45 -25.56 68.04 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.511 -0.743 . . . . 0.0 110.586 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.438 ' HG2' ' CH2' ' A' ' 47' ' ' TRP . 14.7 mtpt -81.57 -34.47 31.02 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.404 -0.81 . . . . 0.0 110.607 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -44.64 -52.53 17.68 Favored Pre-proline 0 N--CA 1.507 2.387 0 O-C-N 121.572 -0.705 . . . . 0.0 111.986 -179.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -78.71 -38.22 0.53 Allowed 'Trans proline' 0 C--N 1.315 -1.227 0 O-C-N 123.263 1.138 . . . . 0.0 110.85 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.1 5.0 23.97 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.51 -0.744 . . . . 0.0 112.055 -178.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.44 -23.07 15.25 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.053 -1.029 . . . . 0.0 110.363 179.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -77.48 -26.22 51.11 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.474 -0.766 . . . . 0.0 110.214 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 72.8 tttt -59.57 -42.26 92.04 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.538 -0.726 . . . . 0.0 110.115 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.408 ' HB1' ' O ' ' A' ' 13' ' ' PRO . . . -69.48 -11.09 60.54 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.573 -0.705 . . . . 0.0 110.63 179.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.66 4.94 34.17 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.195 -0.941 . . . . 0.0 110.537 179.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 40.4 mmtt -105.82 -34.79 7.55 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.198 -0.939 . . . . 0.0 109.309 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.674 HD22 ' HG3' ' A' ' 13' ' ' PRO . 7.6 mp -82.36 -2.34 52.62 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.828 -0.545 . . . . 0.0 110.362 178.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 30.0 tptt -83.3 -33.94 25.83 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.27 -0.894 . . . . 0.0 109.112 179.166 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -67.7 -61.73 1.75 Allowed 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.168 179.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -58.87 -18.54 33.75 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.736 -0.602 . . . . 0.0 111.067 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.415 ' CD1' ' O ' ' A' ' 9' ' ' PRO . 9.5 t80 -78.49 -60.38 2.4 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.229 -0.919 . . . . 0.0 109.494 179.465 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -76.71 -1.04 25.89 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.599 -0.688 . . . . 0.0 111.561 -179.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.7 ttmt -113.0 -37.61 4.75 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.995 -1.066 . . . . 0.0 111.228 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -86.93 -31.19 20.82 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.417 -0.802 . . . . 0.0 111.284 -179.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.409 HG22 ' O ' ' A' ' 69' ' ' TYR . 3.0 tp . . . . . 0 N--CA 1.498 1.974 0 O-C-N 121.434 -0.791 . . . . 0.0 111.129 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.404 ' O ' ' CD1' ' A' ' 69' ' ' TYR . 49.2 Cg_endo . . . . . 0 N--CA 1.483 0.861 0 N-CA-C 110.268 -0.705 . . . . 0.0 110.268 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.1 pttp -99.66 30.59 3.56 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.479 -0.763 . . . . 0.0 110.853 -179.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.53 100.57 0.43 Allowed Pre-proline 0 N--CA 1.497 1.896 0 O-C-N 121.7 -0.625 . . . . 0.0 110.811 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -76.26 118.69 5.03 Favored 'Trans proline' 0 C--N 1.319 -1.02 0 O-C-N 123.263 1.138 . . . . 0.0 110.1 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.701 ' HB2' HD21 ' A' ' 18' ' ' LEU . 48.3 Cg_endo -81.93 166.41 16.95 Favored 'Trans proline' 0 C--N 1.318 -1.077 0 O-C-N 123.236 1.124 . . . . 0.0 110.446 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.535 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 32.4 t -156.69 54.78 0.54 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.466 -0.771 . . . . 0.0 110.582 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.535 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 67.99 -76.23 0.06 Allowed 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.256 -0.902 . . . . 0.0 109.965 -179.527 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -48.81 -49.91 36.84 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.357 -0.839 . . . . 0.0 111.378 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.03 -40.73 81.62 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.541 -0.724 . . . . 0.0 109.629 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.701 HD21 ' HB2' ' A' ' 13' ' ' PRO . 59.9 mt -60.52 -48.07 83.37 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.695 -0.628 . . . . 0.0 110.159 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.409 ' CZ ' ' CE1' ' A' ' 23' ' ' TYR . 60.6 t80 -66.88 -50.19 63.27 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.674 -0.641 . . . . 0.0 110.443 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.462 ' SG ' HD13 ' A' ' 43' ' ' LEU . 1.5 m -64.07 -31.93 73.3 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.507 -0.746 . . . . 0.0 109.966 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.0 m -65.48 -22.9 66.79 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.636 -0.665 . . . . 0.0 110.768 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -107.2 -25.71 11.4 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.405 -0.809 . . . . 0.0 111.55 -179.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.409 ' CE1' ' CZ ' ' A' ' 19' ' ' PHE . 0.6 OUTLIER -83.21 -34.75 25.83 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.13 -0.981 . . . . 0.0 110.928 -179.133 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.514 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 35.5 mtt180 -48.43 -53.18 37.25 Favored Pre-proline 0 N--CA 1.498 1.925 0 O-C-N 121.275 -0.89 . . . . 0.0 112.022 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.528 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.4 Cg_endo -59.93 -27.09 84.16 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 O-C-N 123.169 1.089 . . . . 0.0 110.182 179.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.4 tmtt? -69.55 -44.83 70.12 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.1 mm -59.08 -35.0 54.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 CA-C-O 121.084 0.468 . . . . 0.0 110.094 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.544 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 4.8 mmmm -70.15 -39.92 75.08 Favored 'General case' 0 N--CA 1.497 1.908 0 C-N-CA 120.09 -0.644 . . . . 0.0 110.43 -177.173 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.9 t -57.67 -25.64 60.54 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.348 -0.845 . . . . 0.0 110.891 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -114.0 -23.62 9.47 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.508 -0.745 . . . . 0.0 110.654 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.711 ' HB3' HD23 ' A' ' 34' ' ' LEU . 43.6 m80 -120.7 96.06 48.87 Favored Pre-proline 0 N--CA 1.495 1.784 0 O-C-N 121.414 -0.804 . . . . 0.0 109.482 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -74.96 -36.25 2.7 Favored 'Trans proline' 0 C--N 1.316 -1.161 0 O-C-N 123.462 1.243 . . . . 0.0 110.351 -179.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.4 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -75.3 -16.73 80.44 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 110.174 -1.17 . . . . 0.0 110.174 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.711 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -57.86 83.88 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.486 -1.008 . . . . 0.0 111.255 -179.323 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 33' ' ' GLY . 19.9 m -75.71 172.89 11.86 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.502 -0.749 . . . . 0.0 109.758 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.413 ' O ' ' HB2' ' A' ' 40' ' ' ALA . 42.5 mm -54.6 -28.36 19.17 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.113 0 O-C-N 121.34 -0.85 . . . . 0.0 110.228 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.18 -70.67 0.94 Allowed Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.146 -1.582 . . . . 0.0 109.146 179.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.408 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 10.7 t0 -67.49 -31.99 72.5 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.672 -0.899 . . . . 0.0 110.388 179.569 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.409 ' O ' HD12 ' A' ' 43' ' ' LEU . 78.2 m -65.78 -29.93 70.5 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.457 -0.777 . . . . 0.0 109.913 179.42 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.413 ' HB2' ' O ' ' A' ' 36' ' ' ILE . . . -73.16 -44.32 60.19 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.638 -0.664 . . . . 0.0 109.566 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -86.92 -13.39 44.89 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.646 -0.659 . . . . 0.0 111.78 -179.36 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 9.0 tptt -86.23 6.54 29.05 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 120.941 -1.1 . . . . 0.0 110.696 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.462 HD13 ' SG ' ' A' ' 20' ' ' CYS . 11.8 mt -102.1 -28.58 12.25 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.107 -0.996 . . . . 0.0 109.495 179.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -70.4 -29.7 69.8 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.092 -1.603 . . . . 0.0 109.092 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -55.41 -49.83 71.36 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.475 -1.014 . . . . 0.0 110.22 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 31.3 mmt -73.75 -49.72 24.13 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.663 -0.648 . . . . 0.0 109.643 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 62.2 t-105 -51.71 -59.27 4.49 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.479 -0.763 . . . . 0.0 110.847 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.0 t -61.52 -33.39 73.72 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.479 -0.763 . . . . 0.0 110.274 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -59.58 -39.74 85.11 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.54 -0.725 . . . . 0.0 110.284 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -63.48 162.37 12.76 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.579 -0.701 . . . . 0.0 110.297 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 81.1 p -96.18 -147.37 0.29 Allowed 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -85.72 51.85 2.31 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.152 -0.968 . . . . 0.0 110.095 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 9.8 tptp -125.23 -42.82 1.97 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.42 -0.8 . . . . 0.0 110.121 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -62.34 -37.07 84.23 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.563 -0.71 . . . . 0.0 110.728 -179.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 22.0 tttp -91.03 19.9 5.33 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.375 -0.828 . . . . 0.0 111.348 -179.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.463 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 0.7 OUTLIER -94.25 -57.21 0.22 Allowed Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.012 -1.055 . . . . 0.0 110.341 179.888 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.463 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 57.0 Cg_endo -83.28 -31.26 0.68 Allowed 'Trans proline' 0 N--CA 1.484 0.95 0 O-C-N 122.998 0.999 . . . . 0.0 110.577 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -82.33 2.02 34.2 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.49 -0.757 . . . . 0.0 112.004 -178.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.441 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -96.72 -21.92 17.29 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.035 -1.041 . . . . 0.0 110.736 -179.916 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -82.36 -24.64 34.39 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.425 -0.797 . . . . 0.0 110.201 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 71.0 tttt -62.89 -45.0 94.6 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.514 -0.741 . . . . 0.0 109.846 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.469 ' HB2' ' H ' ' A' ' 15' ' ' ALA . . . -74.27 -10.24 59.4 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.623 -0.673 . . . . 0.0 110.835 179.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.87 0.65 52.53 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.256 -0.902 . . . . 0.0 110.372 179.163 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.79 -30.43 9.41 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.225 -0.922 . . . . 0.0 109.92 179.494 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.469 HD12 ' N ' ' A' ' 65' ' ' LEU . 6.5 mp -83.22 -7.16 59.65 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.89 -0.506 . . . . 0.0 110.401 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.7 ttpt -81.34 -27.33 34.98 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.272 -0.892 . . . . 0.0 109.457 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -85.22 -6.29 59.28 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.674 -0.641 . . . . 0.0 110.363 179.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 36.6 mmtm -105.38 -35.24 7.57 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.367 -0.833 . . . . 0.0 108.888 178.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.703 ' O ' HG22 ' A' ' 73' ' ' ILE . 35.8 t80 -75.5 -57.2 4.03 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 179.392 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -57.69 -19.73 29.08 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.665 -0.647 . . . . 0.0 111.218 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 33.2 mmtm -102.75 -24.62 13.71 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.32 -0.863 . . . . 0.0 111.287 -179.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -98.79 -36.53 9.78 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.33 -0.856 . . . . 0.0 111.314 -179.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.703 HG22 ' O ' ' A' ' 69' ' ' TYR . 4.7 tp . . . . . 0 N--CA 1.495 1.795 0 O-C-N 121.304 -0.873 . . . . 0.0 110.616 -179.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo . . . . . 0 N--CA 1.485 1.001 0 N-CA-C 110.543 -0.599 . . . . 0.0 110.543 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.1 tptt -60.93 -157.39 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.651 -0.656 . . . . 0.0 110.143 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -49.47 140.22 13.94 Favored Pre-proline 0 N--CA 1.502 2.169 0 O-C-N 121.269 -0.895 . . . . 0.0 111.227 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.407 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.0 Cg_endo -76.83 128.69 10.23 Favored 'Trans proline' 0 C--N 1.318 -1.032 0 O-C-N 123.276 1.145 . . . . 0.0 110.263 -179.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.472 ' HB2' HD21 ' A' ' 18' ' ' LEU . 50.4 Cg_endo -82.18 179.46 5.51 Favored 'Trans proline' 0 C--N 1.319 -1.022 0 O-C-N 123.212 1.111 . . . . 0.0 110.23 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.537 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -163.17 65.3 0.18 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.554 -0.716 . . . . 0.0 110.257 -179.861 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.537 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 67.02 -76.63 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.185 0 O-C-N 121.183 -0.948 . . . . 0.0 109.938 -179.36 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.415 ' CD2' ' CD1' ' A' ' 47' ' ' TRP . 6.6 t80 -51.78 -43.22 62.93 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.249 -0.907 . . . . 0.0 111.022 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -63.77 -30.25 71.37 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.612 -0.68 . . . . 0.0 109.386 179.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.472 HD21 ' HB2' ' A' ' 13' ' ' PRO . 58.2 mt -75.28 -43.97 48.3 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.589 -0.695 . . . . 0.0 110.037 -179.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -65.56 -48.28 72.96 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.627 -0.671 . . . . 0.0 110.077 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 12.0 t -65.93 -29.5 69.93 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.564 -0.71 . . . . 0.0 109.771 179.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.5 t -90.52 7.12 40.6 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.578 -0.701 . . . . 0.0 111.653 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -138.79 0.75 2.03 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 120.973 -1.08 . . . . 0.0 112.11 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -123.58 22.08 9.2 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 120.872 -1.142 . . . . 0.0 110.905 -179.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.514 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 8.6 mtt180 -85.47 -45.98 0.63 Allowed Pre-proline 0 N--CA 1.488 1.439 0 O-C-N 121.447 -0.783 . . . . 0.0 112.064 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.561 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.3 Cg_endo -66.57 -15.44 47.67 Favored 'Trans proline' 0 N--CA 1.491 1.341 0 O-C-N 122.853 0.922 . . . . 0.0 110.613 -179.286 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? -73.39 -50.84 19.75 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 178.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 30.1 mm -54.51 -33.52 26.86 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.942 0 CA-C-O 121.298 0.57 . . . . 0.0 110.263 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.561 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.2 mmmm -71.27 -37.12 71.92 Favored 'General case' 0 N--CA 1.498 1.953 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.147 -177.26 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 24.8 t -58.6 -25.61 62.79 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.422 -0.799 . . . . 0.0 110.637 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -115.29 -24.22 8.55 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.55 -0.719 . . . . 0.0 110.618 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.783 ' HB3' HD23 ' A' ' 34' ' ' LEU . 41.2 m80 -119.63 96.56 49.72 Favored Pre-proline 0 N--CA 1.496 1.864 0 O-C-N 121.45 -0.781 . . . . 0.0 109.568 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -75.37 -28.42 8.6 Favored 'Trans proline' 0 C--N 1.315 -1.233 0 O-C-N 123.4 1.211 . . . . 0.0 110.502 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -84.44 -13.55 73.15 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.783 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -60.39 82.36 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.356 -1.085 . . . . 0.0 111.019 -179.441 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.1 t -69.74 170.19 11.43 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.487 -0.758 . . . . 0.0 109.977 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 38.6 mm -52.7 -30.08 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.262 -0.899 . . . . 0.0 110.264 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.0 -65.88 3.1 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.33 -1.508 . . . . 0.0 109.33 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.715 ' HB3' HD13 ' A' ' 34' ' ' LEU . 3.4 t70 -69.55 -30.49 68.3 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.617 -0.931 . . . . 0.0 110.591 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.2 m -63.76 -29.32 70.54 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.331 -0.856 . . . . 0.0 110.249 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.41 -44.8 27.9 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.576 -0.702 . . . . 0.0 110.169 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -86.02 -13.28 47.95 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.554 -0.716 . . . . 0.0 111.669 -179.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.9 tptt -76.88 -59.69 2.67 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.055 -1.028 . . . . 0.0 109.718 179.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 45.1 mt -48.67 -25.12 1.62 Allowed 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.474 -0.766 . . . . 0.0 111.458 -179.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -71.08 -36.98 64.14 Favored Glycine 0 N--CA 1.492 2.403 0 N-CA-C 109.051 -1.62 . . . . 0.0 109.051 179.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -53.86 -38.18 64.42 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.577 -0.955 . . . . 0.0 110.746 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 28.3 mtp -76.41 -49.69 16.09 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.599 -0.688 . . . . 0.0 109.861 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . 0.415 ' CD1' ' CD2' ' A' ' 16' ' ' PHE . 57.6 t-105 -49.99 -53.39 26.86 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.527 -0.733 . . . . 0.0 111.067 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.3 t -59.34 -36.14 75.14 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.447 -0.783 . . . . 0.0 110.459 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -62.29 -39.29 92.46 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.612 -0.68 . . . . 0.0 110.046 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -57.52 154.21 11.56 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.546 -0.721 . . . . 0.0 110.539 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.1 m -102.01 -151.55 0.42 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.694 -0.629 . . . . 0.0 109.457 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.06 52.48 2.53 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.306 -0.871 . . . . 0.0 110.124 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -132.54 -51.75 0.93 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.408 -0.808 . . . . 0.0 110.034 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -64.95 -25.0 67.69 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.687 -0.633 . . . . 0.0 110.47 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 37.7 tttp -81.09 -35.33 31.8 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.524 -0.735 . . . . 0.0 110.534 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -44.23 -52.75 15.57 Favored Pre-proline 0 N--CA 1.507 2.391 0 O-C-N 121.498 -0.751 . . . . 0.0 112.048 -179.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -78.41 -37.42 0.72 Allowed 'Trans proline' 0 C--N 1.315 -1.189 0 O-C-N 123.232 1.122 . . . . 0.0 111.045 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -84.85 4.67 32.11 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.344 -0.847 . . . . 0.0 112.146 -178.433 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -101.02 -24.15 14.38 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.002 -1.061 . . . . 0.0 110.552 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -75.28 -23.32 57.4 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.446 -0.784 . . . . 0.0 110.284 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 66.7 tttt -60.42 -41.66 94.39 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.561 -0.712 . . . . 0.0 110.145 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.41 -11.51 60.49 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.494 -0.754 . . . . 0.0 110.569 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -83.69 2.62 36.83 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.222 -0.923 . . . . 0.0 110.383 179.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 26.6 mmtm -105.33 -32.12 8.74 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.196 -0.94 . . . . 0.0 109.742 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.423 ' N ' HD12 ' A' ' 65' ' ' LEU . 6.2 mp -83.57 1.73 40.67 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.832 -0.543 . . . . 0.0 110.685 179.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 74.4 tttt -92.28 -32.02 15.18 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.232 -0.918 . . . . 0.0 109.508 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -83.53 -12.8 55.75 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.658 -0.651 . . . . 0.0 110.56 179.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -105.07 -28.19 11.18 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.318 -0.864 . . . . 0.0 109.464 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.53 ' O ' HG22 ' A' ' 73' ' ' ILE . 17.5 t80 -76.74 -54.54 6.5 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.775 -0.578 . . . . 0.0 109.6 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -64.04 -14.2 52.65 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.578 -0.702 . . . . 0.0 111.348 -179.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt -106.79 -29.96 9.21 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.26 -0.9 . . . . 0.0 111.125 -179.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -96.02 -34.34 11.8 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.289 -0.882 . . . . 0.0 111.555 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.53 HG22 ' O ' ' A' ' 69' ' ' TYR . 5.0 tp . . . . . 0 N--CA 1.497 1.897 0 O-C-N 121.187 -0.946 . . . . 0.0 110.731 -179.256 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.442 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 44.4 Cg_endo . . . . . 0 N--CA 1.484 0.947 0 N-CA-C 110.656 -0.555 . . . . 0.0 110.656 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.7 mtpt -67.14 -172.37 0.2 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.694 -0.628 . . . . 0.0 109.956 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.0 mtt85 -52.37 136.34 41.37 Favored Pre-proline 0 N--CA 1.5 2.071 0 O-C-N 121.309 -0.87 . . . . 0.0 110.665 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -74.51 128.85 12.23 Favored 'Trans proline' 0 C--N 1.319 -1.004 0 O-C-N 123.257 1.135 . . . . 0.0 110.262 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.682 ' CB ' HD21 ' A' ' 18' ' ' LEU . 48.5 Cg_endo -82.25 174.47 9.92 Favored 'Trans proline' 0 C--N 1.317 -1.094 0 O-C-N 123.25 1.132 . . . . 0.0 110.223 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.517 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 20.2 t -157.14 67.44 0.53 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.427 -0.796 . . . . 0.0 110.599 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 65.61 -76.44 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.107 -0.996 . . . . 0.0 110.531 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -48.48 -43.86 35.28 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.262 -0.899 . . . . 0.0 111.229 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -63.86 -26.77 68.76 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 120.126 -0.63 . . . . 0.0 109.949 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.682 HD21 ' CB ' ' A' ' 13' ' ' PRO . 20.7 mt -89.23 -28.35 20.01 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.377 -0.827 . . . . 0.0 110.379 -179.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.495 ' CZ ' ' CE2' ' A' ' 23' ' ' TYR . 36.9 t80 -76.92 -54.62 6.35 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.551 -0.718 . . . . 0.0 110.716 -179.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 10.7 t -63.04 -35.66 80.96 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.608 -0.682 . . . . 0.0 110.224 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 46.6 t -69.81 -19.73 63.47 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.564 -0.71 . . . . 0.0 111.063 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -111.6 -17.59 13.0 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.261 -0.899 . . . . 0.0 111.555 -179.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.576 ' HB3' HD22 ' A' ' 43' ' ' LEU . 6.2 m-85 -89.0 -32.24 17.71 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.274 -0.891 . . . . 0.0 110.91 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.528 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 5.3 mtp180 -49.11 -52.23 49.55 Favored Pre-proline 0 N--CA 1.497 1.91 0 O-C-N 121.307 -0.871 . . . . 0.0 111.811 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.532 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.2 Cg_endo -59.55 -28.08 86.55 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 O-C-N 123.133 1.07 . . . . 0.0 110.054 179.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.8 tmtt? -69.9 -46.44 65.44 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 108.107 -1.072 . . . . 0.0 108.107 177.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.601 ' CG1' HD21 ' A' ' 43' ' ' LEU . 41.7 mm -56.94 -34.64 44.9 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.051 179.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.555 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 3.4 mmmm -70.16 -38.85 75.54 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.629 -0.67 . . . . 0.0 110.543 -177.518 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.0 t -58.29 -25.67 62.09 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.482 -0.761 . . . . 0.0 110.941 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -115.86 -24.28 8.24 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.455 -0.778 . . . . 0.0 110.853 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.728 ' HB3' HD23 ' A' ' 34' ' ' LEU . 40.3 m80 -119.96 96.25 49.35 Favored Pre-proline 0 N--CA 1.495 1.802 0 O-C-N 121.522 -0.736 . . . . 0.0 109.456 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -75.21 -29.59 7.75 Favored 'Trans proline' 0 C--N 1.315 -1.203 0 O-C-N 123.434 1.228 . . . . 0.0 110.543 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.401 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -82.72 -15.96 71.8 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.728 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -58.52 82.54 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.501 -1.0 . . . . 0.0 111.28 -179.333 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.401 ' N ' ' O ' ' A' ' 33' ' ' GLY . 66.4 m -69.94 -179.15 1.77 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.39 -0.818 . . . . 0.0 109.66 179.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 43.8 mm -56.93 -37.76 56.06 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 O-C-N 121.378 -0.826 . . . . 0.0 110.141 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -57.75 -59.39 10.91 Favored Glycine 0 N--CA 1.494 2.506 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.669 ' CB ' HD13 ' A' ' 34' ' ' LEU . 45.2 m-20 -67.8 -41.01 83.8 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.613 -0.933 . . . . 0.0 109.998 179.135 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 96.3 m -59.77 -26.93 66.11 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.217 -0.927 . . . . 0.0 110.271 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -83.81 -49.18 9.31 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.545 -0.722 . . . . 0.0 110.416 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -81.2 -12.33 59.19 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.548 -0.72 . . . . 0.0 111.975 -179.068 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.471 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -83.94 -61.56 1.79 Allowed 'General case' 0 N--CA 1.5 2.04 0 O-C-N 120.998 -1.064 . . . . 0.0 109.704 179.542 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.601 HD21 ' CG1' ' A' ' 27' ' ' ILE . 61.8 mt -52.18 -24.51 7.25 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.457 -0.777 . . . . 0.0 111.182 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.1 -39.75 83.61 Favored Glycine 0 N--CA 1.493 2.434 0 N-CA-C 109.728 -1.349 . . . . 0.0 109.728 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -56.71 -33.85 66.88 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.467 -1.019 . . . . 0.0 110.584 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 9.6 mtt -75.82 -51.26 12.96 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.601 -0.687 . . . . 0.0 110.18 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -47.69 -38.97 16.19 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.593 -0.692 . . . . 0.0 111.602 -179.233 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.0 t -81.83 -27.13 33.76 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.33 -0.856 . . . . 0.0 110.341 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -63.61 -41.95 98.27 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.544 -0.722 . . . . 0.0 110.312 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.2 169.33 7.24 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.515 -0.74 . . . . 0.0 109.941 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.6 m -155.52 107.16 2.59 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.493 -0.754 . . . . 0.0 110.529 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 51.92 42.05 29.94 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.475 -0.765 . . . . 0.0 110.915 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.9 mttm -139.3 -76.37 0.35 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.548 -0.72 . . . . 0.0 110.348 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -61.98 -25.98 67.94 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.508 -0.745 . . . . 0.0 110.701 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.4 ttpm? -82.89 -33.71 26.88 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.427 -0.795 . . . . 0.0 110.603 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -44.52 -52.17 18.36 Favored Pre-proline 0 N--CA 1.506 2.35 0 O-C-N 121.526 -0.734 . . . . 0.0 111.907 -179.168 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.421 ' HA ' ' NE2' ' A' ' 60' ' ' GLN . 56.1 Cg_endo -79.83 -37.53 0.45 Allowed 'Trans proline' 0 C--N 1.315 -1.186 0 O-C-N 123.262 1.138 . . . . 0.0 110.804 179.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -84.62 8.76 15.71 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.571 -0.706 . . . . 0.0 112.034 -178.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.03 -24.28 13.23 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 120.955 -1.091 . . . . 0.0 110.19 179.511 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.421 ' NE2' ' HA ' ' A' ' 57' ' ' PRO . 12.1 pt20 -74.87 -26.6 59.79 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.494 -0.754 . . . . 0.0 110.137 179.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.416 ' CG ' HD13 ' A' ' 18' ' ' LEU . 42.1 tttt -57.21 -43.3 82.67 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.569 -0.707 . . . . 0.0 110.5 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.621 ' HB1' ' O ' ' A' ' 13' ' ' PRO . . . -73.63 -11.18 60.34 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.452 -0.78 . . . . 0.0 110.774 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.92 -3.52 57.1 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.249 -0.907 . . . . 0.0 110.515 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 64.8 mmtt -97.55 -33.16 11.46 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.254 -0.904 . . . . 0.0 109.655 179.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.9 mp -84.11 5.44 26.11 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.842 -0.536 . . . . 0.0 110.964 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -98.99 -32.79 11.11 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.333 -0.855 . . . . 0.0 109.331 179.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -63.27 -46.67 85.76 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 120.237 -0.585 . . . . 0.0 110.079 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 22.0 tptt -71.29 -63.84 1.03 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.469 -0.769 . . . . 0.0 109.6 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.442 ' CD2' ' HB2' ' A' ' 9' ' ' PRO . 24.4 t80 -36.06 -49.27 0.64 Allowed 'General case' 0 N--CA 1.509 2.486 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -179.296 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -67.16 -32.18 73.1 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.464 -0.773 . . . . 0.0 111.377 -179.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.7 ttmt -95.73 -23.79 16.81 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.323 -0.861 . . . . 0.0 111.703 -178.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -92.14 -24.9 18.95 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.291 -0.881 . . . . 0.0 111.334 -178.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.406 HG22 ' O ' ' A' ' 69' ' ' TYR . 4.5 tp . . . . . 0 N--CA 1.495 1.812 0 O-C-N 121.433 -0.792 . . . . 0.0 110.93 -179.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo . . . . . 0 N--CA 1.485 0.996 0 N-CA-C 110.229 -0.72 . . . . 0.0 110.229 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -128.82 31.43 4.94 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.553 -0.717 . . . . 0.0 110.514 -179.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.1 mtt85 -161.97 85.5 1.6 Allowed Pre-proline 0 N--CA 1.494 1.775 0 O-C-N 121.815 -0.553 . . . . 0.0 110.042 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.403 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.2 Cg_endo -82.24 118.14 2.92 Favored 'Trans proline' 0 C--N 1.317 -1.097 0 O-C-N 123.411 1.216 . . . . 0.0 110.339 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.729 ' HB2' HD21 ' A' ' 18' ' ' LEU . 46.9 Cg_endo -80.45 173.56 12.23 Favored 'Trans proline' 0 C--N 1.318 -1.04 0 O-C-N 123.278 1.146 . . . . 0.0 110.099 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.544 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 41.0 t -166.84 61.29 0.09 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.5 -0.75 . . . . 0.0 110.501 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.544 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 68.27 -77.47 0.05 OUTLIER 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.127 -0.983 . . . . 0.0 110.041 -179.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -50.66 -45.28 57.87 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.194 -0.941 . . . . 0.0 110.893 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -60.84 -29.7 69.66 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 120.201 -0.599 . . . . 0.0 109.801 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.729 HD21 ' HB2' ' A' ' 13' ' ' PRO . 35.4 mt -80.68 -36.54 32.2 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.542 -0.724 . . . . 0.0 110.219 -179.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.499 ' CE2' ' CE2' ' A' ' 23' ' ' TYR . 18.1 t80 -69.41 -52.3 28.25 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.592 -0.692 . . . . 0.0 110.35 -179.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 4.4 t -64.43 -29.81 70.85 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.521 -0.737 . . . . 0.0 109.909 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.3 m -70.01 -15.32 63.0 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.6 -0.688 . . . . 0.0 111.536 -179.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.2 -17.64 4.25 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.034 -1.041 . . . . 0.0 112.466 -179.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.499 ' CE2' ' CE2' ' A' ' 19' ' ' PHE . 12.9 m-85 -91.27 15.11 12.63 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 120.949 -1.094 . . . . 0.0 111.551 -179.378 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.507 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 17.4 mtt180 -91.92 -42.36 0.37 Allowed Pre-proline 0 N--CA 1.489 1.485 0 O-C-N 121.278 -0.889 . . . . 0.0 112.476 179.429 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.581 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.2 Cg_endo -68.08 -16.19 44.37 Favored 'Trans proline' 0 N--CA 1.49 1.298 0 O-C-N 122.759 0.873 . . . . 0.0 110.386 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -73.16 -51.78 16.59 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 177.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 40.3 mm -52.54 -29.07 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 CA-C-O 121.304 0.573 . . . . 0.0 110.495 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.581 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 6.4 mmmm -75.19 -32.68 61.28 Favored 'General case' 0 N--CA 1.496 1.845 0 C-N-CA 120.091 -0.643 . . . . 0.0 110.214 -177.359 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.9 t -62.59 -25.82 68.28 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.576 -0.702 . . . . 0.0 110.422 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -118.2 -19.39 9.02 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.539 -0.726 . . . . 0.0 111.14 -179.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.755 ' HB3' HD23 ' A' ' 34' ' ' LEU . 34.1 m80 -124.4 95.71 42.78 Favored Pre-proline 0 N--CA 1.498 1.97 0 O-C-N 121.294 -0.878 . . . . 0.0 109.706 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -75.57 -33.95 3.7 Favored 'Trans proline' 0 C--N 1.316 -1.163 0 O-C-N 123.472 1.249 . . . . 0.0 110.248 -179.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.411 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -77.03 -18.36 78.75 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.755 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -57.21 83.78 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.491 -1.005 . . . . 0.0 111.297 -179.287 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.411 ' N ' ' O ' ' A' ' 33' ' ' GLY . 63.9 m -75.14 171.01 14.9 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.487 -0.758 . . . . 0.0 109.848 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.0 mm -53.1 -27.57 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 121.343 -0.848 . . . . 0.0 110.303 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -61.22 -67.07 2.29 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.207 -1.557 . . . . 0.0 109.207 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.454 ' HB3' HD13 ' A' ' 34' ' ' LEU . 7.5 t70 -71.87 -28.55 63.61 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.529 -0.983 . . . . 0.0 110.679 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 86.8 m -65.89 -33.79 76.65 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.36 -0.838 . . . . 0.0 110.159 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.63 -39.35 67.28 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.56 -0.712 . . . . 0.0 110.276 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -91.51 -12.11 35.48 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.6 -0.687 . . . . 0.0 111.597 -179.577 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.404 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 14.0 tptt -77.61 -59.29 2.84 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.042 -1.036 . . . . 0.0 109.731 179.499 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 34.5 mt -47.28 -28.32 1.91 Allowed 'General case' 0 N--CA 1.504 2.242 0 O-C-N 121.554 -0.716 . . . . 0.0 111.416 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -64.28 -35.07 91.5 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.2 -1.56 . . . . 0.0 109.2 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -50.83 -36.08 35.66 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.535 -0.979 . . . . 0.0 111.037 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 34.0 mtt -86.62 -40.98 14.63 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.522 -0.736 . . . . 0.0 110.237 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . 0.442 ' CH2' ' HG2' ' A' ' 55' ' ' LYS . 73.1 t-105 -55.34 -22.52 19.55 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.551 -0.718 . . . . 0.0 111.028 -179.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 66.6 p -93.55 -33.3 13.8 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.286 -0.884 . . . . 0.0 110.166 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -63.42 -36.72 84.68 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.561 -0.712 . . . . 0.0 110.015 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -63.04 152.66 36.34 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.583 -0.698 . . . . 0.0 110.194 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 9.3 t -101.26 -152.61 0.43 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.685 -0.634 . . . . 0.0 109.423 179.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -83.51 55.44 3.2 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.397 -0.814 . . . . 0.0 110.023 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 39.6 mttt -132.24 -48.92 0.92 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.415 -0.803 . . . . 0.0 110.324 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -67.86 -28.1 67.25 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.532 -0.73 . . . . 0.0 110.774 -179.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.442 ' HG2' ' CH2' ' A' ' 47' ' ' TRP . 18.7 mtmt -79.79 -36.74 36.58 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.372 -0.83 . . . . 0.0 110.572 -179.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -44.22 -53.37 14.01 Favored Pre-proline 0 N--CA 1.507 2.385 0 O-C-N 121.505 -0.747 . . . . 0.0 112.33 -178.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -77.2 -37.33 1.07 Allowed 'Trans proline' 0 C--N 1.315 -1.226 0 O-C-N 123.129 1.068 . . . . 0.0 111.258 -179.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.48 -5.27 58.6 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.454 -0.779 . . . . 0.0 112.026 -178.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.96 -24.1 21.37 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.992 -1.068 . . . . 0.0 111.072 -179.328 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -78.47 -22.09 48.07 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.325 -0.859 . . . . 0.0 110.626 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 73.8 tttt -64.7 -42.35 95.35 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.365 -0.834 . . . . 0.0 109.803 179.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.551 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -80.86 -15.14 57.14 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.558 -0.714 . . . . 0.0 110.068 179.106 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.34 -35.38 75.52 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.379 -0.826 . . . . 0.0 110.029 179.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -72.62 -62.81 1.31 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.454 -0.779 . . . . 0.0 109.783 179.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.484 HD22 ' HG3' ' A' ' 13' ' ' PRO . 5.0 mp -51.22 -24.05 3.97 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.443 -0.786 . . . . 0.0 111.25 -179.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 10.9 tttt -70.36 -52.54 21.84 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.395 -0.816 . . . . 0.0 109.506 179.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -62.19 -50.33 72.25 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.609 -0.682 . . . . 0.0 109.543 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -58.45 -20.62 46.47 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.557 -0.715 . . . . 0.0 110.548 179.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.511 ' O ' HG22 ' A' ' 73' ' ' ILE . 23.4 t80 -86.82 -58.31 2.65 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.449 -0.782 . . . . 0.0 110.026 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -69.37 -32.67 71.86 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.629 -0.669 . . . . 0.0 111.868 -178.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.0 mmtm -85.47 -14.34 46.4 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.267 -0.895 . . . . 0.0 111.823 -178.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -107.31 -20.69 13.2 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.143 -0.973 . . . . 0.0 111.34 -179.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.511 HG22 ' O ' ' A' ' 69' ' ' TYR . 2.7 tp . . . . . 0 N--CA 1.497 1.883 0 O-C-N 121.3 -0.875 . . . . 0.0 110.825 -179.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo . . . . . 0 N--CA 1.484 0.938 0 N-CA-C 110.425 -0.644 . . . . 0.0 110.425 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.48 -166.91 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.586 -0.696 . . . . 0.0 109.917 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -60.94 146.19 87.82 Favored Pre-proline 0 N--CA 1.496 1.872 0 O-C-N 121.509 -0.744 . . . . 0.0 110.085 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.429 ' HD3' ' CZ ' ' A' ' 69' ' ' TYR . 47.0 Cg_endo -74.21 124.41 8.99 Favored 'Trans proline' 0 C--N 1.317 -1.13 0 O-C-N 123.299 1.157 . . . . 0.0 110.159 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.725 ' HB2' HD21 ' A' ' 18' ' ' LEU . 47.2 Cg_endo -81.43 -179.93 5.33 Favored 'Trans proline' 0 C--N 1.318 -1.055 0 O-C-N 123.286 1.15 . . . . 0.0 110.079 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.555 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 38.1 t -168.93 62.16 0.06 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.461 -0.775 . . . . 0.0 110.811 -179.766 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.644 ' HB2' ' HA ' ' A' ' 59' ' ' GLU . . . 69.6 -77.65 0.05 Allowed 'General case' 0 N--CA 1.503 2.203 0 O-C-N 120.945 -1.097 . . . . 0.0 110.533 -179.783 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.443 ' CE2' ' CD1' ' A' ' 47' ' ' TRP . 3.3 t80 -49.49 -46.93 48.83 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.12 -0.987 . . . . 0.0 111.114 -179.578 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -60.31 -28.29 68.0 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.551 -0.718 . . . . 0.0 110.281 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.725 HD21 ' HB2' ' A' ' 13' ' ' PRO . 23.7 mt -83.99 -35.63 23.77 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.352 -0.843 . . . . 0.0 110.532 -179.37 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.485 ' CE1' ' CE1' ' A' ' 23' ' ' TYR . 59.0 t80 -71.93 -52.68 16.01 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.531 -0.731 . . . . 0.0 110.718 -179.214 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.556 ' SG ' HD13 ' A' ' 43' ' ' LEU . 36.4 t -56.78 -55.16 37.88 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.395 -0.816 . . . . 0.0 110.658 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 9.2 t -55.35 -23.99 27.01 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.502 -0.749 . . . . 0.0 110.989 -179.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -98.97 -21.19 16.38 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.4 -0.812 . . . . 0.0 111.288 -179.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.485 ' CE1' ' CE1' ' A' ' 19' ' ' PHE . 5.6 m-85 -100.11 15.93 25.75 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.349 -0.845 . . . . 0.0 111.352 -179.364 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.506 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 0.5 OUTLIER -92.25 -42.92 0.36 Allowed Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.314 -0.867 . . . . 0.0 112.744 179.663 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.603 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.2 Cg_endo -67.36 -17.94 49.64 Favored 'Trans proline' 0 N--CA 1.491 1.344 0 O-C-N 122.798 0.893 . . . . 0.0 110.493 -178.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? -71.78 -49.34 39.72 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 178.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 26.4 mm -56.06 -30.13 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 CA-C-O 121.257 0.551 . . . . 0.0 110.628 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.603 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 6.0 mmmm -73.84 -34.98 64.75 Favored 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 120.058 -0.657 . . . . 0.0 110.259 -177.236 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.9 t -62.76 -24.19 67.58 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.472 -0.767 . . . . 0.0 110.647 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -118.33 -16.57 9.62 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.415 -0.803 . . . . 0.0 111.194 -179.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.707 ' HB3' HD23 ' A' ' 34' ' ' LEU . 41.6 m80 -127.33 95.24 36.5 Favored Pre-proline 0 N--CA 1.498 1.949 0 O-C-N 121.351 -0.843 . . . . 0.0 109.578 179.594 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -74.95 -35.91 2.91 Favored 'Trans proline' 0 C--N 1.315 -1.231 0 O-C-N 123.492 1.259 . . . . 0.0 110.342 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.408 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -74.9 -19.07 80.1 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 110.099 -1.2 . . . . 0.0 110.099 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.707 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -57.2 83.81 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.584 -0.951 . . . . 0.0 111.312 -179.374 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.408 ' N ' ' O ' ' A' ' 33' ' ' GLY . 46.7 t -72.71 175.99 5.95 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.422 -0.799 . . . . 0.0 109.542 179.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 43.0 mm -56.48 -29.82 29.81 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 O-C-N 121.362 -0.836 . . . . 0.0 110.122 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.31 -64.91 3.83 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.445 ' HB3' HD13 ' A' ' 34' ' ' LEU . 0.6 OUTLIER -71.65 -31.81 67.24 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.66 -0.906 . . . . 0.0 110.564 179.803 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.5 m -67.09 -32.2 73.19 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.387 -0.821 . . . . 0.0 109.901 179.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.09 -35.34 69.2 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.621 -0.674 . . . . 0.0 109.914 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -97.92 -12.68 21.79 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.602 -0.686 . . . . 0.0 111.764 -179.422 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.431 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 6.1 tptt -85.16 5.18 31.07 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.044 -1.035 . . . . 0.0 110.528 179.377 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.556 HD13 ' SG ' ' A' ' 20' ' ' CYS . 18.3 mt -101.8 -33.51 9.79 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.029 -1.044 . . . . 0.0 109.316 179.168 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -66.25 -30.31 76.52 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.391 -1.484 . . . . 0.0 109.391 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.53 -41.39 63.44 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.38 -1.071 . . . . 0.0 110.679 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 11.6 mmt -87.03 -42.78 12.82 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.59 -0.694 . . . . 0.0 109.999 179.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . 0.443 ' CD1' ' CE2' ' A' ' 16' ' ' PHE . 72.9 t-105 -55.74 -23.76 31.13 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.505 -0.747 . . . . 0.0 110.723 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.4 t -85.79 -35.68 20.56 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.366 -0.834 . . . . 0.0 109.997 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -63.45 -33.67 76.08 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.66 -0.65 . . . . 0.0 109.839 179.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 89.8 mm-40 -63.32 151.26 41.23 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.676 -0.64 . . . . 0.0 110.094 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 88.6 p -103.06 -153.02 0.46 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.733 -0.605 . . . . 0.0 109.578 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -82.7 56.4 3.36 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.342 -0.849 . . . . 0.0 110.05 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 15.3 tttt -133.74 -51.18 0.85 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.448 -0.783 . . . . 0.0 110.204 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -67.78 -26.19 65.98 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.542 -0.724 . . . . 0.0 110.616 -179.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.423 ' O ' ' N ' ' A' ' 59' ' ' GLU . 10.9 ttmt -82.7 -36.88 25.49 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.563 -0.711 . . . . 0.0 110.668 -179.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -43.42 -52.53 13.08 Favored Pre-proline 0 N--CA 1.508 2.466 0 O-C-N 121.455 -0.778 . . . . 0.0 112.47 -178.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -78.34 -37.45 0.74 Allowed 'Trans proline' 0 C--N 1.315 -1.218 0 O-C-N 123.129 1.068 . . . . 0.0 111.848 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -84.66 -10.38 57.37 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.345 -0.847 . . . . 0.0 112.409 -177.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.644 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -85.46 -26.9 26.05 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.064 -1.022 . . . . 0.0 110.933 -179.036 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -75.4 -18.26 59.98 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.435 -0.791 . . . . 0.0 110.947 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 59.2 tttt -65.02 -43.67 91.68 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.278 -0.888 . . . . 0.0 110.204 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.551 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -76.38 -12.84 60.12 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.494 -0.754 . . . . 0.0 110.328 179.393 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.96 -40.83 94.85 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.31 -0.869 . . . . 0.0 110.42 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -69.87 -62.39 1.4 Allowed 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.237 -0.914 . . . . 0.0 109.705 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.6 mp -46.29 -24.27 0.45 Allowed 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.606 -0.684 . . . . 0.0 112.142 -179.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.5 tptt -71.33 -45.39 63.07 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.295 -0.878 . . . . 0.0 109.517 179.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -66.1 -57.39 7.78 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.71 -0.619 . . . . 0.0 109.873 179.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 59.1 mttt -54.83 -25.47 28.65 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.56 -0.713 . . . . 0.0 110.71 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.603 ' O ' HG22 ' A' ' 73' ' ' ILE . 46.0 t80 -78.12 -66.19 0.88 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.517 -0.74 . . . . 0.0 109.611 179.514 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -58.58 -22.56 56.3 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.728 -0.608 . . . . 0.0 111.288 -179.267 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 39.2 mttt -93.79 -18.84 21.61 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.288 -0.883 . . . . 0.0 111.574 -179.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -110.04 -27.06 9.38 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.249 -0.907 . . . . 0.0 111.02 -179.376 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.603 HG22 ' O ' ' A' ' 69' ' ' TYR . 4.7 tp . . . . . 0 N--CA 1.495 1.814 0 O-C-N 121.389 -0.819 . . . . 0.0 110.459 -179.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo . . . . . 0 N--CA 1.485 1.011 0 N-CA-C 110.727 -0.528 . . . . 0.0 110.727 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.26 -165.14 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.593 -0.692 . . . . 0.0 110.432 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 7.5 mpt_? -56.83 148.56 47.67 Favored Pre-proline 0 N--CA 1.498 1.953 0 O-C-N 121.455 -0.778 . . . . 0.0 110.732 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.425 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.5 Cg_endo -79.26 126.65 7.05 Favored 'Trans proline' 0 C--N 1.317 -1.1 0 O-C-N 123.387 1.204 . . . . 0.0 110.069 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.56 ' HB2' HD21 ' A' ' 18' ' ' LEU . 49.2 Cg_endo -81.68 178.45 6.56 Favored 'Trans proline' 0 C--N 1.318 -1.067 0 O-C-N 123.266 1.14 . . . . 0.0 110.379 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.532 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 14.7 t -160.23 63.33 0.33 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.502 -0.748 . . . . 0.0 110.526 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.532 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 67.19 -76.42 0.05 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.092 -1.005 . . . . 0.0 109.914 -179.37 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.419 ' CD1' ' CD1' ' A' ' 47' ' ' TRP . 18.6 t80 -51.58 -42.54 61.97 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.326 -0.858 . . . . 0.0 110.814 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -62.62 -29.16 70.4 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.696 -0.627 . . . . 0.0 109.357 179.382 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.56 HD21 ' HB2' ' A' ' 13' ' ' PRO . 45.0 mt -81.36 -40.35 23.66 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.67 -0.644 . . . . 0.0 110.276 -179.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -63.4 -49.74 72.58 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.485 -0.759 . . . . 0.0 109.865 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.594 ' HA ' HD22 ' A' ' 43' ' ' LEU . 9.0 t -60.85 -27.52 68.16 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.621 -0.674 . . . . 0.0 109.743 179.422 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 10.6 t -102.9 20.81 16.75 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.587 -0.696 . . . . 0.0 110.875 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -142.26 -12.01 0.83 Allowed 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.19 -0.944 . . . . 0.0 112.099 179.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -119.23 24.38 10.78 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.854 -1.154 . . . . 0.0 110.862 -179.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.572 ' HG2' HD11 ' A' ' 43' ' ' LEU . 8.0 mtt180 -85.45 -45.93 0.63 Allowed Pre-proline 0 N--CA 1.489 1.485 0 O-C-N 121.512 -0.742 . . . . 0.0 112.126 179.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.558 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.7 Cg_endo -66.91 -14.76 44.94 Favored 'Trans proline' 0 N--CA 1.49 1.281 0 O-C-N 122.925 0.961 . . . . 0.0 110.675 -179.11 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.84 -53.07 11.04 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 177.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 27.1 mm -52.03 -31.73 14.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 CA-C-O 121.417 0.627 . . . . 0.0 110.48 179.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.558 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.4 mmmm -72.71 -37.28 67.85 Favored 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.225 -177.39 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 26.4 t -58.64 -25.09 62.37 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.495 -0.753 . . . . 0.0 110.764 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -117.52 -21.58 8.53 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.531 -0.73 . . . . 0.0 110.96 -179.59 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.706 ' HB3' HD23 ' A' ' 34' ' ' LEU . 41.0 m80 -121.7 96.59 47.2 Favored Pre-proline 0 N--CA 1.496 1.857 0 O-C-N 121.247 -0.908 . . . . 0.0 109.783 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -75.23 -37.9 1.73 Allowed 'Trans proline' 0 C--N 1.315 -1.195 0 O-C-N 123.446 1.235 . . . . 0.0 110.433 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.32 -9.41 85.78 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 110.452 -1.059 . . . . 0.0 110.452 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.706 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -64.52 82.34 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.163 -1.198 . . . . 0.0 110.33 -179.882 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.6 t -76.49 173.06 11.97 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.503 -0.748 . . . . 0.0 109.703 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 40.0 mm -50.94 -29.72 8.03 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.186 0 O-C-N 121.271 -0.893 . . . . 0.0 110.6 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.87 -75.29 0.29 Allowed Glycine 0 N--CA 1.492 2.389 0 N-CA-C 109.069 -1.612 . . . . 0.0 109.069 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.439 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 29.3 t70 -66.2 -18.84 65.6 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.701 -0.882 . . . . 0.0 111.039 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 36.3 m -73.95 -45.58 49.43 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.243 -0.91 . . . . 0.0 109.954 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -52.32 -44.83 65.33 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.442 -0.787 . . . . 0.0 110.15 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.401 ' CD ' ' HA ' ' A' ' 38' ' ' ASP . 0.5 OUTLIER -80.32 -11.19 59.74 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.76 -0.587 . . . . 0.0 111.243 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.439 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -82.0 2.47 30.76 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 120.93 -1.106 . . . . 0.0 110.815 179.111 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.594 HD22 ' HA ' ' A' ' 20' ' ' CYS . 9.4 mt -106.34 -30.35 9.2 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.204 -0.935 . . . . 0.0 109.599 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -78.99 -42.11 12.99 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 108.854 -1.698 . . . . 0.0 108.854 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -55.11 -42.89 73.52 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.533 -0.98 . . . . 0.0 110.401 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 17.6 mmt -74.18 -50.5 18.98 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.571 -0.706 . . . . 0.0 109.535 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . 0.419 ' CD1' ' CD1' ' A' ' 16' ' ' PHE . 69.2 t-105 -49.61 -52.95 26.85 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.642 -0.661 . . . . 0.0 111.047 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 45.0 t -59.92 -35.48 74.99 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.407 -0.808 . . . . 0.0 110.326 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -63.58 -40.27 96.52 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.567 -0.708 . . . . 0.0 109.934 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 89.3 mm-40 -57.52 155.2 9.9 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.576 -0.702 . . . . 0.0 110.556 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 21.7 t -99.87 -150.67 0.38 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.722 -0.612 . . . . 0.0 109.511 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -89.65 47.46 1.47 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.281 -0.887 . . . . 0.0 110.275 179.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 62.0 mttt -126.8 -50.71 1.47 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.551 -0.718 . . . . 0.0 110.069 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -64.16 -24.74 67.79 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.67 -0.644 . . . . 0.0 110.405 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 66.1 tttt -81.96 -35.16 29.3 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.467 -0.771 . . . . 0.0 110.432 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -44.44 -52.22 17.89 Favored Pre-proline 0 N--CA 1.506 2.343 0 O-C-N 121.513 -0.742 . . . . 0.0 112.022 -179.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -78.96 -37.73 0.54 Allowed 'Trans proline' 0 C--N 1.315 -1.204 0 O-C-N 123.188 1.099 . . . . 0.0 110.958 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -84.53 4.29 32.64 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.38 -0.825 . . . . 0.0 112.043 -178.325 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.01 -23.89 14.77 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.072 -1.017 . . . . 0.0 110.446 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -76.36 -23.76 54.16 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.394 -0.816 . . . . 0.0 110.251 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 50.6 tttm -61.44 -39.82 92.19 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.421 -0.799 . . . . 0.0 109.856 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.489 ' HB1' ' O ' ' A' ' 13' ' ' PRO . . . -78.1 -13.06 60.01 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.6 -0.687 . . . . 0.0 110.365 179.348 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.35 1.75 35.58 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.397 -0.814 . . . . 0.0 110.291 178.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 26.3 mmtm -104.35 -30.36 10.15 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.147 -0.971 . . . . 0.0 109.735 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.476 HD12 ' N ' ' A' ' 65' ' ' LEU . 7.1 mp -86.48 1.51 51.22 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.894 -0.504 . . . . 0.0 110.592 179.102 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.5 tptt -94.38 -34.28 12.84 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.156 -0.965 . . . . 0.0 109.428 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -82.93 -11.59 58.05 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.751 -0.593 . . . . 0.0 110.394 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -105.04 -28.78 10.84 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.439 -0.788 . . . . 0.0 109.467 179.111 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.513 ' HE1' HD13 ' A' ' 73' ' ' ILE . 19.3 t80 -75.76 -54.41 6.98 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.6 -0.688 . . . . 0.0 109.59 179.575 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -68.08 -14.68 63.16 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.719 -0.613 . . . . 0.0 111.306 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 60.8 mttt -101.33 -30.53 11.44 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.256 -0.903 . . . . 0.0 110.709 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -92.48 -31.31 15.3 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.483 -0.76 . . . . 0.0 110.852 -179.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.513 HD13 ' HE1' ' A' ' 69' ' ' TYR . 3.7 tp . . . . . 0 N--CA 1.498 1.931 0 O-C-N 121.398 -0.814 . . . . 0.0 110.953 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.466 ' HB2' ' CG ' ' A' ' 69' ' ' TYR . 45.1 Cg_endo . . . . . 0 N--CA 1.483 0.896 0 N-CA-C 110.775 -0.51 . . . . 0.0 110.775 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.6 pttt -67.06 -153.92 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.575 -0.703 . . . . 0.0 109.615 179.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -57.75 138.21 82.61 Favored Pre-proline 0 N--CA 1.499 2.01 0 O-C-N 121.269 -0.895 . . . . 0.0 110.145 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -74.56 134.37 18.53 Favored 'Trans proline' 0 C--N 1.318 -1.078 0 O-C-N 123.246 1.129 . . . . 0.0 110.082 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.656 ' HB2' HD21 ' A' ' 18' ' ' LEU . 50.8 Cg_endo -80.56 179.7 5.88 Favored 'Trans proline' 0 C--N 1.318 -1.07 0 O-C-N 123.208 1.11 . . . . 0.0 110.164 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.541 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -170.0 61.65 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.398 -0.814 . . . . 0.0 110.827 -179.877 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.657 ' HB2' ' HA ' ' A' ' 59' ' ' GLU . . . 68.13 -78.71 0.04 OUTLIER 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.072 -1.018 . . . . 0.0 110.473 -179.76 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.417 ' CE2' ' CD1' ' A' ' 47' ' ' TRP . 3.9 t80 -48.65 -49.36 37.73 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.163 -0.961 . . . . 0.0 111.231 -179.463 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -57.15 -31.07 64.99 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.575 -0.703 . . . . 0.0 110.14 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.656 HD21 ' HB2' ' A' ' 13' ' ' PRO . 34.2 mt -78.57 -31.63 47.39 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.534 -0.729 . . . . 0.0 110.181 -179.779 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.502 ' CZ ' ' CZ ' ' A' ' 23' ' ' TYR . 52.1 t80 -76.79 -55.03 5.85 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.607 -0.683 . . . . 0.0 110.731 -179.306 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.8 t -57.7 -52.9 63.56 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.435 -0.791 . . . . 0.0 110.526 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 8.0 t -55.71 -24.19 33.24 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.5 -0.75 . . . . 0.0 110.855 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -98.72 -24.85 14.88 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.426 -0.796 . . . . 0.0 111.001 -179.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.658 ' HB3' HD22 ' A' ' 43' ' ' LEU . 2.2 m-85 -88.22 -36.4 16.78 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.378 -0.826 . . . . 0.0 110.685 -179.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.54 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 6.8 mtt180 -48.43 -51.38 51.74 Favored Pre-proline 0 N--CA 1.496 1.861 0 O-C-N 121.44 -0.788 . . . . 0.0 111.992 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.577 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.4 Cg_endo -60.11 -28.69 87.51 Favored 'Trans proline' 0 N--CA 1.495 1.566 0 O-C-N 123.21 1.111 . . . . 0.0 109.977 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.3 tmtt? -67.8 -44.68 76.76 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 178.022 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.635 HG13 HD21 ' A' ' 43' ' ' LEU . 46.4 mm -59.54 -23.37 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 CA-C-N 116.152 -0.477 . . . . 0.0 109.877 179.456 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.577 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.9 mmmm -83.56 -38.55 21.54 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.458 -0.777 . . . . 0.0 110.058 -177.693 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.7 t -57.43 -26.62 61.45 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.354 -0.841 . . . . 0.0 110.097 179.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -109.19 -48.05 3.32 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.611 -0.681 . . . . 0.0 109.857 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.826 ' HB3' HD23 ' A' ' 34' ' ' LEU . 14.2 m80 -103.31 103.58 35.93 Favored Pre-proline 0 N--CA 1.497 1.884 0 O-C-N 121.642 -0.661 . . . . 0.0 109.685 -179.456 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -81.38 -40.99 0.15 Allowed 'Trans proline' 0 C--N 1.314 -1.287 0 O-C-N 123.367 1.193 . . . . 0.0 109.975 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.08 -23.26 69.52 Favored Glycine 0 N--CA 1.488 2.146 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 179.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.826 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -51.79 91.76 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.529 -0.983 . . . . 0.0 110.909 179.976 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 68.7 m -74.35 175.41 7.69 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.583 -0.698 . . . . 0.0 109.755 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.508 ' H ' HD12 ' A' ' 36' ' ' ILE . 2.5 mp -59.65 -31.81 47.85 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.348 -0.845 . . . . 0.0 109.584 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.15 -61.41 7.36 Favored Glycine 0 N--CA 1.495 2.607 0 N-CA-C 109.02 -1.632 . . . . 0.0 109.02 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.678 ' HB3' HD13 ' A' ' 34' ' ' LEU . 16.5 t0 -71.36 -35.92 71.3 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.694 -0.886 . . . . 0.0 110.091 179.163 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.407 ' HB ' ' HA ' ' A' ' 36' ' ' ILE . 80.5 m -64.6 -29.9 70.92 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.138 -0.976 . . . . 0.0 109.82 179.157 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.56 -37.9 59.62 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.641 -0.662 . . . . 0.0 110.245 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.411 ' HG2' ' HA ' ' A' ' 38' ' ' ASP . 2.3 ptpt -95.87 -13.71 23.75 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.525 -0.734 . . . . 0.0 111.922 -178.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -86.04 4.49 37.77 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 120.974 -1.079 . . . . 0.0 110.626 179.7 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.658 HD22 ' HB3' ' A' ' 23' ' ' TYR . 80.1 mt -106.77 -34.27 7.33 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.262 -0.899 . . . . 0.0 109.488 179.467 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -64.57 -32.7 85.08 Favored Glycine 0 N--CA 1.493 2.476 0 N-CA-C 109.79 -1.324 . . . . 0.0 109.79 -179.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -51.18 -33.95 29.48 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.403 -1.057 . . . . 0.0 110.794 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 39.2 mtt -87.43 -41.05 13.85 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.604 -0.685 . . . . 0.0 109.888 179.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . 0.417 ' CD1' ' CE2' ' A' ' 16' ' ' PHE . 71.7 t-105 -56.19 -23.89 38.23 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.55 -0.718 . . . . 0.0 110.858 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 21.9 t -85.28 -36.08 21.1 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.48 -0.763 . . . . 0.0 110.066 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -63.03 -33.02 74.53 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.633 -0.667 . . . . 0.0 109.828 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 -64.81 149.64 49.0 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.645 -0.659 . . . . 0.0 110.12 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.6 m -104.44 -153.22 0.48 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.669 -0.644 . . . . 0.0 109.526 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.88 58.29 3.33 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.376 -0.827 . . . . 0.0 109.915 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 26.7 tttt -136.24 -50.79 0.7 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.399 -0.813 . . . . 0.0 110.297 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -69.81 -27.95 65.31 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.557 -0.715 . . . . 0.0 110.726 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.419 ' O ' ' N ' ' A' ' 59' ' ' GLU . 32.6 ttpt -80.0 -37.71 33.65 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.444 -0.785 . . . . 0.0 110.695 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -44.14 -53.01 14.56 Favored Pre-proline 0 N--CA 1.508 2.439 0 O-C-N 121.472 -0.768 . . . . 0.0 112.513 -178.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -77.66 -37.43 0.92 Allowed 'Trans proline' 0 C--N 1.315 -1.2 0 O-C-N 123.078 1.041 . . . . 0.0 111.744 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -81.86 -14.86 55.67 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.395 -0.815 . . . . 0.0 112.089 -178.111 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.657 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -82.84 -24.97 33.04 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.202 -0.936 . . . . 0.0 111.086 -178.934 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -79.83 -20.59 45.7 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.451 -0.781 . . . . 0.0 110.845 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 43.1 tttm -63.04 -48.39 78.9 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.409 -0.807 . . . . 0.0 110.195 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.65 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -81.12 -13.36 58.76 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.447 -0.783 . . . . 0.0 110.316 179.294 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.87 -28.14 69.83 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.321 -0.862 . . . . 0.0 109.154 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -81.75 -66.06 0.94 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.577 -0.702 . . . . 0.0 109.17 178.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.559 ' H ' HD12 ' A' ' 65' ' ' LEU . 3.1 mp -48.32 -22.56 0.7 Allowed 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.602 -0.687 . . . . 0.0 112.117 -179.356 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 23.9 tptt -65.49 -45.46 83.54 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.14 -0.975 . . . . 0.0 109.851 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -66.66 -54.51 22.42 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.662 -0.649 . . . . 0.0 110.349 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 68.9 mttt -56.4 -29.93 62.12 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.487 -0.758 . . . . 0.0 110.478 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.538 ' O ' HG22 ' A' ' 73' ' ' ILE . 3.8 m-85 -75.72 -70.07 0.45 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.576 -0.703 . . . . 0.0 109.834 179.652 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -49.53 -29.26 6.56 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.662 -0.649 . . . . 0.0 111.342 -179.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.8 ttmm -84.47 -58.04 2.9 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.529 -0.732 . . . . 0.0 110.47 -179.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -64.11 -30.23 71.31 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.624 -0.673 . . . . 0.0 111.112 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.538 HG22 ' O ' ' A' ' 69' ' ' TYR . 9.7 tp . . . . . 0 N--CA 1.496 1.829 0 O-C-N 121.351 -0.843 . . . . 0.0 110.442 -179.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo . . . . . 0 N--CA 1.484 0.938 0 N-CA-C 110.458 -0.631 . . . . 0.0 110.458 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.5 pttt -60.12 -162.44 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.664 -0.648 . . . . 0.0 110.337 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.68 144.59 98.8 Favored Pre-proline 0 N--CA 1.495 1.821 0 O-C-N 121.421 -0.799 . . . . 0.0 110.069 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.405 ' HG3' ' CE2' ' A' ' 69' ' ' TYR . 49.3 Cg_endo -75.24 131.0 13.54 Favored 'Trans proline' 0 C--N 1.317 -1.082 0 O-C-N 123.296 1.156 . . . . 0.0 109.802 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.674 ' CB ' HD21 ' A' ' 18' ' ' LEU . 48.9 Cg_endo -81.26 -176.75 3.27 Favored 'Trans proline' 0 C--N 1.317 -1.115 0 O-C-N 123.197 1.104 . . . . 0.0 110.172 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.535 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 76.4 p -165.48 59.21 0.11 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.513 -0.742 . . . . 0.0 110.807 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.535 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 68.52 -77.09 0.05 Allowed 'General case' 0 N--CA 1.504 2.258 0 O-C-N 121.12 -0.987 . . . . 0.0 110.662 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -46.99 -51.6 16.74 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.299 -0.876 . . . . 0.0 111.47 -179.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -57.55 -36.95 72.31 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.497 -0.752 . . . . 0.0 109.945 179.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.674 HD21 ' CB ' ' A' ' 13' ' ' PRO . 36.1 mt -70.08 -38.63 75.75 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.619 -0.676 . . . . 0.0 110.347 -179.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.492 ' CE1' ' CE1' ' A' ' 23' ' ' TYR . 63.1 t80 -71.94 -53.05 14.3 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.517 -0.739 . . . . 0.0 110.621 -179.507 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 34.6 t -56.83 -53.82 53.46 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.368 -0.833 . . . . 0.0 110.657 -179.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 11.8 t -56.22 -29.01 60.39 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.534 -0.729 . . . . 0.0 110.822 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -90.82 -27.75 18.65 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.468 -0.77 . . . . 0.0 110.798 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.492 ' CE1' ' CE1' ' A' ' 19' ' ' PHE . 9.1 m-85 -94.74 14.69 20.43 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.511 -0.743 . . . . 0.0 111.287 -179.433 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.527 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 4.2 mtp180 -88.59 -43.82 0.46 Allowed Pre-proline 0 N--CA 1.488 1.446 0 O-C-N 121.253 -0.904 . . . . 0.0 112.53 179.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.566 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 37.8 Cg_endo -65.66 -17.41 56.67 Favored 'Trans proline' 0 N--CA 1.491 1.365 0 O-C-N 122.865 0.929 . . . . 0.0 110.563 -178.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.8 tmtt? -72.02 -50.43 28.64 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 177.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 24.5 mm -54.86 -33.79 29.23 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 CA-C-O 121.224 0.535 . . . . 0.0 110.631 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.566 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 6.2 mmmm -71.01 -38.35 72.64 Favored 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 120.121 -0.632 . . . . 0.0 110.321 -177.073 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.6 t -58.65 -24.47 61.22 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.515 -0.741 . . . . 0.0 110.797 -179.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -117.29 -23.04 7.99 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.435 -0.79 . . . . 0.0 110.978 -179.565 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.747 ' HB3' HD23 ' A' ' 34' ' ' LEU . 43.0 m80 -120.56 96.58 48.91 Favored Pre-proline 0 N--CA 1.495 1.82 0 O-C-N 121.342 -0.848 . . . . 0.0 109.709 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -75.59 -29.07 7.68 Favored 'Trans proline' 0 C--N 1.315 -1.226 0 O-C-N 123.416 1.219 . . . . 0.0 110.54 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -85.04 -12.2 74.55 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 110.571 -1.012 . . . . 0.0 110.571 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.747 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -61.56 83.67 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.257 -1.143 . . . . 0.0 110.658 -179.543 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 71.5 p -72.52 171.1 13.0 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.512 -0.742 . . . . 0.0 109.847 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.586 ' H ' HD12 ' A' ' 36' ' ' ILE . 2.7 mp -53.6 -28.6 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.122 0 O-C-N 121.281 -0.887 . . . . 0.0 109.944 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.49 -71.13 0.83 Allowed Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.242 -1.543 . . . . 0.0 109.242 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.486 ' HB3' HD13 ' A' ' 34' ' ' LEU . 15.0 t70 -66.53 -27.41 67.74 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.698 -0.883 . . . . 0.0 110.456 179.551 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.433 ' HB ' ' HA ' ' A' ' 36' ' ' ILE . 33.2 m -67.38 -27.72 67.34 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.494 -0.754 . . . . 0.0 109.893 179.404 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.38 -47.37 23.52 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.574 -0.704 . . . . 0.0 109.685 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.69 -17.1 52.18 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.605 -0.684 . . . . 0.0 111.377 -179.64 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.413 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 11.0 tptt -76.66 -59.15 2.9 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.111 -0.993 . . . . 0.0 109.885 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.42 HD12 ' O ' ' A' ' 39' ' ' THR . 54.7 mt -47.03 -27.42 1.32 Allowed 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.648 -0.657 . . . . 0.0 111.544 -179.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.91 -36.2 91.79 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.182 -1.567 . . . . 0.0 109.182 179.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -51.01 -37.36 44.65 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.508 -0.995 . . . . 0.0 111.074 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 65.0 mtt -82.47 -42.8 18.03 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.598 -0.689 . . . . 0.0 110.318 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 69.9 t-105 -49.37 -32.93 12.43 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.523 -0.736 . . . . 0.0 111.585 -179.199 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.3 t -93.02 -24.06 18.47 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.306 -0.872 . . . . 0.0 110.592 -179.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -64.02 -43.3 96.02 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.413 -0.805 . . . . 0.0 109.993 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 52.2 mm-40 -61.83 157.62 17.74 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.719 -0.613 . . . . 0.0 110.329 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.3 t -87.23 -147.7 0.14 Allowed 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -83.58 54.11 2.75 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.181 -0.949 . . . . 0.0 110.125 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.0 tttt -129.62 -37.08 1.6 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.465 -0.772 . . . . 0.0 110.596 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -58.61 -38.62 78.4 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.304 -0.873 . . . . 0.0 110.791 -179.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -92.92 24.13 3.84 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.35 -0.844 . . . . 0.0 111.458 -179.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.454 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 4.4 mm-40 -98.05 -56.89 0.18 Allowed Pre-proline 0 N--CA 1.498 1.959 0 O-C-N 121.219 -0.926 . . . . 0.0 110.539 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.454 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.7 Cg_endo -83.23 -32.16 0.55 Allowed 'Trans proline' 0 N--CA 1.482 0.84 0 O-C-N 122.817 0.904 . . . . 0.0 110.666 179.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -82.09 -0.85 46.47 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.493 -0.754 . . . . 0.0 111.769 -178.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.42 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -92.54 -24.52 18.73 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.084 -1.01 . . . . 0.0 110.814 -179.577 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -79.26 -23.91 43.34 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.443 -0.785 . . . . 0.0 110.332 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -61.66 -44.83 96.21 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.432 -0.792 . . . . 0.0 109.92 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.517 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -70.22 -11.43 60.89 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.598 -0.689 . . . . 0.0 110.482 179.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -88.57 7.45 33.19 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.262 -0.899 . . . . 0.0 110.315 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 58.9 mmtt -107.02 -34.39 7.19 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.222 -0.923 . . . . 0.0 109.111 178.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.413 ' N ' HD12 ' A' ' 65' ' ' LEU . 6.2 mp -81.04 -4.12 54.14 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.984 -0.448 . . . . 0.0 110.342 178.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.9 tppt? -80.82 -31.53 35.54 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.264 -0.898 . . . . 0.0 109.301 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -69.23 -63.26 1.1 Allowed 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 119.876 -0.73 . . . . 0.0 109.603 179.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -55.2 -24.21 26.04 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.531 -0.731 . . . . 0.0 111.107 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.514 ' O ' HG22 ' A' ' 73' ' ' ILE . 29.5 t80 -79.18 -69.56 0.57 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.306 -0.871 . . . . 0.0 110.29 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -62.9 -14.06 41.93 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.551 -0.718 . . . . 0.0 111.768 -179.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.7 tttt -98.24 -27.02 14.34 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.104 -0.998 . . . . 0.0 110.893 -179.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -104.39 -24.56 13.05 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.434 -0.791 . . . . 0.0 111.079 -179.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.514 HG22 ' O ' ' A' ' 69' ' ' TYR . 3.2 tp . . . . . 0 N--CA 1.497 1.882 0 O-C-N 121.407 -0.808 . . . . 0.0 110.421 -179.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo . . . . . 0 N--CA 1.484 0.94 0 N-CA-C 110.443 -0.637 . . . . 0.0 110.443 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.6 pttm -65.6 -155.49 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.599 -0.688 . . . . 0.0 109.658 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -55.44 145.88 46.06 Favored Pre-proline 0 N--CA 1.499 2.015 0 O-C-N 121.291 -0.881 . . . . 0.0 110.365 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -73.57 126.28 10.75 Favored 'Trans proline' 0 C--N 1.316 -1.162 0 O-C-N 123.378 1.199 . . . . 0.0 110.319 -179.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.476 ' C ' ' HB1' ' A' ' 62' ' ' ALA . 48.8 Cg_endo -81.57 173.44 11.41 Favored 'Trans proline' 0 C--N 1.318 -1.043 0 O-C-N 123.239 1.126 . . . . 0.0 109.799 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.579 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 33.5 t -171.83 64.57 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.429 -0.794 . . . . 0.0 111.001 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.579 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 71.32 -74.26 0.09 Allowed 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.124 -0.985 . . . . 0.0 110.876 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -46.67 -52.87 12.83 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.274 -0.891 . . . . 0.0 111.556 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -58.31 -39.24 78.84 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.575 -0.703 . . . . 0.0 109.865 179.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.586 HD11 ' HB2' ' A' ' 62' ' ' ALA . 48.4 mt -64.59 -42.94 95.26 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.667 -0.646 . . . . 0.0 109.814 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.501 ' CE1' ' CE1' ' A' ' 23' ' ' TYR . 80.9 t80 -68.71 -51.73 38.38 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.647 -0.658 . . . . 0.0 110.268 -179.827 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.3 m -55.7 -56.05 24.97 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.545 -0.722 . . . . 0.0 110.69 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 84.8 p -55.87 -30.78 62.07 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.48 -0.762 . . . . 0.0 110.831 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -87.54 -27.31 22.68 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.464 -0.773 . . . . 0.0 110.909 -179.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.501 ' CE1' ' CE1' ' A' ' 19' ' ' PHE . 9.6 m-85 -98.87 14.85 27.46 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.458 -0.776 . . . . 0.0 111.369 -179.5 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.516 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 14.2 mtp180 -87.91 -45.01 0.49 Allowed Pre-proline 0 N--CA 1.488 1.437 0 O-C-N 121.151 -0.968 . . . . 0.0 112.505 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.562 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.0 Cg_endo -65.47 -17.61 57.88 Favored 'Trans proline' 0 N--CA 1.491 1.353 0 O-C-N 122.802 0.896 . . . . 0.0 110.539 -178.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.1 tmtm? -71.71 -49.8 36.08 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 177.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 23.7 mm -55.49 -34.14 34.1 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 CA-C-O 121.322 0.582 . . . . 0.0 110.566 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.562 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.7 mmmm -70.98 -38.6 72.75 Favored 'General case' 0 N--CA 1.497 1.886 0 C-N-CA 120.167 -0.613 . . . . 0.0 110.299 -176.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.9 t -59.91 -23.52 63.57 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.461 -0.775 . . . . 0.0 110.816 -179.564 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -117.52 -21.04 8.78 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.484 -0.76 . . . . 0.0 111.116 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.753 ' HB3' HD23 ' A' ' 34' ' ' LEU . 48.5 m80 -121.96 96.45 46.79 Favored Pre-proline 0 N--CA 1.495 1.824 0 O-C-N 121.348 -0.845 . . . . 0.0 109.784 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -75.38 -28.75 8.29 Favored 'Trans proline' 0 C--N 1.315 -1.185 0 O-C-N 123.416 1.219 . . . . 0.0 110.455 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -84.14 -13.83 73.32 Favored Glycine 0 N--CA 1.488 2.127 0 N-CA-C 110.504 -1.038 . . . . 0.0 110.504 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.753 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -61.08 82.8 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.334 -1.097 . . . . 0.0 110.892 -179.522 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 33.4 t -75.05 171.54 13.93 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.506 -0.746 . . . . 0.0 109.78 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 40.8 mm -52.12 -27.73 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.175 0 O-C-N 121.284 -0.885 . . . . 0.0 110.369 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -61.42 -71.63 0.77 Allowed Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.227 -1.549 . . . . 0.0 109.227 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.423 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 8.2 t70 -67.33 -26.04 66.3 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.628 -0.925 . . . . 0.0 110.765 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 56.2 m -68.46 -28.79 67.36 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.458 -0.777 . . . . 0.0 109.926 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.58 -47.13 34.25 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.536 -0.728 . . . . 0.0 109.747 179.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -81.49 -14.71 56.67 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.573 -0.704 . . . . 0.0 111.366 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 6.9 tptt -76.4 -58.82 3.06 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.085 -1.009 . . . . 0.0 109.727 179.686 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.409 HD11 ' CG ' ' A' ' 24' ' ' ARG . 45.0 mt -48.28 -27.09 2.29 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.493 -0.754 . . . . 0.0 111.287 -179.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.92 -38.73 96.5 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 109.17 -1.572 . . . . 0.0 109.17 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -51.7 -39.34 58.14 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.524 -0.986 . . . . 0.0 110.852 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.0 mmt -72.91 -45.63 57.07 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.617 -0.677 . . . . 0.0 109.516 179.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 51.7 t-105 -52.14 -58.16 7.41 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.671 -0.643 . . . . 0.0 110.771 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 9.0 t -59.35 -32.6 70.26 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.453 -0.779 . . . . 0.0 110.305 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -63.68 -42.33 98.04 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.574 -0.704 . . . . 0.0 109.945 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -64.43 154.93 34.21 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.651 -0.655 . . . . 0.0 110.404 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 76.2 p -99.31 -150.15 0.37 Allowed 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.94 57.41 3.06 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.203 -0.935 . . . . 0.0 110.15 179.656 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 22.5 tttt -134.99 -43.25 0.73 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.352 -0.842 . . . . 0.0 110.212 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -63.41 -32.29 73.69 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.487 -0.758 . . . . 0.0 110.56 -179.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.2 ttpt -91.83 22.97 3.86 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.332 -0.855 . . . . 0.0 111.325 -179.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.46 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 8.0 mm-40 -96.95 -59.98 0.15 Allowed Pre-proline 0 N--CA 1.497 1.881 0 O-C-N 121.103 -0.998 . . . . 0.0 110.843 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.46 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.4 Cg_endo -80.45 -30.29 2.04 Favored 'Trans proline' 0 N--CA 1.486 1.047 0 O-C-N 122.871 0.932 . . . . 0.0 110.897 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.542 ' O ' HD12 ' A' ' 18' ' ' LEU . 3.2 m-85 -82.49 -8.92 59.6 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.492 -0.755 . . . . 0.0 112.01 -178.587 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.57 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -84.3 -25.37 29.34 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.095 -1.003 . . . . 0.0 111.113 -179.331 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -79.09 -21.94 45.96 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.461 -0.774 . . . . 0.0 110.791 -179.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 44.9 tttt -66.0 -44.05 85.92 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.336 -0.853 . . . . 0.0 109.858 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.586 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -79.9 -15.13 57.96 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.534 -0.728 . . . . 0.0 110.134 179.411 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.02 -31.33 69.85 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.269 -0.894 . . . . 0.0 109.42 179.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -74.1 -62.75 1.4 Allowed 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 178.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.459 HD22 ' HG3' ' A' ' 13' ' ' PRO . 0.8 OUTLIER -43.61 -25.36 0.16 Allowed 'General case' 0 N--CA 1.506 2.336 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -179.297 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -65.02 -44.22 89.89 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.223 -0.923 . . . . 0.0 109.169 178.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -66.24 -57.4 7.65 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.755 -0.59 . . . . 0.0 109.787 179.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.7 mptm? -51.31 -31.31 21.12 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.397 -0.815 . . . . 0.0 110.718 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.55 ' O ' HG22 ' A' ' 73' ' ' ILE . 34.8 t80 -75.62 -64.37 1.09 Allowed 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 179.095 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -59.67 -17.81 37.03 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.881 -0.512 . . . . 0.0 111.322 -179.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.4 mmmt -99.47 -23.75 15.01 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.169 -0.957 . . . . 0.0 111.45 -179.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -103.95 -28.66 11.43 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.27 -0.894 . . . . 0.0 110.983 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.55 HG22 ' O ' ' A' ' 69' ' ' TYR . 3.1 tp . . . . . 0 N--CA 1.495 1.809 0 O-C-N 121.427 -0.796 . . . . 0.0 110.186 -179.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo . . . . . 0 N--CA 1.485 0.972 0 N-CA-C 110.218 -0.724 . . . . 0.0 110.218 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.53 -155.0 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.63 -0.669 . . . . 0.0 110.323 -179.715 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -61.0 133.92 92.67 Favored Pre-proline 0 N--CA 1.497 1.899 0 O-C-N 121.492 -0.755 . . . . 0.0 110.153 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.44 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.8 Cg_endo -76.82 137.72 18.08 Favored 'Trans proline' 0 C--N 1.319 -0.992 0 O-C-N 123.192 1.101 . . . . 0.0 109.847 179.4 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.674 ' CG ' HD21 ' A' ' 18' ' ' LEU . 50.3 Cg_endo -79.29 -169.41 0.79 Allowed 'Trans proline' 0 C--N 1.316 -1.177 0 O-C-N 123.174 1.092 . . . . 0.0 110.154 -179.745 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.509 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 66.5 p -163.0 63.67 0.19 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.439 -0.788 . . . . 0.0 110.92 -179.728 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.509 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 66.49 -78.06 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.002 -1.061 . . . . 0.0 110.518 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -48.47 -48.19 37.9 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.351 -0.843 . . . . 0.0 111.447 -179.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -59.78 -33.99 72.42 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.583 -0.698 . . . . 0.0 109.737 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.674 HD21 ' CG ' ' A' ' 13' ' ' PRO . 42.4 mt -72.29 -33.03 67.12 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.707 -0.621 . . . . 0.0 109.488 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.492 ' CZ ' ' CZ ' ' A' ' 23' ' ' TYR . 22.9 t80 -73.3 -52.48 13.76 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.78 -0.575 . . . . 0.0 110.489 -179.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 17.0 p -60.81 -31.79 71.18 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.477 -0.764 . . . . 0.0 110.38 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 91.8 p -71.14 -23.86 62.16 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.781 -0.574 . . . . 0.0 112.111 -178.451 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.9 -24.71 9.39 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.022 -1.049 . . . . 0.0 112.384 -178.611 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.492 ' CZ ' ' CZ ' ' A' ' 19' ' ' PHE . 4.9 m-85 -80.33 -36.93 33.51 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 120.925 -1.109 . . . . 0.0 111.099 -179.207 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.556 ' HG2' HD11 ' A' ' 43' ' ' LEU . 10.3 mtp180 -48.0 -52.91 36.85 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.319 -0.863 . . . . 0.0 112.198 -179.61 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.562 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.2 Cg_endo -59.67 -27.7 85.57 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 O-C-N 123.274 1.144 . . . . 0.0 110.261 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.8 tmtm? -69.63 -45.95 67.33 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 177.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.2 mm -57.77 -29.67 35.72 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.28 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.562 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.4 mmmm -73.09 -35.49 66.63 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 119.968 -0.693 . . . . 0.0 110.571 -177.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 28.9 t -66.27 -22.6 66.31 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.445 -0.784 . . . . 0.0 110.62 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -116.19 -16.06 11.01 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.528 -0.733 . . . . 0.0 111.142 -179.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.692 ' HB3' HD23 ' A' ' 34' ' ' LEU . 44.6 m80 -129.83 94.75 30.76 Favored Pre-proline 0 N--CA 1.497 1.889 0 O-C-N 121.306 -0.871 . . . . 0.0 109.238 179.46 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -74.72 -36.09 3.03 Favored 'Trans proline' 0 C--N 1.316 -1.148 0 O-C-N 123.514 1.27 . . . . 0.0 110.479 -179.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -75.34 -19.17 79.71 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 110.051 -1.22 . . . . 0.0 110.051 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.692 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -55.11 86.28 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.522 -0.987 . . . . 0.0 111.378 -179.385 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.404 ' N ' ' O ' ' A' ' 33' ' ' GLY . 42.8 t -80.34 171.24 15.32 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.549 -0.719 . . . . 0.0 109.471 179.552 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.44 ' O ' ' HB2' ' A' ' 40' ' ' ALA . 43.3 mm -53.33 -26.2 11.92 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 O-C-N 121.326 -0.859 . . . . 0.0 110.347 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -61.08 -71.77 0.74 Allowed Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.238 -1.545 . . . . 0.0 109.238 179.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.429 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 16.4 t70 -69.32 -28.22 66.06 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.688 -0.889 . . . . 0.0 110.502 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.433 ' OG1' HD12 ' A' ' 34' ' ' LEU . 86.6 m -68.68 -32.27 71.98 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.413 -0.804 . . . . 0.0 109.769 179.437 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.44 ' HB2' ' O ' ' A' ' 36' ' ' ILE . . . -69.89 -39.61 76.14 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 120.073 -0.651 . . . . 0.0 109.484 179.693 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -91.51 -15.12 29.24 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.644 -0.66 . . . . 0.0 111.493 -179.399 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.429 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 30.7 tptt -83.29 1.14 42.5 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.022 -1.049 . . . . 0.0 110.526 179.378 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.556 HD11 ' HG2' ' A' ' 24' ' ' ARG . 25.7 mt -97.45 -35.1 10.77 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.12 -0.987 . . . . 0.0 108.958 178.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.35 -31.98 71.75 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 108.841 -1.704 . . . . 0.0 108.841 179.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -55.35 -47.63 75.45 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.595 -0.944 . . . . 0.0 110.179 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 16.2 mtp -70.61 -48.98 52.43 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 70.0 t-105 -52.92 -58.42 7.01 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.708 -0.62 . . . . 0.0 110.555 179.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 46.6 t -60.76 -34.34 74.31 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.472 -0.767 . . . . 0.0 110.26 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -58.02 -39.11 77.52 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.603 -0.686 . . . . 0.0 110.26 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 57.5 mm-40 -67.54 164.96 17.83 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.592 -0.692 . . . . 0.0 110.075 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.1 m -150.09 107.2 3.58 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.544 -0.723 . . . . 0.0 110.17 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 53.01 47.1 25.41 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.347 -0.845 . . . . 0.0 110.655 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.9 mtpt -149.26 -64.76 0.23 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.556 -0.715 . . . . 0.0 109.86 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -59.78 -31.28 69.53 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.5 -0.75 . . . . 0.0 110.562 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.4 tttm -96.05 22.36 7.64 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.427 -0.796 . . . . 0.0 111.191 -179.447 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.436 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 1.3 mm-40 -99.1 -55.02 0.18 Allowed Pre-proline 0 N--CA 1.496 1.842 0 O-C-N 121.195 -0.941 . . . . 0.0 110.61 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.436 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.0 Cg_endo -83.73 -36.76 0.18 Allowed 'Trans proline' 0 C--N 1.321 -0.873 0 O-C-N 122.925 0.961 . . . . 0.0 110.825 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -80.6 5.33 15.76 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.539 -0.725 . . . . 0.0 111.787 -179.306 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.492 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -97.8 -20.35 17.59 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.079 -1.013 . . . . 0.0 110.619 179.943 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -77.67 -24.33 49.38 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.441 -0.787 . . . . 0.0 110.364 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.429 ' HD3' HD13 ' A' ' 18' ' ' LEU . 26.4 tttp -58.81 -45.36 90.09 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.409 -0.807 . . . . 0.0 110.027 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.7 -10.08 59.24 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.596 -0.69 . . . . 0.0 110.58 179.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -86.31 2.97 45.35 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.253 -0.905 . . . . 0.0 110.503 179.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 24.4 mmtp -105.12 -32.86 8.49 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.231 -0.918 . . . . 0.0 109.462 179.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.8 mp -80.83 4.25 19.8 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.909 -0.494 . . . . 0.0 111.039 179.553 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -97.29 -26.76 14.79 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.141 -0.974 . . . . 0.0 109.926 179.503 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -84.71 -14.52 48.13 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.521 -0.737 . . . . 0.0 110.62 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.4 mmtt -103.57 -29.19 11.28 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.309 -0.869 . . . . 0.0 109.711 179.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.548 ' O ' HG22 ' A' ' 73' ' ' ILE . 11.6 t80 -75.26 -53.34 8.95 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.63 -0.669 . . . . 0.0 109.628 179.71 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -63.99 -13.34 45.63 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.618 -0.676 . . . . 0.0 111.494 -179.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.4 mmtm -108.1 -32.42 7.53 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.129 -0.982 . . . . 0.0 110.901 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -89.69 -36.39 15.25 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.443 -0.785 . . . . 0.0 111.281 -179.079 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.548 HG22 ' O ' ' A' ' 69' ' ' TYR . 3.7 tp . . . . . 0 N--CA 1.497 1.898 0 O-C-N 121.27 -0.894 . . . . 0.0 110.864 -179.316 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.432 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 53.3 Cg_endo . . . . . 0 N--CA 1.482 0.807 0 N-CA-C 110.282 -0.699 . . . . 0.0 110.282 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -110.0 26.34 10.77 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.465 -0.772 . . . . 0.0 110.98 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.5 ttm180 -159.19 94.61 1.77 Allowed Pre-proline 0 N--CA 1.493 1.681 0 O-C-N 121.734 -0.604 . . . . 0.0 110.488 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -76.98 114.05 3.74 Favored 'Trans proline' 0 C--N 1.317 -1.127 0 O-C-N 123.491 1.259 . . . . 0.0 110.491 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.736 ' CB ' HD21 ' A' ' 18' ' ' LEU . 47.2 Cg_endo -81.04 164.65 19.8 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 O-C-N 123.282 1.149 . . . . 0.0 110.251 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.544 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 94.6 p -157.06 53.9 0.51 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.43 -0.794 . . . . 0.0 110.806 -179.677 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.636 ' HB2' ' HA ' ' A' ' 59' ' ' GLU . . . 68.12 -76.57 0.05 Allowed 'General case' 0 N--CA 1.503 2.221 0 O-C-N 121.135 -0.978 . . . . 0.0 109.993 -179.613 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -48.16 -50.62 28.21 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.315 -0.866 . . . . 0.0 111.227 -179.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -57.52 -40.09 77.97 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.596 -0.69 . . . . 0.0 109.528 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.736 HD21 ' CB ' ' A' ' 13' ' ' PRO . 49.3 mt -64.43 -44.26 91.74 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.757 -0.589 . . . . 0.0 110.242 179.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -66.3 -51.81 53.59 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.573 -0.705 . . . . 0.0 110.359 -179.538 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.483 ' SG ' HD13 ' A' ' 43' ' ' LEU . 48.1 t -66.77 -21.39 66.06 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.579 -0.7 . . . . 0.0 110.299 179.582 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.9 m -73.57 -20.63 60.57 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.383 -0.823 . . . . 0.0 111.728 -179.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -127.15 -14.28 5.48 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.017 -1.052 . . . . 0.0 112.972 -178.456 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -88.69 16.02 7.33 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 120.774 -1.204 . . . . 0.0 111.73 -178.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.531 ' HG2' HD11 ' A' ' 43' ' ' LEU . 33.2 mtp180 -92.16 -44.27 0.35 Allowed Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.197 -0.939 . . . . 0.0 112.543 179.615 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.572 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.1 Cg_endo -66.82 -15.15 46.4 Favored 'Trans proline' 0 N--CA 1.49 1.307 0 O-C-N 122.917 0.956 . . . . 0.0 110.382 -179.299 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.76 -54.28 8.42 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 177.531 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 38.2 mm -51.2 -26.02 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.985 0 O-C-N 121.89 -0.507 . . . . 0.0 110.738 179.381 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.572 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 6.8 mmmm -78.22 -31.71 49.46 Favored 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 119.84 -0.744 . . . . 0.0 110.014 -177.853 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 15.1 t -67.09 -21.96 65.84 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.563 -0.711 . . . . 0.0 110.525 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -119.54 -13.67 9.18 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.384 -0.822 . . . . 0.0 111.282 -179.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.766 ' HB3' HD23 ' A' ' 34' ' ' LEU . 38.1 m80 -130.63 94.75 28.38 Favored Pre-proline 0 N--CA 1.497 1.899 0 O-C-N 121.19 -0.944 . . . . 0.0 109.502 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -75.25 -35.45 2.96 Favored 'Trans proline' 0 C--N 1.316 -1.173 0 O-C-N 123.575 1.303 . . . . 0.0 110.061 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.15 -15.33 81.5 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 179.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.766 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.3 OUTLIER -56.62 87.78 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.327 -1.102 . . . . 0.0 110.887 -179.611 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 80.1 p -79.91 169.19 18.25 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.594 -0.691 . . . . 0.0 109.56 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 36.9 mm -50.01 -27.02 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.237 0 O-C-N 121.449 -0.782 . . . . 0.0 110.379 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.452 ' O ' ' HD3' ' A' ' 41' ' ' LYS . . . -58.95 -68.78 1.52 Allowed Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.135 -1.586 . . . . 0.0 109.135 179.554 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -78.09 -15.97 58.41 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.719 -0.871 . . . . 0.0 111.876 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.6 ' HA ' HD12 ' A' ' 34' ' ' LEU . 51.2 m -61.49 -40.88 96.18 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.023 -1.048 . . . . 0.0 109.277 179.545 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.58 -37.69 87.4 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.32 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.452 ' HD3' ' O ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -70.15 -31.72 69.35 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.789 -0.57 . . . . 0.0 110.133 -179.481 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.51 -11.75 60.55 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.26 -0.9 . . . . 0.0 110.515 179.683 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.531 HD11 ' HG2' ' A' ' 24' ' ' ARG . 77.2 mt -97.04 -27.87 14.41 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.301 -0.874 . . . . 0.0 110.172 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -89.63 -46.34 4.32 Favored Glycine 0 N--CA 1.493 2.472 0 N-CA-C 109.629 -1.389 . . . . 0.0 109.629 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -51.43 -31.9 24.62 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.388 -1.066 . . . . 0.0 110.825 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 75.7 mtp -87.77 -41.47 13.27 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.563 -0.711 . . . . 0.0 109.817 179.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -57.2 -22.2 38.99 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.609 -0.682 . . . . 0.0 110.804 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -94.04 -35.67 12.48 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.381 -0.825 . . . . 0.0 110.131 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -61.38 -34.23 74.98 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.524 -0.735 . . . . 0.0 109.968 179.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -58.04 150.2 21.52 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.572 -0.705 . . . . 0.0 110.507 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 17.1 t -89.43 -151.63 0.23 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.616 -0.678 . . . . 0.0 109.588 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -84.01 54.66 3.0 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.249 -0.907 . . . . 0.0 110.181 179.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.4 mttp -136.87 -41.59 0.6 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.473 -0.767 . . . . 0.0 110.435 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -62.31 -37.45 85.63 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.522 -0.736 . . . . 0.0 110.388 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -96.28 20.41 10.45 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.371 -0.83 . . . . 0.0 110.918 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.469 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 3.7 mt-30 -88.33 -59.03 0.26 Allowed Pre-proline 0 N--CA 1.496 1.867 0 O-C-N 121.165 -0.959 . . . . 0.0 109.759 179.571 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.469 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 57.3 Cg_endo -81.58 -23.89 4.63 Favored 'Trans proline' 0 C--N 1.32 -0.971 0 O-C-N 122.99 0.995 . . . . 0.0 110.353 179.013 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -81.56 -20.31 40.19 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.59 -0.694 . . . . 0.0 111.827 -178.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.636 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -82.37 -22.06 35.63 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.145 -0.972 . . . . 0.0 110.79 -179.564 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -84.02 -24.09 30.65 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.379 -0.825 . . . . 0.0 110.422 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -62.39 -47.29 84.78 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.44 -0.787 . . . . 0.0 109.778 179.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.643 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -74.53 -9.44 58.58 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.595 -0.691 . . . . 0.0 110.916 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.64 -0.61 55.58 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.3 -0.875 . . . . 0.0 110.283 179.015 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 47.7 mmtt -105.48 -29.18 10.37 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.21 -0.931 . . . . 0.0 109.943 179.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.2 mp -86.85 -14.23 42.66 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.963 -0.461 . . . . 0.0 110.031 178.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.8 tptt -76.3 -30.35 57.7 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.284 -0.885 . . . . 0.0 109.469 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -67.42 -59.72 3.16 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.651 -0.655 . . . . 0.0 109.484 179.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.9 mmpt? -60.25 -25.71 65.88 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.641 -0.662 . . . . 0.0 110.511 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.633 ' O ' HG22 ' A' ' 73' ' ' ILE . 21.4 t80 -71.5 -65.14 0.79 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.37 -0.831 . . . . 0.0 109.255 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -61.29 -17.5 53.86 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.836 -0.54 . . . . 0.0 111.082 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -98.62 -20.83 16.78 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.283 -0.885 . . . . 0.0 111.568 -179.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -106.36 -32.69 8.03 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.23 -0.919 . . . . 0.0 111.064 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.633 HG22 ' O ' ' A' ' 69' ' ' TYR . 8.4 tp . . . . . 0 N--CA 1.495 1.816 0 O-C-N 121.419 -0.801 . . . . 0.0 110.372 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo . . . . . 0 N--CA 1.485 0.973 0 N-CA-C 110.008 -0.805 . . . . 0.0 110.008 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 35.87 -156.49 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.324 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 178.596 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -108.43 153.92 41.78 Favored Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.583 -0.698 . . . . 0.0 109.483 179.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -73.15 113.96 3.91 Favored 'Trans proline' 0 C--N 1.316 -1.155 0 O-C-N 123.316 1.166 . . . . 0.0 110.803 -179.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.739 ' HB2' HD21 ' A' ' 18' ' ' LEU . 49.9 Cg_endo -82.98 173.18 10.34 Favored 'Trans proline' 0 C--N 1.318 -1.045 0 O-C-N 123.37 1.194 . . . . 0.0 110.122 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.513 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 42.2 t -165.4 63.33 0.12 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.492 -0.755 . . . . 0.0 110.616 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.513 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 66.64 -77.25 0.04 OUTLIER 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.114 -0.991 . . . . 0.0 110.361 -179.78 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -47.7 -49.49 27.66 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.302 -0.874 . . . . 0.0 111.401 -179.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -59.07 -35.86 74.08 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.616 -0.677 . . . . 0.0 109.945 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.739 HD21 ' HB2' ' A' ' 13' ' ' PRO . 23.0 mt -74.27 -32.62 62.99 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.624 -0.673 . . . . 0.0 110.323 -179.599 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.422 ' CE1' ' CZ ' ' A' ' 23' ' ' TYR . 68.1 t80 -79.65 -55.26 5.15 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.498 -0.751 . . . . 0.0 110.647 -179.363 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.9 t -57.15 -54.58 45.13 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.526 -0.734 . . . . 0.0 110.686 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.1 t -55.74 -22.49 24.13 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.438 -0.788 . . . . 0.0 110.982 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 41.1 mm-40 -100.93 -25.1 14.2 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.406 -0.809 . . . . 0.0 110.936 -179.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.435 ' O ' HD21 ' A' ' 43' ' ' LEU . 10.9 m-85 -96.71 12.43 31.94 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.395 -0.815 . . . . 0.0 111.522 -179.376 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.524 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 50.9 mtt180 -87.04 -45.02 0.53 Allowed Pre-proline 0 N--CA 1.489 1.482 0 O-C-N 121.226 -0.921 . . . . 0.0 112.164 179.538 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.591 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.1 Cg_endo -66.71 -15.67 48.11 Favored 'Trans proline' 0 N--CA 1.49 1.308 0 O-C-N 122.89 0.942 . . . . 0.0 110.484 -179.231 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -72.88 -50.19 25.32 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 177.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 28.0 mm -54.62 -32.96 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 CA-C-O 121.377 0.608 . . . . 0.0 110.288 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.591 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.0 mmmm -72.3 -36.59 68.98 Favored 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.3 -177.149 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.8 t -60.02 -25.76 65.56 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.551 -0.718 . . . . 0.0 110.661 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -115.35 -22.73 9.22 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.545 -0.722 . . . . 0.0 110.766 -179.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.756 ' HB3' HD23 ' A' ' 34' ' ' LEU . 39.2 m80 -121.41 96.07 48.01 Favored Pre-proline 0 N--CA 1.496 1.865 0 O-C-N 121.485 -0.76 . . . . 0.0 109.596 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -75.21 -31.17 6.16 Favored 'Trans proline' 0 C--N 1.315 -1.221 0 O-C-N 123.393 1.207 . . . . 0.0 110.344 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.409 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -80.38 -16.37 76.23 Favored Glycine 0 N--CA 1.489 2.193 0 N-CA-C 110.298 -1.121 . . . . 0.0 110.298 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.756 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -59.16 82.64 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.408 -1.054 . . . . 0.0 111.222 -179.356 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.409 ' N ' ' O ' ' A' ' 33' ' ' GLY . 71.8 m -69.55 172.43 7.34 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.479 -0.763 . . . . 0.0 109.701 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.556 ' H ' HD12 ' A' ' 36' ' ' ILE . 2.5 mp -56.15 -28.39 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.108 0 O-C-N 121.273 -0.892 . . . . 0.0 109.735 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.79 -65.34 3.39 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.235 -1.546 . . . . 0.0 109.235 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.591 ' HB3' HD13 ' A' ' 34' ' ' LEU . 7.9 t0 -70.02 -30.82 68.22 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.604 -0.939 . . . . 0.0 110.466 179.642 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.442 ' HB ' ' HA ' ' A' ' 36' ' ' ILE . 54.7 m -63.97 -30.66 71.72 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.494 -0.754 . . . . 0.0 109.96 179.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.78 -43.29 47.19 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.562 -0.711 . . . . 0.0 110.118 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.419 ' HG2' ' HA ' ' A' ' 38' ' ' ASP . 0.5 OUTLIER -87.72 -10.02 52.38 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.62 -0.675 . . . . 0.0 111.695 -179.525 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.42 -60.99 2.11 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.05 -1.031 . . . . 0.0 109.683 179.571 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.435 HD21 ' O ' ' A' ' 23' ' ' TYR . 21.8 mt -49.23 -25.66 2.43 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.518 -0.739 . . . . 0.0 111.378 -179.719 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -66.28 -36.89 92.34 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 109.365 -1.494 . . . . 0.0 109.365 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -51.92 -34.61 42.35 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.474 -1.015 . . . . 0.0 111.016 -179.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 7.6 mtt -85.14 -43.01 14.23 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.495 -0.753 . . . . 0.0 109.998 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . 0.444 ' CH2' ' HG2' ' A' ' 55' ' ' LYS . 64.4 t-105 -51.19 -36.69 42.58 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.528 -0.733 . . . . 0.0 111.174 -179.532 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 6.9 t -85.53 -27.8 25.34 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.438 -0.789 . . . . 0.0 110.117 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -58.63 -39.04 79.39 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.479 -0.763 . . . . 0.0 110.113 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.28 167.33 16.58 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.58 -0.7 . . . . 0.0 109.749 179.523 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.4 m -146.57 101.39 3.46 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.608 -0.683 . . . . 0.0 110.498 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 51.51 48.55 22.71 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.409 -0.807 . . . . 0.0 110.969 179.724 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 14.1 tttp -141.6 -65.57 0.42 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.553 -0.717 . . . . 0.0 110.236 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -64.48 -24.88 67.77 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.524 -0.735 . . . . 0.0 110.721 -179.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.444 ' HG2' ' CH2' ' A' ' 47' ' ' TRP . 39.9 mtpt -80.45 -35.14 35.34 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.476 -0.765 . . . . 0.0 110.759 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -46.4 -53.22 24.88 Favored Pre-proline 0 N--CA 1.505 2.303 0 O-C-N 121.51 -0.744 . . . . 0.0 112.021 -179.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -77.62 -39.98 0.47 Allowed 'Trans proline' 0 C--N 1.314 -1.257 0 O-C-N 123.171 1.09 . . . . 0.0 110.956 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -80.21 5.33 14.86 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.453 -0.779 . . . . 0.0 112.07 -178.404 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.32 -18.68 16.68 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.876 -1.14 . . . . 0.0 110.727 179.466 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -79.86 -28.12 40.02 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.261 -0.9 . . . . 0.0 110.224 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.4 ' CG ' HD13 ' A' ' 18' ' ' LEU . 45.6 tttm -60.25 -41.24 92.77 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.544 -0.722 . . . . 0.0 110.097 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.443 ' HB2' ' H ' ' A' ' 15' ' ' ALA . . . -69.05 -10.93 60.03 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.596 -0.69 . . . . 0.0 110.817 179.591 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -90.27 6.17 44.04 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.122 -0.986 . . . . 0.0 110.634 179.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -106.2 -36.94 6.73 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.254 -0.903 . . . . 0.0 109.028 178.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.739 HD22 ' HG3' ' A' ' 13' ' ' PRO . 6.8 mp -76.85 -0.08 22.75 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.912 -0.493 . . . . 0.0 111.07 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 19.1 tttm -91.3 -22.83 20.35 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.062 -1.024 . . . . 0.0 110.005 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -84.02 -16.16 44.94 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.475 -0.765 . . . . 0.0 110.522 179.55 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -102.2 -27.57 12.8 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.307 -0.871 . . . . 0.0 109.981 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.544 ' O ' HG22 ' A' ' 73' ' ' ILE . 17.0 t80 -78.05 -51.05 10.92 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.62 -0.675 . . . . 0.0 109.799 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -60.67 -15.53 29.68 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.783 -0.573 . . . . 0.0 111.419 -179.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -107.3 -30.47 8.7 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.092 -1.005 . . . . 0.0 110.056 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -86.14 -31.27 21.92 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.559 -0.713 . . . . 0.0 110.488 -179.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.544 HG22 ' O ' ' A' ' 69' ' ' TYR . 6.0 tp . . . . . 0 N--CA 1.495 1.793 0 O-C-N 121.539 -0.725 . . . . 0.0 109.993 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo . . . . . 0 N--CA 1.484 0.925 0 N-CA-C 110.27 -0.704 . . . . 0.0 110.27 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.31 -165.98 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.522 -0.736 . . . . 0.0 109.993 179.823 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -70.57 145.8 93.08 Favored Pre-proline 0 N--CA 1.496 1.874 0 O-C-N 121.429 -0.795 . . . . 0.0 110.207 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.438 ' HD3' ' CZ ' ' A' ' 69' ' ' TYR . 47.8 Cg_endo -76.25 128.85 10.8 Favored 'Trans proline' 0 C--N 1.318 -1.04 0 O-C-N 123.342 1.18 . . . . 0.0 109.993 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.589 ' CB ' HD21 ' A' ' 18' ' ' LEU . 49.1 Cg_endo -81.65 -175.82 2.77 Favored 'Trans proline' 0 C--N 1.318 -1.048 0 O-C-N 123.24 1.126 . . . . 0.0 110.181 -179.842 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.558 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 33.6 t -168.74 56.77 0.05 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.53 -0.731 . . . . 0.0 110.628 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.558 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 70.32 -76.92 0.06 Allowed 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.15 -0.969 . . . . 0.0 110.198 -179.515 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -49.19 -49.81 40.98 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.228 -0.92 . . . . 0.0 111.058 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -57.88 -37.72 74.47 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.604 -0.685 . . . . 0.0 109.457 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.773 HD11 ' HB2' ' A' ' 62' ' ' ALA . 56.3 mt -67.06 -45.48 77.24 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.725 -0.609 . . . . 0.0 109.992 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.405 ' HB2' ' CZ3' ' A' ' 47' ' ' TRP . 46.4 t80 -63.58 -50.17 70.5 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.541 -0.724 . . . . 0.0 109.728 179.826 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.9 t -62.87 -29.38 70.71 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 120.05 -0.66 . . . . 0.0 109.597 179.309 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.404 ' HG ' ' HA ' ' A' ' 18' ' ' LEU . 65.4 p -95.26 14.74 21.29 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.627 -0.671 . . . . 0.0 111.034 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -139.51 -5.02 1.41 Allowed 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.137 -0.977 . . . . 0.0 111.965 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -121.19 -29.22 4.56 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.902 -1.124 . . . . 0.0 110.895 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.746 ' HG2' HD11 ' A' ' 43' ' ' LEU . 5.9 mtt180 -47.64 -53.28 31.75 Favored Pre-proline 0 N--CA 1.498 1.944 0 O-C-N 121.284 -0.885 . . . . 0.0 112.491 -179.506 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.533 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 35.3 Cg_endo -58.61 -27.74 83.79 Favored 'Trans proline' 0 N--CA 1.495 1.611 0 O-C-N 123.188 1.099 . . . . 0.0 110.202 -179.594 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -69.23 -45.73 69.11 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 177.505 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.9 mm -60.4 -17.46 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.847 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.533 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 8.2 mmmm -86.89 -27.37 23.46 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.078 -1.014 . . . . 0.0 110.39 -177.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 6.6 t -70.11 -14.32 62.6 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.425 -0.797 . . . . 0.0 110.992 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -133.26 2.47 3.57 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.14 -0.975 . . . . 0.0 111.784 -179.551 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.634 ' HB3' HD23 ' A' ' 34' ' ' LEU . 31.5 m80 -142.39 93.46 7.1 Favored Pre-proline 0 N--CA 1.498 1.927 0 O-C-N 121.073 -1.017 . . . . 0.0 109.298 179.029 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -75.0 -33.98 4.18 Favored 'Trans proline' 0 C--N 1.315 -1.204 0 O-C-N 123.52 1.274 . . . . 0.0 110.29 -179.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.407 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -72.48 -30.93 63.73 Favored Glycine 0 N--CA 1.487 2.076 0 N-CA-C 109.304 -1.518 . . . . 0.0 109.304 179.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.634 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.3 OUTLIER -46.01 90.65 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.76 -0.847 . . . . 0.0 111.925 -179.487 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.407 ' N ' ' O ' ' A' ' 33' ' ' GLY . 22.8 t -88.72 170.94 10.35 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.558 -0.714 . . . . 0.0 109.596 179.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.618 ' H ' HD12 ' A' ' 36' ' ' ILE . 3.2 mp -53.12 -24.63 8.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.073 0 O-C-N 121.372 -0.83 . . . . 0.0 110.26 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.3 -66.4 2.62 Favored Glycine 0 N--CA 1.493 2.467 0 N-CA-C 108.958 -1.657 . . . . 0.0 108.958 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.45 ' HA ' ' HG2' ' A' ' 41' ' ' LYS . 6.1 t70 -75.16 -28.29 60.04 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.755 -0.85 . . . . 0.0 110.216 179.486 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.559 ' O ' HD12 ' A' ' 43' ' ' LEU . 88.3 m -68.87 -28.51 66.78 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.573 -0.704 . . . . 0.0 110.347 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -79.6 -25.37 41.51 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.453 -0.78 . . . . 0.0 109.975 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.45 ' HG2' ' HA ' ' A' ' 38' ' ' ASP . 3.3 ptpt -105.17 -11.94 16.33 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.617 -0.677 . . . . 0.0 111.014 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 9.4 tptt -84.77 -10.76 56.9 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.026 -1.046 . . . . 0.0 110.483 179.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.746 HD11 ' HG2' ' A' ' 24' ' ' ARG . 28.8 mt -90.16 -31.99 16.83 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.331 -0.856 . . . . 0.0 109.294 179.096 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.53 -32.3 71.3 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 108.717 -1.753 . . . . 0.0 108.717 179.119 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -55.96 -40.05 72.67 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.62 -0.929 . . . . 0.0 110.576 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 9.2 mmt -78.73 -46.09 19.74 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.568 -0.708 . . . . 0.0 110.209 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . 0.551 ' CZ2' ' HB1' ' A' ' 15' ' ' ALA . 67.1 t-105 -59.95 -17.3 36.89 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.543 -0.723 . . . . 0.0 111.245 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.6 t -103.48 -37.72 7.47 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.226 -0.921 . . . . 0.0 111.575 -179.095 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -75.12 -32.89 61.51 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.284 -0.885 . . . . 0.0 111.745 -178.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.401 ' CB ' ' HB2' ' A' ' 54' ' ' ASP . 13.5 mm-40 -59.27 156.78 11.86 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.21 -0.931 . . . . 0.0 110.919 -179.031 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 77.2 p -77.87 -137.8 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 179.161 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -90.5 36.1 0.89 Allowed 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.854 -1.154 . . . . 0.0 110.795 179.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 11.6 mptt -116.11 -35.56 4.35 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.359 -0.838 . . . . 0.0 109.67 179.483 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.401 ' HB2' ' CB ' ' A' ' 50' ' ' GLN . 1.3 t70 -92.92 53.66 2.04 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 108.485 -0.932 . . . . 0.0 108.485 178.399 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.433 ' HG2' ' CE2' ' A' ' 47' ' ' TRP . 0.0 OUTLIER -173.01 -65.18 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 179.696 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.406 ' CB ' ' CD ' ' A' ' 57' ' ' PRO . 0.3 OUTLIER -40.2 -58.05 2.53 Favored Pre-proline 0 N--CA 1.506 2.346 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -179.253 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.406 ' CD ' ' CB ' ' A' ' 56' ' ' GLN . 42.4 Cg_endo -67.37 -32.38 32.6 Favored 'Trans proline' 0 N--CA 1.488 1.16 0 O-C-N 123.072 1.038 . . . . 0.0 110.833 -179.285 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.53 ' O ' HD12 ' A' ' 18' ' ' LEU . 13.6 m-85 -82.99 -14.18 54.53 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.5 -0.75 . . . . 0.0 110.69 179.578 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.437 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 29.0 mm-40 -77.9 -64.03 1.25 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.348 -0.845 . . . . 0.0 110.132 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -53.05 -23.52 7.84 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.548 -0.72 . . . . 0.0 111.366 -179.486 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 66.4 tttt -63.08 -48.73 77.37 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.465 -0.772 . . . . 0.0 110.13 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.773 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -78.05 -16.31 58.16 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.559 -0.713 . . . . 0.0 110.176 179.187 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.7 -35.08 77.0 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.428 -0.795 . . . . 0.0 110.454 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 67.5 mmtt -74.58 -63.41 1.25 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.322 -0.861 . . . . 0.0 110.102 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.459 ' H ' HD12 ' A' ' 65' ' ' LEU . 4.0 mp -45.59 -26.59 0.62 Allowed 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.599 -0.688 . . . . 0.0 111.882 -179.406 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 32.4 tptt -65.68 -45.08 84.21 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.324 -0.86 . . . . 0.0 109.507 179.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -66.17 -55.16 17.73 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.665 -0.647 . . . . 0.0 110.121 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -55.0 -31.49 61.06 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.466 -0.771 . . . . 0.0 110.485 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.545 ' O ' HG22 ' A' ' 73' ' ' ILE . 76.5 t80 -75.92 -68.64 0.56 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.538 -0.726 . . . . 0.0 109.674 179.621 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -48.73 -28.45 3.62 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.687 -0.633 . . . . 0.0 111.284 -179.612 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.2 mmmt -86.22 -57.72 2.91 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.6 -0.687 . . . . 0.0 110.545 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -62.88 -30.92 71.9 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.504 -0.747 . . . . 0.0 110.968 -179.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.545 HG22 ' O ' ' A' ' 69' ' ' TYR . 2.7 tp . . . . . 0 N--CA 1.495 1.807 0 O-C-N 121.419 -0.8 . . . . 0.0 110.496 -179.475 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo . . . . . 0 N--CA 1.484 0.935 0 N-CA-C 110.561 -0.592 . . . . 0.0 110.561 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -166.2 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.484 -0.76 . . . . 0.0 110.018 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.72 141.24 92.69 Favored Pre-proline 0 N--CA 1.497 1.913 0 O-C-N 121.509 -0.745 . . . . 0.0 109.938 179.943 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -74.37 132.56 16.46 Favored 'Trans proline' 0 C--N 1.317 -1.099 0 O-C-N 123.309 1.163 . . . . 0.0 109.972 179.786 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.473 ' CB ' HD21 ' A' ' 18' ' ' LEU . 49.5 Cg_endo -81.12 -173.15 1.72 Allowed 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.184 1.097 . . . . 0.0 110.004 -179.737 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.555 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 31.1 t -167.98 59.41 0.07 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.41 -0.806 . . . . 0.0 110.549 -179.898 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.555 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 69.43 -75.76 0.07 Allowed 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.256 -0.902 . . . . 0.0 110.303 -179.527 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -47.3 -52.53 16.05 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.323 -0.861 . . . . 0.0 111.439 -179.388 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -58.1 -39.98 80.01 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.578 -0.701 . . . . 0.0 109.656 179.666 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.477 HD11 ' HB2' ' A' ' 62' ' ' ALA . 51.4 mt -62.32 -45.41 93.33 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.646 -0.659 . . . . 0.0 109.84 179.833 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.497 ' CZ ' ' CE2' ' A' ' 23' ' ' TYR . 43.0 t80 -68.48 -51.62 41.39 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.757 -0.59 . . . . 0.0 110.421 -179.649 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.6 m -56.4 -54.98 39.21 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.523 -0.735 . . . . 0.0 110.813 -179.613 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 88.7 p -57.42 -30.09 64.68 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.466 -0.771 . . . . 0.0 110.856 -179.666 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 -89.95 -23.55 21.52 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.475 -0.766 . . . . 0.0 111.302 -179.29 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.497 ' CE2' ' CZ ' ' A' ' 19' ' ' PHE . 9.0 m-85 -96.02 -34.25 11.83 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.352 -0.842 . . . . 0.0 110.927 -179.423 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.518 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 29.8 mtt-85 -48.28 -53.02 37.72 Favored Pre-proline 0 N--CA 1.498 1.959 0 O-C-N 121.376 -0.828 . . . . 0.0 112.109 -179.881 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.587 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.1 Cg_endo -59.38 -28.61 88.03 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 O-C-N 123.218 1.115 . . . . 0.0 110.155 179.968 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.0 tmtt? -68.89 -45.2 71.54 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 177.918 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 47.4 mm -58.93 -27.4 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.233 179.755 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.587 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.6 mmmm -75.66 -35.23 60.46 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 119.789 -0.765 . . . . 0.0 110.214 -177.53 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 13.4 t -64.94 -21.39 66.82 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.444 -0.785 . . . . 0.0 110.591 179.932 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -121.42 -10.36 8.89 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.307 -0.871 . . . . 0.0 111.415 -179.56 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.716 ' HB3' HD23 ' A' ' 34' ' ' LEU . 41.4 m80 -134.36 94.2 17.98 Favored Pre-proline 0 N--CA 1.497 1.911 0 O-C-N 121.227 -0.92 . . . . 0.0 109.449 179.175 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -74.95 -32.63 5.29 Favored 'Trans proline' 0 C--N 1.315 -1.198 0 O-C-N 123.531 1.28 . . . . 0.0 110.193 -179.679 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.411 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -76.36 -23.11 71.69 Favored Glycine 0 N--CA 1.488 2.118 0 N-CA-C 109.767 -1.333 . . . . 0.0 109.767 179.674 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.716 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.6 OUTLIER -54.78 86.01 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.696 -0.885 . . . . 0.0 111.37 -179.548 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.411 ' N ' ' O ' ' A' ' 33' ' ' GLY . 75.7 m -77.6 172.09 13.92 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.466 -0.771 . . . . 0.0 109.523 179.573 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.2 mm -52.74 -30.02 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.133 0 O-C-N 121.31 -0.868 . . . . 0.0 110.322 -179.934 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.98 -66.64 2.55 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.197 -1.561 . . . . 0.0 109.197 179.7 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.409 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 1.2 m-20 -69.87 -31.41 69.22 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.622 -0.928 . . . . 0.0 110.381 179.639 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 91.1 m -65.26 -31.35 72.46 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.403 -0.81 . . . . 0.0 110.0 179.514 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.89 -42.63 48.55 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.551 -0.718 . . . . 0.0 110.303 179.973 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.4 ' HG2' ' HA ' ' A' ' 38' ' ' ASP . 0.6 OUTLIER -88.2 -12.58 43.41 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.522 -0.736 . . . . 0.0 111.853 -179.284 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.409 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 9.7 tptt -77.73 -58.86 3.04 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 120.941 -1.099 . . . . 0.0 109.869 179.694 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.414 HD22 ' HB3' ' A' ' 23' ' ' TYR . 39.9 mt -48.11 -28.27 2.81 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 121.528 -0.732 . . . . 0.0 111.184 -179.579 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -64.56 -37.58 94.59 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.236 -1.545 . . . . 0.0 109.236 179.6 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -49.42 -34.98 17.81 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.551 -0.97 . . . . 0.0 111.225 -179.639 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 7.9 mmt -89.63 -36.64 15.16 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.578 -0.701 . . . . 0.0 110.112 179.763 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . 0.439 ' CZ2' ' HG2' ' A' ' 55' ' ' LYS . 73.6 t-105 -65.27 -12.29 50.06 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.603 -0.686 . . . . 0.0 111.254 -179.596 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 27.8 t -99.94 -42.7 6.67 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.109 -0.994 . . . . 0.0 110.781 -179.684 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -66.13 -29.21 69.47 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.441 -0.787 . . . . 0.0 110.493 -179.696 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -58.37 150.36 22.39 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.506 -0.746 . . . . 0.0 110.309 179.902 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.4 t -94.13 -154.08 0.4 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.612 -0.68 . . . . 0.0 109.684 179.75 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -86.19 52.32 2.46 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.361 -0.837 . . . . 0.0 110.028 179.624 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 22.4 mttp -127.63 -46.89 1.42 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.544 -0.722 . . . . 0.0 110.302 -179.855 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -67.97 -31.32 70.96 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.577 -0.702 . . . . 0.0 111.214 -179.203 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.439 ' HG2' ' CZ2' ' A' ' 47' ' ' TRP . 34.3 mtpt -80.43 -37.64 31.65 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.344 -0.847 . . . . 0.0 111.127 -179.198 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -43.46 -56.12 7.37 Favored Pre-proline 0 N--CA 1.509 2.476 0 O-C-N 121.451 -0.781 . . . . 0.0 112.7 -178.443 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -76.2 -35.92 2.12 Favored 'Trans proline' 0 C--N 1.315 -1.203 0 O-C-N 123.049 1.026 . . . . 0.0 111.417 -179.35 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -82.04 -8.85 59.69 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.39 -0.819 . . . . 0.0 112.132 -178.314 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.07 -23.76 22.46 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.021 -1.049 . . . . 0.0 111.201 -179.193 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -78.98 -20.79 48.27 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.376 -0.828 . . . . 0.0 110.804 -179.823 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 22.1 tttp -60.43 -50.04 75.18 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.365 -0.834 . . . . 0.0 110.301 179.997 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.477 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -77.48 -10.84 59.71 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 119.839 -0.744 . . . . 0.0 110.429 179.493 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.9 -25.73 67.29 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.286 -0.884 . . . . 0.0 109.469 179.277 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -79.57 -64.8 1.1 Allowed 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.835 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.54 ' H ' HD12 ' A' ' 65' ' ' LEU . 2.8 mp -42.07 -20.52 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.279 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 -178.914 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 57.2 tttt -70.39 -32.83 70.64 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.646 -1.284 . . . . 0.0 109.067 178.491 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -85.99 -5.3 59.25 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.703 -0.623 . . . . 0.0 110.751 179.451 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.2 tptt -102.4 -37.77 7.89 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.251 -0.906 . . . . 0.0 108.952 179.234 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.628 ' CZ ' HD13 ' A' ' 73' ' ' ILE . 19.0 t80 -75.7 -56.58 4.55 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 179.149 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -57.22 -20.28 26.21 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.839 -0.538 . . . . 0.0 111.236 -179.674 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.0 mttt -98.9 -23.64 15.26 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.226 -0.921 . . . . 0.0 111.07 -179.379 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -103.3 -31.35 10.1 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.428 -0.795 . . . . 0.0 111.125 -179.216 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.628 HD13 ' CZ ' ' A' ' 69' ' ' TYR . 2.5 tp . . . . . 0 N--CA 1.497 1.88 0 O-C-N 121.43 -0.794 . . . . 0.0 110.539 -179.422 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.429 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 48.0 Cg_endo . . . . . 0 N--CA 1.484 0.948 0 N-CA-C 110.521 -0.607 . . . . 0.0 110.521 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.4 pttm -144.18 31.37 1.24 Allowed 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.646 -0.659 . . . . 0.0 110.451 -179.966 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 43.1 mtt180 -147.17 68.78 11.49 Favored Pre-proline 0 N--CA 1.493 1.711 0 C-N-CA 120.444 -0.502 . . . . 0.0 110.183 -179.807 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -77.31 123.6 6.69 Favored 'Trans proline' 0 C--N 1.316 -1.149 0 O-C-N 123.264 1.139 . . . . 0.0 110.452 -179.932 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.766 ' HG3' HD22 ' A' ' 65' ' ' LEU . 48.2 Cg_endo -81.52 176.44 8.58 Favored 'Trans proline' 0 C--N 1.318 -1.053 0 O-C-N 123.26 1.137 . . . . 0.0 109.835 179.793 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.539 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 52.4 p -167.48 56.54 0.07 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.379 -0.826 . . . . 0.0 111.043 -179.753 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.539 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 68.94 -79.81 0.04 OUTLIER 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.143 -0.973 . . . . 0.0 110.807 -179.905 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -47.36 -51.04 20.77 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.117 -0.989 . . . . 0.0 111.412 -179.33 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -54.97 -27.73 46.14 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.523 -0.735 . . . . 0.0 110.28 179.743 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.68 HD11 ' HB2' ' A' ' 62' ' ' ALA . 21.3 mt -85.17 -24.63 27.84 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.523 -0.735 . . . . 0.0 110.386 -179.925 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.496 ' CE1' ' CE1' ' A' ' 23' ' ' TYR . 80.5 t80 -81.27 -57.45 3.49 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.469 -0.769 . . . . 0.0 110.756 -179.267 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.7 t -60.18 -48.8 80.19 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.502 -0.749 . . . . 0.0 110.403 -179.717 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 30.7 t -57.43 -21.5 37.13 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.636 -0.665 . . . . 0.0 110.881 -179.768 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -107.67 -13.61 15.0 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.35 -0.843 . . . . 0.0 111.442 -179.489 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.507 ' HB3' HD22 ' A' ' 43' ' ' LEU . 2.6 m-85 -94.69 -37.76 11.14 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.173 -0.955 . . . . 0.0 110.602 -179.592 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.527 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 5.9 mtt180 -46.88 -51.77 37.04 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.437 -0.789 . . . . 0.0 112.265 -179.625 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.539 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.5 Cg_endo -60.2 -26.52 82.77 Favored 'Trans proline' 0 N--CA 1.493 1.486 0 O-C-N 123.24 1.126 . . . . 0.0 110.089 179.779 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.0 tmtt? -69.65 -47.37 63.57 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 177.494 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.665 HG13 HD21 ' A' ' 43' ' ' LEU . 46.4 mm -57.97 -18.67 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.607 179.543 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.539 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 7.1 mmmm -85.24 -28.58 25.29 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.189 -0.944 . . . . 0.0 110.293 -177.843 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.1 t -68.55 -18.74 64.41 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.507 -0.745 . . . . 0.0 110.846 -179.979 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -127.59 -1.59 6.14 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.313 -0.867 . . . . 0.0 111.611 -179.598 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.679 ' HB3' HD23 ' A' ' 34' ' ' LEU . 26.7 m80 -140.71 93.58 8.49 Favored Pre-proline 0 N--CA 1.497 1.925 0 O-C-N 121.135 -0.978 . . . . 0.0 109.057 179.035 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -74.68 -37.32 2.32 Favored 'Trans proline' 0 C--N 1.316 -1.155 0 O-C-N 123.511 1.269 . . . . 0.0 110.384 -179.467 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.68 -26.73 73.56 Favored Glycine 0 N--CA 1.488 2.159 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 179.571 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.679 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.3 OUTLIER -48.2 90.87 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.616 -0.932 . . . . 0.0 111.704 -179.501 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.1 p -76.71 -179.67 5.49 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.533 -0.729 . . . . 0.0 109.475 179.595 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.487 ' N ' HD12 ' A' ' 36' ' ' ILE . 2.0 mp -60.54 -33.91 56.29 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 O-C-N 121.37 -0.831 . . . . 0.0 109.297 179.822 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.09 -54.61 36.6 Favored Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.024 -1.631 . . . . 0.0 109.024 179.483 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.6 ' CB ' HD13 ' A' ' 34' ' ' LEU . 23.8 m-20 -73.39 -36.9 66.1 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.763 -0.845 . . . . 0.0 110.031 179.017 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.481 ' O ' HD12 ' A' ' 43' ' ' LEU . 87.9 m -65.3 -25.13 67.49 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.238 -0.914 . . . . 0.0 110.263 179.265 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -84.43 -33.02 23.79 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.418 -0.802 . . . . 0.0 110.328 -179.942 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.429 ' HG2' ' HA ' ' A' ' 38' ' ' ASP . 3.0 ptpt -100.06 -14.7 18.5 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.442 -0.786 . . . . 0.0 111.79 -179.179 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -85.06 -5.21 59.35 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.921 -1.112 . . . . 0.0 110.547 179.338 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.665 HD21 HG13 ' A' ' 27' ' ' ILE . 86.4 mt -96.83 -38.74 9.74 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.283 -0.886 . . . . 0.0 109.237 179.337 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -59.22 -32.76 72.59 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 109.863 -1.295 . . . . 0.0 109.863 -179.943 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -55.36 -37.22 67.21 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.513 -0.992 . . . . 0.0 110.419 -179.992 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 14.3 mtt -76.14 -44.42 38.47 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.621 -0.674 . . . . 0.0 109.598 179.408 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 70.7 t-105 -54.64 -22.69 14.34 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.621 -0.674 . . . . 0.0 110.897 -179.955 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.1 t -88.82 -31.49 18.3 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.282 -0.886 . . . . 0.0 110.117 179.94 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -90.88 -4.8 56.27 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.533 -0.73 . . . . 0.0 110.995 179.674 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.414 ' HB2' ' CB ' ' A' ' 54' ' ' ASP . 4.4 pp0? -59.03 -167.35 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.217 -0.927 . . . . 0.0 110.621 179.928 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.2 t -156.75 -147.07 0.18 Allowed 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 179.897 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.88 -3.82 31.2 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.135 -0.978 . . . . 0.0 111.035 179.684 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.4 mtmt -90.89 -38.78 12.69 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.92 -1.113 . . . . 0.0 110.901 -179.524 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.414 ' CB ' ' HB2' ' A' ' 50' ' ' GLN . 0.8 OUTLIER -87.91 49.87 1.88 Allowed 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.339 -0.851 . . . . 0.0 110.777 -179.366 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.417 ' O ' ' N ' ' A' ' 59' ' ' GLU . 17.6 mtmt -159.82 -59.81 0.06 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.581 -0.699 . . . . 0.0 109.697 178.673 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.407 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 5.0 mm100 -41.15 -52.29 7.29 Favored Pre-proline 0 N--CA 1.506 2.352 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -179.097 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.407 ' HD2' ' N ' ' A' ' 56' ' ' GLN . 52.8 Cg_endo -75.29 -36.03 2.61 Favored 'Trans proline' 0 N--CA 1.489 1.213 0 O-C-N 123.129 1.068 . . . . 0.0 112.182 -179.208 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.409 ' O ' HD12 ' A' ' 18' ' ' LEU . 8.0 m-85 -87.68 -17.85 30.87 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 121.221 -0.925 . . . . 0.0 111.848 -178.611 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.417 ' N ' ' O ' ' A' ' 55' ' ' LYS . 0.2 OUTLIER -85.35 -30.9 23.3 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.25 -0.907 . . . . 0.0 110.018 -179.417 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.412 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 5.7 pt20 -77.71 -24.74 49.11 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.748 -0.595 . . . . 0.0 110.159 179.494 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 73.1 tttt -62.91 -43.1 99.71 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.46 -0.775 . . . . 0.0 109.858 179.728 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.68 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -78.94 -16.38 57.04 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.515 -0.741 . . . . 0.0 109.943 178.987 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.412 ' HB3' ' O ' ' A' ' 60' ' ' GLN . . . -58.25 -42.75 87.08 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.404 -0.81 . . . . 0.0 110.449 179.954 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -70.08 -62.27 1.45 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.306 -0.871 . . . . 0.0 110.055 -179.989 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.766 HD22 ' HG3' ' A' ' 13' ' ' PRO . 4.3 mp -45.69 -27.15 0.75 Allowed 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.688 -0.632 . . . . 0.0 111.815 -179.419 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.1 tptt -64.25 -51.85 61.56 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.42 -0.8 . . . . 0.0 109.421 179.142 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -60.82 -52.0 66.94 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.647 -0.658 . . . . 0.0 109.846 179.499 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 69.5 mttt -56.19 -26.11 49.5 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.527 -0.733 . . . . 0.0 110.536 179.926 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.495 ' O ' HG22 ' A' ' 73' ' ' ILE . 32.8 t80 -81.92 -63.37 1.4 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.396 -0.815 . . . . 0.0 109.538 179.468 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.435 ' C ' HG22 ' A' ' 73' ' ' ILE . 9.6 mt-10 -55.21 -23.87 24.36 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.475 -0.766 . . . . 0.0 110.682 179.718 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 25.3 ttmt -89.42 -59.86 2.1 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.452 -0.78 . . . . 0.0 110.426 -179.924 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -56.28 -23.09 34.29 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.529 -0.732 . . . . 0.0 111.084 -179.403 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.495 HG22 ' O ' ' A' ' 69' ' ' TYR . 7.1 tp . . . . . 0 N--CA 1.496 1.858 0 O-C-N 121.342 -0.849 . . . . 0.0 109.88 179.764 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo . . . . . 0 N--CA 1.485 0.978 0 N-CA-C 110.286 -0.698 . . . . 0.0 110.286 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.53 -164.78 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.631 -0.668 . . . . 0.0 110.438 -179.779 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.4 mpt_? -60.6 142.27 91.5 Favored Pre-proline 0 N--CA 1.496 1.854 0 O-C-N 121.618 -0.677 . . . . 0.0 110.124 -179.989 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -75.13 131.55 14.28 Favored 'Trans proline' 0 C--N 1.318 -1.076 0 O-C-N 123.324 1.171 . . . . 0.0 110.053 179.876 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.626 ' CB ' HD21 ' A' ' 18' ' ' LEU . 48.7 Cg_endo -81.72 -177.08 3.36 Favored 'Trans proline' 0 C--N 1.318 -1.075 0 O-C-N 123.195 1.103 . . . . 0.0 110.21 -179.815 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.534 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 24.7 t -166.31 65.2 0.1 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.513 -0.742 . . . . 0.0 110.527 -179.846 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.534 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 66.91 -76.59 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.057 -1.027 . . . . 0.0 110.043 -179.388 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -48.8 -46.81 42.23 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.354 -0.841 . . . . 0.0 111.274 -179.812 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -60.38 -32.75 71.6 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.597 -0.689 . . . . 0.0 110.118 179.784 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.626 HD21 ' CB ' ' A' ' 13' ' ' PRO . 22.2 mt -79.4 -30.43 42.42 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.571 -0.706 . . . . 0.0 110.433 -179.496 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.498 ' CE2' ' CE1' ' A' ' 23' ' ' TYR . 31.0 t80 -77.41 -54.43 6.45 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.562 -0.711 . . . . 0.0 110.685 -179.392 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.716 ' SG ' HD13 ' A' ' 43' ' ' LEU . 45.3 t -57.91 -50.38 73.53 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.578 -0.702 . . . . 0.0 110.675 -179.539 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 99.5 p -59.01 -24.48 62.83 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.553 -0.717 . . . . 0.0 110.944 -179.688 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -99.36 -25.62 14.41 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.398 -0.813 . . . . 0.0 111.305 -179.251 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.498 ' CE1' ' CE2' ' A' ' 19' ' ' PHE . 4.6 m-85 -86.5 -34.41 20.03 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.345 -0.847 . . . . 0.0 111.123 -179.281 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.479 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 4.0 mtt180 -46.6 -54.45 18.95 Favored Pre-proline 0 N--CA 1.499 1.995 0 O-C-N 121.384 -0.823 . . . . 0.0 112.251 -179.59 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.55 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 37.0 Cg_endo -61.09 -25.73 81.65 Favored 'Trans proline' 0 N--CA 1.494 1.507 0 O-C-N 123.305 1.161 . . . . 0.0 110.194 179.895 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -69.87 -46.6 65.16 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.179 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 35.9 mm -57.67 -29.61 35.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 CA-C-O 121.171 0.51 . . . . 0.0 110.402 179.873 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.55 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.5 mmmm -74.04 -36.28 64.39 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 120.01 -0.676 . . . . 0.0 110.204 -177.068 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.4 t -67.51 -19.15 65.28 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.458 -0.776 . . . . 0.0 110.48 179.7 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -118.65 -12.28 9.75 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.333 -0.854 . . . . 0.0 111.356 -179.628 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.684 ' HB3' HD23 ' A' ' 34' ' ' LEU . 42.3 m80 -133.54 94.25 19.86 Favored Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 121.152 -0.967 . . . . 0.0 109.737 179.515 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -75.65 -33.73 3.78 Favored 'Trans proline' 0 C--N 1.316 -1.155 0 O-C-N 123.592 1.312 . . . . 0.0 110.109 -179.841 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.43 -21.15 75.88 Favored Glycine 0 N--CA 1.489 2.198 0 N-CA-C 109.845 -1.302 . . . . 0.0 109.845 179.643 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.684 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.2 OUTLIER -50.18 91.11 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.497 -1.002 . . . . 0.0 111.373 -179.691 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 50.6 p -77.35 165.49 24.38 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.53 -0.731 . . . . 0.0 109.757 179.707 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.584 ' H ' HD12 ' A' ' 36' ' ' ILE . 2.4 mp -52.12 -27.38 9.62 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 O-C-N 121.432 -0.793 . . . . 0.0 110.171 -179.953 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.15 -61.44 6.65 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.054 -1.618 . . . . 0.0 109.054 179.607 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.445 ' HA ' ' HB2' ' A' ' 41' ' ' LYS . 32.8 t0 -76.86 -25.26 52.91 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.735 -0.862 . . . . 0.0 110.584 179.865 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.623 ' HA ' HD12 ' A' ' 34' ' ' LEU . 49.3 m -52.93 -45.55 67.7 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 120.867 -1.146 . . . . 0.0 110.072 179.451 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.637 ' HA ' HD12 ' A' ' 43' ' ' LEU . . . -76.15 -44.04 40.08 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 178.475 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.445 ' HB2' ' HA ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -57.74 -30.3 65.46 Favored 'General case' 0 N--CA 1.497 1.924 0 CA-C-O 121.378 0.609 . . . . 0.0 110.034 179.272 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.422 ' N ' ' O ' ' A' ' 38' ' ' ASP . 2.7 tptt -88.19 -3.02 58.93 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.636 -0.665 . . . . 0.0 110.964 -179.583 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.716 HD13 ' SG ' ' A' ' 20' ' ' CYS . 9.9 mt -90.17 -42.79 10.85 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.261 -0.9 . . . . 0.0 109.064 179.322 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -70.7 -32.24 67.25 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 108.762 -1.735 . . . . 0.0 108.762 179.264 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -58.58 -54.28 48.84 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.65 -0.912 . . . . 0.0 109.835 179.522 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 58.4 mtt -65.86 -54.59 24.69 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.643 -0.661 . . . . 0.0 109.438 179.206 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 68.2 t-105 -51.21 -56.45 12.78 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.605 -0.684 . . . . 0.0 110.787 -179.858 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 35.1 t -61.41 -34.34 75.2 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.436 -0.79 . . . . 0.0 110.252 -179.972 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -61.71 -39.84 92.92 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.578 -0.701 . . . . 0.0 110.114 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 31.4 mm-40 -57.97 155.69 10.38 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.62 -0.675 . . . . 0.0 110.614 -179.906 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.0 t -92.75 -149.58 0.26 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.69 -0.631 . . . . 0.0 109.41 179.527 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.04 50.33 1.99 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.211 -0.931 . . . . 0.0 110.312 179.726 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.59 -42.91 1.28 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.445 -0.784 . . . . 0.0 110.044 179.944 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -60.08 -29.79 68.8 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.454 -0.779 . . . . 0.0 110.584 -179.671 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 44.2 tttt -95.3 22.7 6.55 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.283 -0.886 . . . . 0.0 111.214 -179.368 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.436 ' HB2' ' HD3' ' A' ' 57' ' ' PRO . 10.0 mp0 -100.36 -61.09 0.1 OUTLIER Pre-proline 0 N--CA 1.497 1.876 0 O-C-N 121.349 -0.844 . . . . 0.0 111.047 179.683 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.436 ' HD3' ' HB2' ' A' ' 56' ' ' GLN . 55.5 Cg_endo -76.96 -36.76 1.33 Allowed 'Trans proline' 0 N--CA 1.485 0.987 0 O-C-N 122.618 0.799 . . . . 0.0 110.7 179.884 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -79.79 3.6 19.02 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.407 -0.808 . . . . 0.0 111.916 -178.929 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.416 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -98.31 -18.86 18.12 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.075 -1.016 . . . . 0.0 110.882 179.983 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -77.64 -24.39 49.5 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.286 -0.884 . . . . 0.0 110.363 179.817 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.441 ' HD3' HD13 ' A' ' 18' ' ' LEU . 55.0 tttt -59.82 -40.02 87.04 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.462 -0.774 . . . . 0.0 109.718 179.456 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.401 ' CB ' ' HA ' ' A' ' 14' ' ' SER . . . -69.42 -10.71 59.2 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.626 -0.671 . . . . 0.0 110.537 179.312 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.85 6.78 33.78 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.163 -0.961 . . . . 0.0 110.439 179.218 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 38.1 mmtt -105.78 -35.04 7.48 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.255 -0.903 . . . . 0.0 109.078 178.86 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.1 mp -78.38 -0.0 27.38 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.936 -0.478 . . . . 0.0 110.888 179.44 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 59.5 tttt -89.3 -26.16 21.28 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.168 -0.958 . . . . 0.0 109.805 179.292 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -83.27 -15.77 48.96 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.573 -0.704 . . . . 0.0 110.478 179.425 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 32.8 mtpt -101.48 -27.17 13.27 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.307 -0.87 . . . . 0.0 109.992 179.688 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.442 ' O ' HG22 ' A' ' 73' ' ' ILE . 23.0 t80 -77.68 -51.47 10.55 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.557 -0.714 . . . . 0.0 109.642 179.627 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -70.51 -6.82 38.95 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.685 -0.634 . . . . 0.0 111.589 -179.632 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 47.8 mttt -110.66 -33.9 6.43 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.077 -1.014 . . . . 0.0 110.174 179.868 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -87.34 -29.88 21.23 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.556 -0.715 . . . . 0.0 110.833 -179.47 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.442 HG22 ' O ' ' A' ' 69' ' ' TYR . 3.2 tp . . . . . 0 N--CA 1.498 1.927 0 O-C-N 121.401 -0.812 . . . . 0.0 110.436 -179.69 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo . . . . . 0 N--CA 1.484 0.939 0 N-CA-C 110.628 -0.566 . . . . 0.0 110.628 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.56 -163.08 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.803 -0.56 . . . . 0.0 110.302 -179.821 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 7.1 mpt_? -55.22 154.62 10.62 Favored Pre-proline 0 N--CA 1.5 2.045 0 O-C-N 121.37 -0.831 . . . . 0.0 110.768 -179.889 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -73.74 121.9 7.38 Favored 'Trans proline' 0 C--N 1.317 -1.122 0 O-C-N 123.541 1.285 . . . . 0.0 110.01 179.795 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.76 ' HB2' HD21 ' A' ' 18' ' ' LEU . 47.8 Cg_endo -82.23 162.48 17.62 Favored 'Trans proline' 0 C--N 1.317 -1.099 0 O-C-N 123.208 1.11 . . . . 0.0 110.353 -179.614 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.535 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 0.9 OUTLIER -162.75 65.76 0.21 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.554 -0.716 . . . . 0.0 110.223 -179.758 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.535 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 66.83 -76.58 0.05 OUTLIER 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.171 -0.956 . . . . 0.0 109.926 -179.35 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.439 ' CD1' ' CD1' ' A' ' 47' ' ' TRP . 11.7 t80 -51.64 -42.16 61.85 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.206 -0.934 . . . . 0.0 110.807 179.878 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -65.16 -26.34 68.13 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 120.085 -0.646 . . . . 0.0 109.824 179.716 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.76 HD21 ' HB2' ' A' ' 13' ' ' PRO . 35.9 mt -84.03 -39.2 19.92 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.5 -0.75 . . . . 0.0 110.064 -179.736 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -67.16 -49.77 63.56 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.557 -0.715 . . . . 0.0 110.223 -179.862 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 9.0 t -67.2 -28.29 67.96 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.62 -0.675 . . . . 0.0 109.964 179.561 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 42.0 t -87.57 4.23 44.46 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.491 -0.756 . . . . 0.0 111.632 -179.415 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 50.8 mm-40 -141.51 2.58 1.64 Allowed 'General case' 0 N--CA 1.499 1.997 0 O-C-N 120.974 -1.079 . . . . 0.0 112.367 -179.568 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 33.9 m-85 -122.27 22.2 10.17 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 120.826 -1.171 . . . . 0.0 111.129 -179.671 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.507 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 15.3 mtp180 -87.82 -45.49 0.49 Allowed Pre-proline 0 N--CA 1.489 1.49 0 O-C-N 121.361 -0.837 . . . . 0.0 112.403 179.815 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.582 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.4 Cg_endo -66.83 -14.68 44.71 Favored 'Trans proline' 0 N--CA 1.492 1.393 0 O-C-N 122.917 0.956 . . . . 0.0 110.686 -179.035 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -74.25 -52.58 11.92 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 177.837 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 30.2 mm -52.46 -31.26 15.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 CA-C-O 121.297 0.57 . . . . 0.0 110.454 179.649 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.582 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.9 mmmm -72.54 -33.45 66.84 Favored 'General case' 0 N--CA 1.496 1.855 0 C-N-CA 120.123 -0.631 . . . . 0.0 110.176 -177.303 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.7 t -62.03 -25.98 67.98 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.589 -0.694 . . . . 0.0 110.508 -179.922 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -115.7 -24.55 8.19 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.551 -0.718 . . . . 0.0 110.79 -179.669 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.768 ' HB3' HD23 ' A' ' 34' ' ' LEU . 38.3 m80 -119.3 96.75 50.13 Favored Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.476 -0.765 . . . . 0.0 109.543 -179.889 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -75.33 -28.79 8.36 Favored 'Trans proline' 0 C--N 1.313 -1.293 0 O-C-N 123.444 1.234 . . . . 0.0 110.49 -179.813 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -83.88 -13.94 73.81 Favored Glycine 0 N--CA 1.488 2.129 0 N-CA-C 110.506 -1.037 . . . . 0.0 110.506 -179.947 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.768 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -61.71 79.56 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.413 -1.051 . . . . 0.0 111.273 -179.333 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.404 ' N ' ' O ' ' A' ' 33' ' ' GLY . 79.5 p -69.48 174.79 4.55 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.394 -0.816 . . . . 0.0 109.581 179.847 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 40.3 mm -54.33 -29.9 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 O-C-N 121.308 -0.87 . . . . 0.0 110.15 179.895 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.7 -65.91 3.1 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 179.906 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.463 ' HB3' HD13 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -69.83 -29.72 67.05 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.622 -0.928 . . . . 0.0 110.757 179.857 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 73.7 m -64.65 -31.0 72.02 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.393 -0.817 . . . . 0.0 110.133 179.707 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.38 -43.78 48.41 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.584 -0.698 . . . . 0.0 110.158 -179.983 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.23 -12.06 47.87 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.596 -0.69 . . . . 0.0 111.822 -179.403 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 9.4 tptt -77.59 -59.64 2.7 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.987 -1.071 . . . . 0.0 109.797 179.529 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 43.8 mt -48.95 -26.08 2.3 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.413 -0.805 . . . . 0.0 111.336 -179.729 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.1 -37.87 82.79 Favored Glycine 0 N--CA 1.492 2.425 0 N-CA-C 109.277 -1.529 . . . . 0.0 109.277 179.673 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -50.9 -35.04 30.94 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.462 -1.022 . . . . 0.0 110.919 -179.839 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 22.8 mmt -81.84 -42.85 19.05 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.66 -0.65 . . . . 0.0 109.591 179.587 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . 0.439 ' CD1' ' CD1' ' A' ' 16' ' ' PHE . 45.4 t-105 -51.86 -52.66 47.93 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.526 -0.734 . . . . 0.0 110.788 -179.862 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.9 t -68.17 -32.1 72.11 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.381 -0.824 . . . . 0.0 110.506 -179.572 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -58.68 -38.84 79.1 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.516 -0.74 . . . . 0.0 110.252 -179.86 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -73.63 172.09 12.04 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.514 -0.741 . . . . 0.0 109.944 179.668 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 88.6 p -164.17 110.86 1.07 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.486 -0.758 . . . . 0.0 110.507 -179.918 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 51.6 35.34 14.49 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.429 -0.794 . . . . 0.0 111.054 179.611 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 70.8 mttt -135.39 -73.51 0.46 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.547 -0.721 . . . . 0.0 110.302 179.961 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -66.87 -20.67 65.96 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.511 -0.743 . . . . 0.0 110.687 -179.937 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.437 ' HG2' ' CH2' ' A' ' 47' ' ' TRP . 50.3 mttt -82.99 -35.27 26.0 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.368 -0.833 . . . . 0.0 110.678 -179.763 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -45.78 -51.55 29.26 Favored Pre-proline 0 N--CA 1.507 2.395 0 O-C-N 121.569 -0.707 . . . . 0.0 111.759 -179.176 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -79.09 -39.29 0.35 Allowed 'Trans proline' 0 C--N 1.314 -1.239 0 O-C-N 123.186 1.098 . . . . 0.0 110.747 179.889 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -81.51 4.68 20.38 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.605 -0.684 . . . . 0.0 112.104 -178.657 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.84 -20.35 17.56 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 120.996 -1.065 . . . . 0.0 110.358 179.387 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -77.72 -26.35 49.97 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.442 -0.786 . . . . 0.0 110.085 179.598 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 50.4 tttt -61.89 -40.38 95.24 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.571 -0.706 . . . . 0.0 110.092 179.855 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.636 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -79.34 -14.0 59.27 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.482 -0.761 . . . . 0.0 110.539 179.606 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -81.16 0.34 36.84 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.313 -0.867 . . . . 0.0 110.299 179.159 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 24.0 mmtp -105.72 -29.81 9.84 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.164 -0.96 . . . . 0.0 109.93 179.4 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.9 mp -87.15 -2.47 58.65 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.882 -0.511 . . . . 0.0 110.361 178.834 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.5 tptt -83.98 -35.64 23.79 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.299 -0.876 . . . . 0.0 108.771 178.916 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -66.95 -59.57 3.38 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 119.939 -0.704 . . . . 0.0 109.324 179.323 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -58.85 -20.3 49.56 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.607 -0.683 . . . . 0.0 111.02 -179.888 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.462 ' O ' HG22 ' A' ' 73' ' ' ILE . 32.6 t80 -77.5 -61.25 2.05 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.158 -0.964 . . . . 0.0 109.579 179.471 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -64.2 -12.49 41.03 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.613 -0.679 . . . . 0.0 111.334 -179.955 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.1 mmtm -102.49 -29.31 11.67 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.131 -0.981 . . . . 0.0 110.516 -179.949 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -99.78 -26.96 13.87 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.528 -0.732 . . . . 0.0 110.95 -179.612 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.462 HG22 ' O ' ' A' ' 69' ' ' TYR . 4.3 tp . . . . . 0 N--CA 1.497 1.886 0 O-C-N 121.276 -0.89 . . . . 0.0 109.907 179.891 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo . . . . . 0 N--CA 1.481 0.776 0 N-CA-C 110.123 -0.761 . . . . 0.0 110.123 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.35 -166.43 0.09 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.616 -0.678 . . . . 0.0 110.326 -179.706 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -58.37 146.34 72.06 Favored Pre-proline 0 N--CA 1.497 1.883 0 O-C-N 121.551 -0.718 . . . . 0.0 110.408 -179.92 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -74.35 125.3 9.57 Favored 'Trans proline' 0 C--N 1.317 -1.113 0 O-C-N 123.433 1.228 . . . . 0.0 110.009 179.783 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.729 ' HB2' HD21 ' A' ' 18' ' ' LEU . 49.4 Cg_endo -82.21 174.81 9.67 Favored 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.232 1.122 . . . . 0.0 110.181 -179.731 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.535 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 0.6 OUTLIER -169.59 69.07 0.06 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.556 -0.715 . . . . 0.0 110.495 -179.956 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.535 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 67.11 -77.64 0.04 OUTLIER 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.045 -1.035 . . . . 0.0 110.574 -179.794 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -47.79 -47.87 30.69 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.237 -0.914 . . . . 0.0 111.508 -179.34 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -61.83 -29.92 70.49 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.621 -0.674 . . . . 0.0 109.87 179.812 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.729 HD21 ' HB2' ' A' ' 13' ' ' PRO . 18.2 mt -83.16 -29.9 28.26 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.479 -0.763 . . . . 0.0 109.989 -179.82 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.498 ' CE2' ' CE1' ' A' ' 23' ' ' TYR . 55.8 t80 -77.56 -54.58 6.24 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.542 -0.724 . . . . 0.0 110.481 -179.463 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.444 ' SG ' HD13 ' A' ' 43' ' ' LEU . 7.7 t -58.43 -50.93 71.93 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.535 -0.728 . . . . 0.0 110.646 -179.704 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.1 t -58.23 -21.67 48.95 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.518 -0.739 . . . . 0.0 110.916 -179.798 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -101.63 -23.63 14.23 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.343 -0.848 . . . . 0.0 111.003 -179.662 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.498 ' CE1' ' CE2' ' A' ' 19' ' ' PHE . 2.4 m-85 -86.7 -33.87 19.9 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.479 -0.763 . . . . 0.0 110.681 -179.61 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.53 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 4.4 mtt-85 -48.35 -52.23 44.46 Favored Pre-proline 0 N--CA 1.498 1.93 0 O-C-N 121.318 -0.864 . . . . 0.0 111.85 179.903 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.571 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.2 Cg_endo -60.28 -27.9 85.8 Favored 'Trans proline' 0 N--CA 1.492 1.431 0 O-C-N 123.218 1.115 . . . . 0.0 109.933 179.797 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.8 tmtm? -69.64 -46.64 65.73 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 177.872 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.601 HG13 HD21 ' A' ' 43' ' ' LEU . 44.5 mm -56.42 -31.2 32.76 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.032 179.711 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.571 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 4.7 mmmm -72.95 -37.58 67.07 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 120.079 -0.649 . . . . 0.0 110.449 -177.552 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.4 t -60.56 -24.43 65.4 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.501 -0.749 . . . . 0.0 110.649 -179.633 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -117.62 -17.03 10.04 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.49 -0.756 . . . . 0.0 111.158 -179.625 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.716 ' HB3' HD23 ' A' ' 34' ' ' LEU . 39.8 m80 -127.77 95.15 35.54 Favored Pre-proline 0 N--CA 1.496 1.865 0 O-C-N 121.297 -0.877 . . . . 0.0 109.528 179.736 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -75.1 -36.14 2.66 Favored 'Trans proline' 0 C--N 1.315 -1.197 0 O-C-N 123.54 1.284 . . . . 0.0 110.307 -179.736 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.402 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -75.58 -18.46 79.77 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 179.771 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.824 HD13 ' HB3' ' A' ' 38' ' ' ASP . 0.3 OUTLIER -53.79 88.14 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.465 -1.021 . . . . 0.0 111.375 -179.507 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.402 ' N ' ' O ' ' A' ' 33' ' ' GLY . 45.2 t -70.88 175.91 4.7 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.517 -0.739 . . . . 0.0 109.741 179.722 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.463 ' N ' HD12 ' A' ' 36' ' ' ILE . 2.1 mp -59.64 -34.23 54.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.306 -0.871 . . . . 0.0 109.513 179.953 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.13 -58.83 12.53 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 109.104 -1.598 . . . . 0.0 109.104 179.63 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.824 ' HB3' HD13 ' A' ' 34' ' ' LEU . 6.5 t70 -70.21 -37.76 75.13 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.742 -0.858 . . . . 0.0 110.063 179.107 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.9 m -61.78 -31.08 71.26 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.159 -0.963 . . . . 0.0 110.107 179.268 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.94 -43.03 46.84 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.568 -0.708 . . . . 0.0 110.398 -179.845 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.42 ' HG2' ' HA ' ' A' ' 38' ' ' ASP . 2.3 ptpt -89.44 -12.97 38.69 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.595 -0.691 . . . . 0.0 111.979 -178.925 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.472 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -88.98 5.7 42.98 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 120.892 -1.13 . . . . 0.0 110.602 179.721 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.601 HD21 HG13 ' A' ' 27' ' ' ILE . 91.0 mt -107.92 -31.23 8.08 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.133 -0.979 . . . . 0.0 109.546 179.486 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.56 -31.9 82.34 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -61.76 -53.84 50.51 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.564 -0.963 . . . . 0.0 109.895 179.918 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 23.6 mtt -64.19 -23.55 67.36 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.589 -0.694 . . . . 0.0 110.345 179.803 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 77.0 t-105 -78.08 -38.92 43.12 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.46 -0.775 . . . . 0.0 110.121 179.794 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.9 m -80.14 -25.07 40.01 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.514 -0.741 . . . . 0.0 110.58 -179.899 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -70.21 -43.86 69.8 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.42 -0.8 . . . . 0.0 109.774 179.72 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 16.3 mm-40 -56.27 154.39 8.14 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.514 -0.742 . . . . 0.0 110.579 -179.92 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.4 m -93.52 -149.76 0.27 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.653 -0.654 . . . . 0.0 109.571 179.698 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -92.26 41.81 1.08 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.262 -0.899 . . . . 0.0 110.259 179.685 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -119.46 -49.06 2.38 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.529 -0.732 . . . . 0.0 110.109 179.899 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -61.62 -27.5 68.7 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.584 -0.698 . . . . 0.0 110.533 -179.831 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.8 ttpt -82.92 -34.38 26.61 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.434 -0.791 . . . . 0.0 110.638 -179.747 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -43.33 -53.09 11.84 Favored Pre-proline 0 N--CA 1.507 2.407 0 O-C-N 121.472 -0.768 . . . . 0.0 112.317 -178.861 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -79.12 -36.44 0.71 Allowed 'Trans proline' 0 C--N 1.315 -1.19 0 O-C-N 123.14 1.074 . . . . 0.0 111.273 179.999 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -85.21 0.02 53.16 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.454 -0.779 . . . . 0.0 112.319 -178.065 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.84 -25.41 15.04 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 120.938 -1.101 . . . . 0.0 110.699 -179.384 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.462 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 3.9 pt20 -73.99 -21.56 59.95 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.468 -0.77 . . . . 0.0 110.644 179.94 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.428 ' CG ' HD13 ' A' ' 18' ' ' LEU . 31.7 tttt -60.32 -43.11 96.67 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.49 -0.756 . . . . 0.0 110.233 179.877 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.23 -12.32 59.93 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.4 -0.813 . . . . 0.0 110.131 179.153 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' A' ' 60' ' ' GLN . . . -58.38 -38.99 78.42 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.244 -0.91 . . . . 0.0 109.229 179.223 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.6 ttpt -67.52 -61.47 1.88 Allowed 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 178.513 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.57 HD22 ' HG3' ' A' ' 13' ' ' PRO . 0.7 OUTLIER -44.74 -23.63 0.14 Allowed 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.798 -0.564 . . . . 0.0 112.328 -179.582 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 58.9 tttt -71.89 -44.43 63.76 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.256 -0.902 . . . . 0.0 108.658 178.241 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -82.26 -9.93 59.31 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.738 -0.601 . . . . 0.0 110.058 178.597 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.94 -32.56 11.6 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.309 -0.869 . . . . 0.0 109.153 179.267 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.463 ' O ' HG22 ' A' ' 73' ' ' ILE . 58.8 t80 -77.28 -51.13 11.42 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.131 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -70.91 -8.31 51.99 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.606 -0.684 . . . . 0.0 111.113 179.837 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.7 ttmm -108.87 -34.35 6.67 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.063 -1.023 . . . . 0.0 110.596 -179.907 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -82.24 -31.11 30.36 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.466 -0.772 . . . . 0.0 110.502 -179.853 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.463 HG22 ' O ' ' A' ' 69' ' ' TYR . 4.4 tp . . . . . 0 N--CA 1.496 1.863 0 O-C-N 121.517 -0.739 . . . . 0.0 110.447 179.964 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo . . . . . 0 N--CA 1.486 1.033 0 N-CA-C 110.722 -0.53 . . . . 0.0 110.722 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.7 pttt -59.47 -160.38 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.644 -0.66 . . . . 0.0 110.452 -179.724 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -57.05 149.35 45.96 Favored Pre-proline 0 N--CA 1.499 1.995 0 O-C-N 121.282 -0.886 . . . . 0.0 110.786 -179.884 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.408 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.6 Cg_endo -76.41 124.37 7.68 Favored 'Trans proline' 0 C--N 1.317 -1.114 0 O-C-N 123.455 1.24 . . . . 0.0 109.651 179.31 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.513 ' C ' ' HB1' ' A' ' 62' ' ' ALA . 47.6 Cg_endo -81.2 177.08 8.17 Favored 'Trans proline' 0 C--N 1.316 -1.139 0 O-C-N 123.261 1.137 . . . . 0.0 110.158 -179.644 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.566 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 8.9 t -167.77 60.13 0.07 Allowed 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.458 -0.776 . . . . 0.0 110.684 -179.766 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.593 ' HB2' ' HA ' ' A' ' 59' ' ' GLU . . . 70.14 -74.79 0.08 Allowed 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.199 -0.938 . . . . 0.0 110.1 -179.469 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -48.76 -50.42 33.97 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.347 -0.846 . . . . 0.0 111.241 -179.643 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -58.91 -40.96 86.11 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.593 -0.692 . . . . 0.0 109.477 179.431 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.743 HD11 ' HB2' ' A' ' 62' ' ' ALA . 53.2 mt -61.67 -46.61 89.01 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.681 -0.637 . . . . 0.0 109.884 179.732 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.499 ' CE2' ' CE2' ' A' ' 23' ' ' TYR . 23.6 t80 -65.88 -50.43 64.56 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.715 -0.616 . . . . 0.0 110.252 -179.891 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.3 m -65.71 -29.1 69.59 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.673 -0.642 . . . . 0.0 110.057 179.981 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.7 m -67.85 -23.68 65.18 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.559 -0.713 . . . . 0.0 110.75 -179.749 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -110.2 -27.76 8.97 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.38 -0.825 . . . . 0.0 111.42 -179.104 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.499 ' CE2' ' CE2' ' A' ' 19' ' ' PHE . 7.2 m-85 -81.6 -37.23 27.96 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.18 -0.95 . . . . 0.0 110.849 -179.238 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.534 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 11.2 mtt85 -48.76 -51.75 51.27 Favored Pre-proline 0 N--CA 1.495 1.802 0 O-C-N 121.305 -0.872 . . . . 0.0 111.823 -179.974 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.534 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 36.0 Cg_endo -59.71 -27.62 85.39 Favored 'Trans proline' 0 N--CA 1.492 1.421 0 O-C-N 123.137 1.072 . . . . 0.0 109.821 179.455 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.88 -48.09 48.23 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 177.349 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.643 HG13 HD21 ' A' ' 43' ' ' LEU . 41.6 mm -54.71 -33.02 26.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.479 179.826 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.553 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER -68.23 -31.26 70.63 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.569 -0.707 . . . . 0.0 110.399 -177.579 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.9 t -82.11 -17.86 45.02 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.505 -0.747 . . . . 0.0 111.195 -179.853 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -114.72 -15.94 11.85 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.179 -0.951 . . . . 0.0 111.362 -179.485 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.567 ' HB3' ' CB ' ' A' ' 34' ' ' LEU . 25.0 m80 -117.26 91.92 38.43 Favored Pre-proline 0 N--CA 1.499 1.977 0 O-C-N 121.27 -0.894 . . . . 0.0 109.634 -179.702 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -77.43 -71.74 0.01 OUTLIER 'Trans proline' 0 N--CA 1.484 0.969 0 O-C-N 123.378 1.199 . . . . 0.0 111.689 -179.199 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -56.26 -21.93 34.89 Favored Glycine 0 N--CA 1.499 2.867 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 -179.752 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.786 HD23 ' O ' ' A' ' 34' ' ' LEU . 7.8 tt -53.41 92.85 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.48 -1.012 . . . . 0.0 110.845 179.506 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 18.8 m -57.7 175.53 0.18 Allowed 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.461 -0.774 . . . . 0.0 110.116 -179.386 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.414 HD13 ' HA ' ' A' ' 36' ' ' ILE . 14.7 mm -56.19 -61.32 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 O-C-N 121.351 -0.843 . . . . 0.0 110.312 -179.897 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.444 ' O ' ' HE2' ' A' ' 41' ' ' LYS . . . -48.59 -38.19 21.15 Favored Glycine 0 N--CA 1.497 2.701 0 N-CA-C 110.319 -1.112 . . . . 0.0 110.319 -179.12 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.42 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 33.4 m-20 -65.39 -36.5 84.15 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.558 -0.966 . . . . 0.0 109.737 178.755 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.599 ' CA ' HD21 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -60.95 -36.43 79.36 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.571 -0.705 . . . . 0.0 110.678 179.743 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.98 -49.64 17.12 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.526 -0.734 . . . . 0.0 110.242 -179.713 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.444 ' HE2' ' O ' ' A' ' 37' ' ' GLY . 0.9 OUTLIER -74.71 -13.41 60.61 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.602 -0.686 . . . . 0.0 111.294 -179.621 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.42 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 5.4 tptt -84.63 -59.73 2.28 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 120.933 -1.104 . . . . 0.0 109.836 179.339 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.643 HD21 HG13 ' A' ' 27' ' ' ILE . 16.3 mt -49.15 -29.25 5.17 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.541 -0.724 . . . . 0.0 111.043 -179.819 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.27 -38.58 96.69 Favored Glycine 0 N--CA 1.493 2.444 0 N-CA-C 109.425 -1.47 . . . . 0.0 109.425 179.934 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -50.56 -33.89 23.57 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.445 -1.032 . . . . 0.0 111.041 -179.708 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 31.9 mtt -86.69 -41.31 14.29 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.536 -0.728 . . . . 0.0 110.495 -179.793 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 72.3 t-105 -55.55 -21.21 16.05 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.502 -0.749 . . . . 0.0 111.136 -179.421 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.6 t -93.01 -33.46 14.12 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.324 -0.86 . . . . 0.0 110.239 -179.979 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -63.27 -36.32 83.28 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.637 -0.665 . . . . 0.0 110.067 179.891 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -62.56 150.68 39.82 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.587 -0.696 . . . . 0.0 110.201 179.949 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 83.9 p -98.22 -152.08 0.39 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.611 -0.681 . . . . 0.0 109.588 179.677 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -82.58 56.57 3.38 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.305 -0.872 . . . . 0.0 110.053 179.794 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -134.98 -46.03 0.72 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.444 -0.785 . . . . 0.0 110.198 179.932 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -63.72 -31.14 72.22 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.545 -0.722 . . . . 0.0 110.457 -179.708 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.401 ' O ' ' HB3' ' A' ' 59' ' ' GLU . 19.8 ttpt -99.09 22.75 9.92 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.46 -0.775 . . . . 0.0 110.824 -179.73 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.453 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 4.9 mt-30 -93.44 -59.79 0.2 Allowed Pre-proline 0 N--CA 1.495 1.807 0 O-C-N 121.146 -0.971 . . . . 0.0 110.787 -179.659 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.453 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.5 Cg_endo -79.28 -27.3 4.44 Favored 'Trans proline' 0 N--CA 1.486 1.071 0 O-C-N 122.953 0.975 . . . . 0.0 111.468 -179.58 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.432 ' CE2' ' HB3' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -84.48 -21.12 30.74 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.354 -0.841 . . . . 0.0 111.914 -178.163 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.593 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.2 OUTLIER -69.61 -27.08 64.77 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.245 -0.909 . . . . 0.0 111.033 -179.287 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -78.14 -20.03 52.87 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.42 -0.8 . . . . 0.0 110.508 179.923 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 58.1 tttt -64.05 -46.38 84.63 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.462 -0.773 . . . . 0.0 109.803 179.717 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.743 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -77.5 -13.14 59.99 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.555 -0.715 . . . . 0.0 110.532 179.578 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -78.21 -3.0 40.49 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.325 -0.86 . . . . 0.0 110.081 178.832 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 26.2 mmtm -105.25 -25.31 12.49 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.108 -0.995 . . . . 0.0 110.068 179.507 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.2 mp -88.8 -16.21 32.66 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.749 -0.595 . . . . 0.0 109.926 178.704 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.5 tptt -74.7 -35.89 62.72 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.46 -0.775 . . . . 0.0 109.482 179.397 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -67.2 -57.48 6.65 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.686 -0.634 . . . . 0.0 109.829 179.776 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -58.28 -26.72 63.32 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.601 -0.687 . . . . 0.0 110.593 -179.955 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.631 ' HE1' HD13 ' A' ' 73' ' ' ILE . 37.0 t80 -73.63 -68.25 0.52 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.473 -0.767 . . . . 0.0 109.445 179.503 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -55.34 -21.15 13.95 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.798 -0.564 . . . . 0.0 111.211 -179.772 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -95.46 -19.1 20.14 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.423 -0.798 . . . . 0.0 111.316 -179.485 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -109.73 -31.93 7.27 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.242 -0.911 . . . . 0.0 110.907 -179.537 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.631 HD13 ' HE1' ' A' ' 69' ' ' TYR . 2.5 tp . . . . . 0 N--CA 1.495 1.823 0 C-N-CA 119.822 -0.751 . . . . 0.0 110.024 -179.733 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo . . . . . 0 N--CA 1.485 1.0 0 N-CA-C 110.517 -0.609 . . . . 0.0 110.517 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.7 pttt -67.97 -160.17 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.541 -0.725 . . . . 0.0 109.751 179.815 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -60.44 141.03 91.86 Favored Pre-proline 0 N--CA 1.497 1.898 0 O-C-N 121.359 -0.838 . . . . 0.0 109.88 179.769 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.411 ' HD3' ' CZ ' ' A' ' 69' ' ' TYR . 46.8 Cg_endo -73.77 129.87 14.0 Favored 'Trans proline' 0 C--N 1.317 -1.094 0 O-C-N 123.248 1.131 . . . . 0.0 110.193 -179.897 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.612 ' HB2' HD21 ' A' ' 18' ' ' LEU . 49.1 Cg_endo -81.26 -179.59 5.13 Favored 'Trans proline' 0 C--N 1.318 -1.051 0 O-C-N 123.271 1.143 . . . . 0.0 110.08 -179.94 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.557 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 32.2 t -170.01 62.51 0.05 OUTLIER 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.505 -0.747 . . . . 0.0 110.828 -179.928 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.557 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 70.88 -75.98 0.07 Allowed 'General case' 0 N--CA 1.505 2.308 0 O-C-N 121.043 -1.035 . . . . 0.0 110.504 -179.601 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -50.78 -45.83 59.31 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.23 -0.919 . . . . 0.0 110.952 -179.823 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -61.45 -34.35 75.27 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 120.183 -0.607 . . . . 0.0 109.71 179.622 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.612 HD21 ' HB2' ' A' ' 13' ' ' PRO . 29.8 mt -76.44 -40.16 51.38 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.486 -0.759 . . . . 0.0 110.404 -179.539 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.494 ' CE2' ' CZ ' ' A' ' 23' ' ' TYR . 32.0 t80 -66.45 -51.18 59.61 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.554 -0.716 . . . . 0.0 110.586 -179.43 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 2.2 t -65.7 -28.94 69.44 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.453 -0.78 . . . . 0.0 110.051 179.707 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.9 m -70.06 -15.87 63.06 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.647 -0.658 . . . . 0.0 111.54 -179.273 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -125.65 -25.72 3.64 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.068 -1.02 . . . . 0.0 112.133 -179.116 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.494 ' CZ ' ' CE2' ' A' ' 19' ' ' PHE . 10.6 m-85 -76.95 -38.47 53.25 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.165 -0.959 . . . . 0.0 110.798 -179.448 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.491 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 2.1 mtt180 -48.08 -53.33 33.86 Favored Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 121.359 -0.838 . . . . 0.0 112.415 -179.527 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.534 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.2 Cg_endo -59.61 -27.66 85.49 Favored 'Trans proline' 0 N--CA 1.494 1.517 0 O-C-N 123.221 1.116 . . . . 0.0 110.185 -179.624 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.0 tmtm? -70.46 -46.78 63.16 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 177.542 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.655 HG13 HD21 ' A' ' 43' ' ' LEU . 46.1 mm -57.71 -21.68 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.632 179.724 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.535 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 4.9 mmmm -81.06 -26.96 35.91 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.141 -0.974 . . . . 0.0 110.426 -177.573 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.8 t -86.28 -3.23 58.94 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.482 -0.761 . . . . 0.0 111.119 179.627 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -132.51 -2.01 3.45 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.062 -1.024 . . . . 0.0 112.018 -179.464 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.59 ' CB ' HD13 ' A' ' 34' ' ' LEU . 54.4 m80 -126.33 95.65 38.15 Favored Pre-proline 0 N--CA 1.499 2.015 0 O-C-N 120.915 -1.116 . . . . 0.0 109.779 179.924 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -78.34 -75.41 0.01 OUTLIER 'Trans proline' 0 N--CA 1.485 0.979 0 O-C-N 123.43 1.226 . . . . 0.0 111.708 -179.301 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -51.35 -28.71 20.91 Favored Glycine 0 N--CA 1.503 3.113 0 N-CA-C 110.343 -1.103 . . . . 0.0 110.343 -179.483 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.746 HD23 ' O ' ' A' ' 34' ' ' LEU . 7.8 tt -46.59 96.04 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.792 -0.828 . . . . 0.0 111.455 179.844 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 44.8 m -66.52 178.3 1.3 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.675 -0.64 . . . . 0.0 109.863 -179.77 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.403 ' HA ' HD13 ' A' ' 36' ' ' ILE . 13.8 mm -58.72 -61.44 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.053 0 O-C-N 121.46 -0.775 . . . . 0.0 110.201 179.908 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.457 ' O ' ' HE2' ' A' ' 41' ' ' LYS . . . -46.9 -38.34 10.18 Favored Glycine 0 N--CA 1.498 2.777 0 N-CA-C 110.617 -0.993 . . . . 0.0 110.617 -178.806 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.462 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 1.6 m-20 -68.57 -33.44 74.09 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.585 -0.95 . . . . 0.0 110.055 178.917 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.536 HG23 HD21 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -67.34 -38.63 85.14 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.333 -0.854 . . . . 0.0 110.776 179.69 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.2 -38.36 78.58 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.65 -0.656 . . . . 0.0 110.121 -179.226 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.457 ' HE2' ' O ' ' A' ' 37' ' ' GLY . 1.2 ptpm? -89.72 -13.8 36.06 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 119.988 -0.685 . . . . 0.0 111.167 -179.69 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 3.4 tptt -87.66 -9.33 54.5 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.006 -1.058 . . . . 0.0 110.556 179.015 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.655 HD21 HG13 ' A' ' 27' ' ' ILE . 22.4 mt -95.11 -32.82 12.91 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.39 -0.819 . . . . 0.0 109.287 179.362 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.91 -35.42 72.36 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 108.605 -1.798 . . . . 0.0 108.605 179.178 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -57.13 -39.26 74.8 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.633 -0.922 . . . . 0.0 110.363 179.881 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 30.5 mtt -77.69 -48.69 16.12 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.54 -0.725 . . . . 0.0 110.355 179.991 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 68.8 t-105 -58.3 -25.46 61.87 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.539 -0.726 . . . . 0.0 110.659 -179.712 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 62.5 p -85.9 -37.26 19.3 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.394 -0.816 . . . . 0.0 110.054 179.963 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -63.92 -31.95 73.31 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.523 -0.736 . . . . 0.0 109.967 179.873 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 89.4 mm-40 -62.28 148.73 44.06 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.58 -0.7 . . . . 0.0 110.134 179.889 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.8 m -101.41 -153.01 0.44 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.58 -0.7 . . . . 0.0 109.621 179.724 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -82.52 56.34 3.27 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.344 -0.847 . . . . 0.0 110.119 179.753 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 17.6 tptt -132.25 -49.29 0.93 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.449 -0.782 . . . . 0.0 110.133 -179.994 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -66.8 -35.7 80.68 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.57 -0.706 . . . . 0.0 110.46 -179.948 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.419 ' O ' ' N ' ' A' ' 59' ' ' GLU . 17.6 tttt -71.59 -37.78 70.96 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.552 -0.718 . . . . 0.0 110.864 -179.669 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.402 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 5.0 mm-40 -43.53 -57.19 5.9 Favored Pre-proline 0 N--CA 1.507 2.406 0 O-C-N 121.318 -0.864 . . . . 0.0 112.751 -178.674 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.402 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.0 Cg_endo -77.19 -36.21 1.44 Allowed 'Trans proline' 0 N--CA 1.489 1.255 0 O-C-N 123.071 1.037 . . . . 0.0 111.903 -179.52 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -83.46 -12.28 56.53 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.352 -0.843 . . . . 0.0 112.561 -177.645 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.419 ' N ' ' O ' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -82.72 -27.47 31.13 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.033 -1.042 . . . . 0.0 111.112 -179.165 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -74.01 -20.04 60.45 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.343 -0.848 . . . . 0.0 110.751 -179.987 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 43.5 tttm -65.8 -42.08 91.11 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.286 -0.883 . . . . 0.0 109.962 179.796 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.566 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -81.34 -16.79 51.29 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.599 -0.688 . . . . 0.0 110.224 179.385 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.27 -36.86 78.77 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.343 -0.848 . . . . 0.0 110.306 179.89 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -70.82 -62.34 1.43 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.239 -0.913 . . . . 0.0 110.003 179.858 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.436 ' H ' HD12 ' A' ' 65' ' ' LEU . 4.7 mp -46.88 -24.15 0.55 Allowed 'General case' 0 N--CA 1.505 2.291 0 O-C-N 121.555 -0.716 . . . . 0.0 112.157 -179.453 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.8 tptm -68.23 -48.14 65.95 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.299 -0.876 . . . . 0.0 109.506 179.189 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -65.0 -55.49 18.7 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.735 -0.603 . . . . 0.0 109.953 179.718 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 60.3 mttm -56.67 -26.89 57.56 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.467 -0.771 . . . . 0.0 110.481 179.888 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.449 ' O ' HG22 ' A' ' 73' ' ' ILE . 50.1 t80 -75.91 -67.99 0.62 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.499 -0.751 . . . . 0.0 109.296 179.385 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -51.36 -24.34 4.66 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.662 -0.648 . . . . 0.0 111.478 -179.548 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 46.8 mttp -92.62 -62.53 1.38 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.439 -0.788 . . . . 0.0 110.917 -179.44 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -58.1 -31.04 66.74 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.609 -0.682 . . . . 0.0 111.135 -179.078 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.449 HG22 ' O ' ' A' ' 69' ' ' TYR . 4.6 tp . . . . . 0 N--CA 1.497 1.882 0 O-C-N 121.342 -0.849 . . . . 0.0 110.457 -179.474 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.424 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 53.7 Cg_endo . . . . . 0 N--CA 1.484 0.928 0 CA-C-O 120.756 0.232 . . . . 0.0 112.123 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 9.5 mtpt -43.3 139.91 1.78 Allowed 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.396 -0.815 . . . . 0.0 112.872 -179.065 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.7 tpt180 49.79 99.82 0.04 OUTLIER Pre-proline 0 N--CA 1.497 1.923 0 O-C-N 121.795 -0.566 . . . . 0.0 112.156 178.911 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.408 ' HB3' ' CD2' ' A' ' 69' ' ' TYR . 47.1 Cg_endo -75.79 132.21 14.17 Favored 'Trans proline' 0 C--N 1.318 -1.028 0 O-C-N 123.248 1.131 . . . . 0.0 109.321 178.581 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.55 ' HG3' HD22 ' A' ' 65' ' ' LEU . 50.1 Cg_endo -80.06 155.88 23.02 Favored 'Trans proline' 0 C--N 1.316 -1.152 0 O-C-N 123.161 1.085 . . . . 0.0 110.196 -179.576 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.573 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 7.6 t -158.73 51.43 0.39 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.515 -0.741 . . . . 0.0 110.961 -179.584 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.573 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 71.58 -73.83 0.09 Allowed 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.348 -0.845 . . . . 0.0 110.403 -179.518 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -46.71 -53.72 11.16 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.327 -0.858 . . . . 0.0 111.442 -179.561 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -55.61 -40.93 72.75 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.518 -0.739 . . . . 0.0 109.965 179.512 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.503 HD11 ' HB2' ' A' ' 62' ' ' ALA . 56.4 mt -62.09 -41.41 98.16 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.719 -0.613 . . . . 0.0 109.834 179.819 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -75.19 -53.89 8.05 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.592 -0.692 . . . . 0.0 110.232 -179.996 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 3.7 m -55.44 -55.96 25.7 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.435 -0.791 . . . . 0.0 110.434 -179.976 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 62.9 p -53.6 -29.92 39.97 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.467 -0.771 . . . . 0.0 110.521 179.994 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -88.56 -32.51 18.1 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.618 -0.677 . . . . 0.0 110.74 -179.781 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -94.63 13.61 23.7 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.451 -0.781 . . . . 0.0 111.513 -179.446 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.551 ' CG ' HD11 ' A' ' 43' ' ' LEU . 8.5 mtt180 -88.37 -42.92 0.47 Allowed Pre-proline 0 N--CA 1.488 1.434 0 O-C-N 121.192 -0.942 . . . . 0.0 112.367 179.471 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.58 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.1 Cg_endo -67.04 -16.95 50.68 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 O-C-N 122.711 0.848 . . . . 0.0 110.427 -179.203 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.41 -50.78 23.91 Favored 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 177.859 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 39.0 mm -52.93 -32.7 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 CA-C-O 121.49 0.662 . . . . 0.0 110.281 179.641 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.58 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.6 mmmm -72.37 -37.43 68.77 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.252 -177.215 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.0 t -59.91 -24.57 64.43 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.377 -0.827 . . . . 0.0 110.619 -179.699 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -116.37 -21.83 9.08 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.455 -0.778 . . . . 0.0 110.903 -179.609 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.775 ' HB3' HD23 ' A' ' 34' ' ' LEU . 43.7 m80 -121.71 96.32 47.34 Favored Pre-proline 0 N--CA 1.495 1.788 0 O-C-N 121.342 -0.849 . . . . 0.0 109.682 179.93 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -74.98 -33.27 4.74 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.366 1.193 . . . . 0.0 110.361 -179.817 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -79.48 -11.8 84.46 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 110.35 -1.1 . . . . 0.0 110.35 179.805 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.775 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -62.46 81.64 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.287 -1.125 . . . . 0.0 110.753 -179.668 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.1 t -74.89 177.9 5.94 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.425 -0.797 . . . . 0.0 109.721 179.721 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 37.3 mm -51.33 -37.25 18.21 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.207 0 O-C-N 121.234 -0.916 . . . . 0.0 110.586 -179.899 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -55.57 -68.94 1.43 Allowed Glycine 0 N--CA 1.494 2.502 0 N-CA-C 109.328 -1.509 . . . . 0.0 109.328 179.824 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.533 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 1.9 m-20 -66.19 -29.65 69.97 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.786 -0.832 . . . . 0.0 110.724 179.475 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 75.1 m -66.58 -29.26 69.27 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.164 -0.96 . . . . 0.0 110.291 179.648 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.11 -45.05 59.27 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.553 -0.717 . . . . 0.0 109.948 179.848 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -82.92 -17.72 42.66 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.668 -0.645 . . . . 0.0 112.213 -178.897 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.533 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -82.18 3.18 28.25 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 120.762 -1.211 . . . . 0.0 110.818 179.665 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.551 HD11 ' CG ' ' A' ' 24' ' ' ARG . 34.1 mt -105.79 -29.44 10.04 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.268 -0.895 . . . . 0.0 109.632 179.502 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.09 -37.8 82.85 Favored Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -179.79 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -50.16 -36.02 28.46 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.428 -1.043 . . . . 0.0 110.906 -179.644 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 64.2 mtm -87.27 -39.24 15.58 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.518 -0.739 . . . . 0.0 109.946 179.614 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 67.3 t-105 -55.56 -31.07 61.85 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.605 -0.684 . . . . 0.0 110.994 -179.643 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.2 t -87.35 -32.84 19.4 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.276 -0.89 . . . . 0.0 110.229 -179.802 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -63.66 -37.06 85.92 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.509 -0.744 . . . . 0.0 109.915 179.869 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.0 mm-40 -59.7 149.68 29.99 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.628 -0.67 . . . . 0.0 110.336 179.919 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 85.6 p -92.83 -152.15 0.31 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.688 -0.633 . . . . 0.0 109.613 179.679 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -83.67 55.55 3.27 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.313 -0.867 . . . . 0.0 110.151 179.82 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -135.95 -43.61 0.65 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.453 -0.779 . . . . 0.0 110.255 -179.936 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -62.49 -33.85 75.7 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.457 -0.777 . . . . 0.0 110.336 -179.904 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -96.87 22.35 8.41 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.442 -0.786 . . . . 0.0 111.092 -179.556 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.464 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 2.6 mm100 -92.19 -57.46 0.24 Allowed Pre-proline 0 N--CA 1.496 1.852 0 O-C-N 121.072 -1.017 . . . . 0.0 110.278 179.889 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.464 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 57.5 Cg_endo -82.96 -26.35 2.42 Favored 'Trans proline' 0 N--CA 1.484 0.945 0 O-C-N 122.929 0.963 . . . . 0.0 110.748 179.568 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -83.21 -18.54 38.92 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.456 -0.777 . . . . 0.0 111.955 -178.149 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.436 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.3 OUTLIER -77.2 -26.14 52.48 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.175 -0.953 . . . . 0.0 110.944 -179.288 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -79.45 -21.31 45.64 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.501 -0.75 . . . . 0.0 110.648 179.947 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 62.2 tttt -65.9 -44.33 85.57 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.455 -0.778 . . . . 0.0 109.74 179.643 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.503 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -79.99 -15.13 57.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.581 -0.699 . . . . 0.0 110.161 179.174 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.08 -32.97 72.61 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.351 -0.843 . . . . 0.0 109.942 179.592 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -77.59 -63.9 1.27 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.579 -0.701 . . . . 0.0 109.73 179.45 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.55 HD22 ' HG3' ' A' ' 13' ' ' PRO . 5.0 mp -50.1 -25.68 3.72 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.48 -0.762 . . . . 0.0 111.114 -179.807 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -67.19 -49.95 62.74 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.523 -0.736 . . . . 0.0 109.373 179.307 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -61.98 -49.31 76.61 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.68 -0.637 . . . . 0.0 109.351 179.298 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 37.1 mttp -60.33 -27.37 67.3 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.719 -0.613 . . . . 0.0 110.067 179.444 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.598 ' O ' HG22 ' A' ' 73' ' ' ILE . 19.8 t80 -74.2 -65.11 0.89 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.378 -0.826 . . . . 0.0 109.13 179.024 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -58.1 -25.5 61.42 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.784 -0.572 . . . . 0.0 111.115 -179.495 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.2 mmmt -91.83 -14.25 30.06 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.354 -0.841 . . . . 0.0 111.89 -179.102 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -111.84 -30.13 7.41 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.057 -1.027 . . . . 0.0 110.902 -179.624 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.598 HG22 ' O ' ' A' ' 69' ' ' TYR . 2.5 tp . . . . . 0 N--CA 1.495 1.806 0 O-C-N 121.529 -0.732 . . . . 0.0 110.115 -179.787 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.403 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 46.5 Cg_endo . . . . . 0 N--CA 1.483 0.875 0 N-CA-C 110.499 -0.616 . . . . 0.0 110.499 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.3 pttt -70.82 -154.84 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.529 -0.732 . . . . 0.0 109.73 179.651 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.26 141.65 87.0 Favored Pre-proline 0 N--CA 1.498 1.956 0 O-C-N 121.374 -0.829 . . . . 0.0 109.806 179.661 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -74.1 133.39 17.97 Favored 'Trans proline' 0 C--N 1.318 -1.076 0 O-C-N 123.305 1.16 . . . . 0.0 110.321 -179.811 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.553 ' HB2' HD21 ' A' ' 18' ' ' LEU . 50.8 Cg_endo -80.94 173.7 11.71 Favored 'Trans proline' 0 C--N 1.319 -1.004 0 O-C-N 123.299 1.157 . . . . 0.0 109.903 179.909 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.562 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 37.2 t -170.53 62.9 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.44 -0.787 . . . . 0.0 110.868 -179.899 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.562 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 69.7 -76.31 0.06 Allowed 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.041 -1.037 . . . . 0.0 110.452 -179.62 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -47.67 -50.22 25.36 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.267 -0.896 . . . . 0.0 111.267 -179.463 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -58.73 -35.78 73.25 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.67 -0.643 . . . . 0.0 110.108 179.785 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.662 HD11 ' HB2' ' A' ' 62' ' ' ALA . 24.1 mt -74.4 -35.01 63.43 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.501 -0.749 . . . . 0.0 110.228 -179.581 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . 0.502 ' CE2' ' CZ ' ' A' ' 23' ' ' TYR . 54.9 t80 -74.28 -54.2 8.17 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.599 -0.688 . . . . 0.0 110.626 -179.373 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.458 ' SG ' HD13 ' A' ' 43' ' ' LEU . 1.8 t -59.54 -48.77 80.36 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.583 -0.698 . . . . 0.0 110.489 -179.744 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.7 t -58.63 -26.05 63.32 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.509 -0.744 . . . . 0.0 110.671 -179.694 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -99.13 -22.03 15.87 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.519 -0.738 . . . . 0.0 111.212 -179.316 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.502 ' CZ ' ' CE2' ' A' ' 19' ' ' PHE . 7.1 m-85 -92.68 -36.38 12.98 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.389 -0.819 . . . . 0.0 110.829 -179.466 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.49 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 9.6 mtt180 -47.59 -53.56 29.34 Favored Pre-proline 0 N--CA 1.499 1.986 0 O-C-N 121.38 -0.825 . . . . 0.0 112.215 -179.55 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.529 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.8 Cg_endo -60.64 -26.93 83.93 Favored 'Trans proline' 0 N--CA 1.494 1.544 0 O-C-N 123.198 1.104 . . . . 0.0 110.021 179.997 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.06 -47.13 63.25 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 177.726 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.463 HG22 ' HG ' ' A' ' 34' ' ' LEU . 46.5 mm -55.97 -22.7 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.328 179.551 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.716 ' NZ ' HD12 ' A' ' 34' ' ' LEU . 16.1 mmmt -82.74 -29.64 29.6 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.327 -0.858 . . . . 0.0 111.34 -176.717 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.9 t -72.91 -34.73 66.81 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.177 -0.952 . . . . 0.0 110.18 -179.627 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -97.67 -4.43 37.36 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.72 -0.612 . . . . 0.0 111.226 -179.258 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.454 ' CB ' ' HB2' ' A' ' 34' ' ' LEU . 27.8 m80 -140.08 96.46 8.14 Favored Pre-proline 0 N--CA 1.493 1.703 0 O-C-N 121.26 -0.9 . . . . 0.0 108.698 179.016 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -75.03 -47.36 0.2 Allowed 'Trans proline' 0 C--N 1.315 -1.205 0 O-C-N 123.481 1.253 . . . . 0.0 110.662 -179.306 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.59 -20.59 63.92 Favored Glycine 0 N--CA 1.494 2.513 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 179.03 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.716 HD12 ' NZ ' ' A' ' 28' ' ' LYS . 0.2 OUTLIER -48.01 92.22 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.471 -1.017 . . . . 0.0 111.705 -179.769 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.8 m -66.89 -179.3 0.88 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.497 -0.752 . . . . 0.0 109.461 179.3 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.421 HD13 ' HA ' ' A' ' 36' ' ' ILE . 17.8 mm -60.78 -56.39 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.382 -0.824 . . . . 0.0 109.843 179.946 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.43 ' O ' ' HE2' ' A' ' 41' ' ' LYS . . . -49.89 -43.41 39.48 Favored Glycine 0 N--CA 1.497 2.754 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 -179.018 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.637 ' HB2' HD13 ' A' ' 34' ' ' LEU . 40.5 m-20 -61.5 -36.17 79.73 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.636 -0.92 . . . . 0.0 109.993 178.949 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.52 ' O ' HD12 ' A' ' 43' ' ' LEU . 10.9 m -60.08 -36.9 78.4 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.28 -0.887 . . . . 0.0 110.785 179.573 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.54 -54.02 6.91 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.624 -0.673 . . . . 0.0 110.357 -179.695 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.43 ' HE2' ' O ' ' A' ' 37' ' ' GLY . 1.8 ptpm? -67.39 -28.34 67.84 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.63 -0.669 . . . . 0.0 111.458 -179.23 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.486 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -81.5 -2.01 48.18 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.911 -1.118 . . . . 0.0 110.916 179.697 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.52 HD12 ' O ' ' A' ' 39' ' ' THR . 26.2 mt -106.6 -34.12 7.44 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.203 -0.935 . . . . 0.0 110.174 -179.904 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.5 -40.93 96.45 Favored Glycine 0 N--CA 1.494 2.504 0 N-CA-C 109.885 -1.286 . . . . 0.0 109.885 -179.653 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -55.88 -34.12 65.22 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.544 -0.974 . . . . 0.0 110.732 -179.628 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 47.1 mmm -80.65 -46.88 14.91 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.542 -0.724 . . . . 0.0 110.358 -179.876 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 74.2 t-105 -56.76 -22.11 33.3 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.53 -0.731 . . . . 0.0 110.989 -179.621 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 16.5 t -91.83 -35.52 14.04 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.269 -0.894 . . . . 0.0 110.231 179.976 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -65.02 -34.66 78.97 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.551 -0.718 . . . . 0.0 110.041 179.89 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 63.2 mm-40 -59.01 150.58 24.27 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.556 -0.715 . . . . 0.0 110.417 179.999 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 10.5 t -89.91 -151.53 0.24 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.637 -0.665 . . . . 0.0 109.545 179.744 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -85.74 53.6 2.83 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.258 -0.901 . . . . 0.0 110.192 179.849 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 67.4 mttt -132.17 -43.16 0.96 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.438 -0.789 . . . . 0.0 110.208 179.97 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -59.61 -31.42 69.47 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.488 -0.757 . . . . 0.0 110.626 -179.673 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 69.8 tttt -101.0 25.54 7.96 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.467 -0.771 . . . . 0.0 110.964 -179.503 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.434 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 1.7 mm-40 -97.64 -53.43 0.21 Allowed Pre-proline 0 N--CA 1.496 1.842 0 O-C-N 121.213 -0.929 . . . . 0.0 110.786 -179.836 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.434 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.6 Cg_endo -85.11 -31.86 0.35 Allowed 'Trans proline' 0 C--N 1.321 -0.908 0 O-C-N 122.92 0.958 . . . . 0.0 111.33 -179.634 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.34 -11.63 57.46 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.417 -0.802 . . . . 0.0 111.775 -178.579 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.556 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.5 OUTLIER -79.22 -26.71 42.49 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.075 -1.016 . . . . 0.0 110.856 -179.421 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -76.12 -20.06 57.97 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.487 -0.758 . . . . 0.0 110.871 -179.9 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 36.7 tttt -65.02 -44.23 89.83 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.387 -0.821 . . . . 0.0 110.109 179.977 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.662 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -82.44 -15.51 52.33 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.51 -0.744 . . . . 0.0 110.11 179.283 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.36 -28.17 67.98 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.29 -0.881 . . . . 0.0 109.362 178.923 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -81.5 -64.99 1.07 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.61 -0.681 . . . . 0.0 109.472 179.175 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.511 ' H ' HD12 ' A' ' 65' ' ' LEU . 3.8 mp -50.65 -24.23 3.17 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.573 -0.704 . . . . 0.0 111.318 -179.732 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.3 tttt -63.18 -53.07 59.0 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.443 -0.785 . . . . 0.0 109.663 179.292 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -62.51 -48.78 78.07 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.682 -0.636 . . . . 0.0 110.25 -179.996 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 24.2 mmtp -60.32 -27.18 67.13 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.543 -0.723 . . . . 0.0 110.466 -179.674 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.48 ' O ' HG22 ' A' ' 73' ' ' ILE . 3.7 m-85 -80.72 -64.69 1.13 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.518 -0.739 . . . . 0.0 109.894 179.845 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -50.56 -35.2 28.69 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.5 -0.75 . . . . 0.0 111.163 -179.697 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 41.5 mmtt -76.11 -50.82 13.62 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.546 -0.721 . . . . 0.0 110.778 -179.754 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -74.52 -23.91 58.89 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.45 -0.781 . . . . 0.0 111.302 -179.103 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . 0.48 HG22 ' O ' ' A' ' 69' ' ' TYR . 9.1 tp . . . . . 0 N--CA 1.493 1.718 0 O-C-N 121.266 -0.896 . . . . 0.0 109.904 -179.983 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.426 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 48.6 Cg_endo . . . . . 0 N--CA 1.485 1.001 0 N-CA-C 110.725 -0.529 . . . . 0.0 110.725 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -108.2 26.27 10.62 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.585 -0.697 . . . . 0.0 110.784 179.815 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -163.27 95.62 1.08 Allowed Pre-proline 0 N--CA 1.494 1.767 0 O-C-N 121.702 -0.624 . . . . 0.0 110.16 -179.906 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -75.56 114.77 4.04 Favored 'Trans proline' 0 C--N 1.316 -1.14 0 O-C-N 123.352 1.185 . . . . 0.0 110.66 -179.843 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.579 ' HB2' HD21 ' A' ' 18' ' ' LEU . 47.4 Cg_endo -81.23 157.57 19.93 Favored 'Trans proline' 0 C--N 1.319 -1.013 0 O-C-N 123.303 1.159 . . . . 0.0 110.026 179.779 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.537 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 32.6 t -151.82 55.78 0.84 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.467 -0.771 . . . . 0.0 110.91 -179.625 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.537 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 67.87 -74.94 0.07 Allowed 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.194 -0.942 . . . . 0.0 110.152 -179.65 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -47.77 -51.26 23.06 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.416 -0.802 . . . . 0.0 111.402 -179.605 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -57.82 -41.67 82.73 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.455 -0.778 . . . . 0.0 109.743 179.548 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.639 HD11 ' HB2' ' A' ' 62' ' ' ALA . 61.9 mt -59.73 -46.65 88.46 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.576 -0.703 . . . . 0.0 109.947 179.9 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -69.67 -51.33 35.64 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.679 -0.638 . . . . 0.0 110.284 -179.729 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.5 m -56.24 -54.33 46.56 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.54 -0.725 . . . . 0.0 110.787 -179.658 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 34.7 t -57.94 -30.75 66.22 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.358 -0.839 . . . . 0.0 110.539 -179.807 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 -86.66 -29.42 22.51 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.534 -0.729 . . . . 0.0 110.721 -179.651 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -99.62 9.76 42.57 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.35 -0.844 . . . . 0.0 111.519 -179.401 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.516 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 3.6 mtt180 -79.75 -50.12 1.27 Allowed Pre-proline 0 N--CA 1.49 1.567 0 O-C-N 121.222 -0.924 . . . . 0.0 111.522 179.453 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.567 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 37.5 Cg_endo -63.74 -15.61 49.88 Favored 'Trans proline' 0 N--CA 1.491 1.362 0 O-C-N 122.918 0.957 . . . . 0.0 110.609 -179.631 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 9.1 tmtt? -72.69 -49.84 28.79 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 177.93 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.534 ' CG1' HD21 ' A' ' 43' ' ' LEU . 16.2 mm -55.65 -38.11 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 CA-C-O 121.51 0.671 . . . . 0.0 110.204 179.804 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.567 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 4.2 mmmm -68.15 -40.93 82.27 Favored 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.183 -177.101 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.4 t -58.04 -24.08 56.93 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.398 -0.814 . . . . 0.0 110.88 -179.527 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -114.32 -23.6 9.32 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.478 -0.764 . . . . 0.0 110.686 -179.679 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.771 ' HB3' HD23 ' A' ' 34' ' ' LEU . 53.8 m80 -119.67 96.79 49.79 Favored Pre-proline 0 N--CA 1.494 1.75 0 O-C-N 121.483 -0.761 . . . . 0.0 109.519 -179.783 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -75.08 -27.94 9.45 Favored 'Trans proline' 0 C--N 1.314 -1.28 0 O-C-N 123.525 1.276 . . . . 0.0 110.542 -179.855 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -85.72 -11.34 74.37 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 110.449 -1.06 . . . . 0.0 110.449 179.951 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.771 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -62.18 81.72 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.282 -1.128 . . . . 0.0 110.747 -179.608 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.5 m -70.98 171.0 11.58 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.407 -0.808 . . . . 0.0 109.904 -179.977 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 38.6 mm -51.76 -29.55 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.175 0 O-C-N 121.262 -0.899 . . . . 0.0 110.315 179.976 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.35 -69.06 1.39 Allowed Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.31 -1.516 . . . . 0.0 109.31 179.802 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.651 ' HB3' HD13 ' A' ' 34' ' ' LEU . 13.7 t70 -67.26 -28.5 68.09 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.591 -0.946 . . . . 0.0 110.698 179.723 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 85.3 m -65.26 -27.8 68.9 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.344 -0.848 . . . . 0.0 110.131 179.775 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.59 -47.27 19.83 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.44 -0.788 . . . . 0.0 109.948 179.76 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -82.57 -12.37 57.77 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.602 -0.686 . . . . 0.0 111.578 -179.603 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.1 OUTLIER -78.85 -60.5 2.35 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.985 -1.072 . . . . 0.0 109.641 179.55 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.534 HD21 ' CG1' ' A' ' 27' ' ' ILE . 52.7 mt -50.96 -25.17 4.32 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.428 -0.795 . . . . 0.0 111.07 -179.873 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.47 -40.43 91.18 Favored Glycine 0 N--CA 1.493 2.435 0 N-CA-C 109.173 -1.571 . . . . 0.0 109.173 179.553 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -54.98 -37.34 66.41 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.507 -0.996 . . . . 0.0 110.676 -179.875 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 10.9 mmt -70.4 -53.09 17.94 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.531 -0.73 . . . . 0.0 109.988 179.872 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 47' ' ' TRP . . . . . 0.409 ' CH2' ' HB3' ' A' ' 55' ' ' LYS . 63.9 t-105 -49.47 -54.58 16.95 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.475 -0.765 . . . . 0.0 111.115 -179.677 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 26.6 t -57.44 -36.56 71.54 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.376 -0.828 . . . . 0.0 110.304 179.993 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -63.82 -41.41 97.86 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.544 -0.722 . . . . 0.0 109.743 179.69 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -60.14 156.76 14.45 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.583 -0.698 . . . . 0.0 110.268 179.814 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.0 m -100.52 -151.93 0.41 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.681 -0.637 . . . . 0.0 109.395 179.485 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.42 51.15 2.15 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.329 -0.857 . . . . 0.0 109.993 179.613 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 42.1 mtmt -130.46 -49.92 1.08 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.431 -0.793 . . . . 0.0 110.523 -179.84 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -70.83 -16.37 62.72 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.553 -0.717 . . . . 0.0 111.481 -179.102 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.414 ' HG3' ' N ' ' A' ' 56' ' ' GLN . 32.2 pttt -107.07 -37.31 6.34 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.152 -0.967 . . . . 0.0 111.116 -179.592 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.414 ' N ' ' HG3' ' A' ' 55' ' ' LYS . 5.9 mm100 -42.87 -56.52 6.02 Favored Pre-proline 0 N--CA 1.508 2.444 0 O-C-N 121.402 -0.811 . . . . 0.0 112.438 -178.847 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.403 ' CD ' ' CB ' ' A' ' 56' ' ' GLN . 48.6 Cg_endo -72.52 -34.15 7.74 Favored 'Trans proline' 0 C--N 1.316 -1.172 0 O-C-N 123.061 1.032 . . . . 0.0 109.891 179.624 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -75.66 -8.16 56.11 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.647 -0.658 . . . . 0.0 110.667 179.818 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.422 ' OE1' ' HB2' ' A' ' 15' ' ' ALA . 5.6 mm-40 -77.49 -58.39 3.3 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.18 -0.95 . . . . 0.0 109.96 179.776 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.401 ' HG3' ' N ' ' A' ' 61' ' ' LYS . 11.1 pt20 -47.75 -28.2 2.38 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.697 -0.627 . . . . 0.0 111.535 -179.413 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.401 ' N ' ' HG3' ' A' ' 60' ' ' GLN . 70.1 tttt -60.35 -50.35 73.97 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.319 -0.863 . . . . 0.0 109.886 179.648 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.639 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -72.64 -8.25 54.35 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.654 -0.654 . . . . 0.0 110.575 179.426 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.58 0.3 52.93 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.175 -0.953 . . . . 0.0 110.215 178.895 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 48.8 mmtt -105.28 -29.34 10.36 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.105 -0.997 . . . . 0.0 109.695 179.398 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.5 mp -88.47 -9.72 51.53 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.78 -0.575 . . . . 0.0 110.157 178.758 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.3 tptm -81.53 -31.17 32.88 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.3 -0.875 . . . . 0.0 109.204 179.154 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -67.89 -61.34 1.92 Allowed 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 120.114 -0.634 . . . . 0.0 109.359 179.411 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.9 mtpp -57.59 -23.9 53.35 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.573 -0.705 . . . . 0.0 110.72 179.887 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.426 ' CD2' ' HB2' ' A' ' 9' ' ' PRO . 23.9 t80 -74.22 -60.28 2.34 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.263 -0.898 . . . . 0.0 109.857 179.662 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -80.2 -17.81 51.32 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.698 -0.627 . . . . 0.0 112.046 -178.723 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.0 ttmm -98.93 -23.76 15.2 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.102 -0.999 . . . . 0.0 112.052 -178.621 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -102.25 -31.98 10.28 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.151 -0.968 . . . . 0.0 111.457 -179.149 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.9 tp . . . . . 0 N--CA 1.502 2.13 0 O-C-N 121.242 -0.911 . . . . 0.0 110.666 -179.492 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.4 ttt . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.145 0.498 . . . . 0.0 110.231 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.5 mttm -167.57 -40.01 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.628 -0.67 . . . . 0.0 110.489 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 10.1 tttt -167.69 84.81 0.21 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.455 -0.778 . . . . 0.0 110.272 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 42.3 mttm -60.93 -56.5 20.45 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.575 -0.703 . . . . 0.0 110.344 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.422 ' HB2' ' HB3' ' A' ' 8' ' ' ALA . 0.9 OUTLIER -162.73 159.7 19.61 Favored Pre-proline 0 N--CA 1.494 1.75 0 O-C-N 121.605 -0.684 . . . . 0.0 110.237 -179.99 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -73.28 -46.64 0.35 Allowed 'Trans proline' 0 C--N 1.318 -1.069 0 O-C-N 123.333 1.175 . . . . 0.0 110.627 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -79.4 -21.61 45.4 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.565 -0.709 . . . . 0.0 110.837 -179.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.422 ' HB3' ' HB2' ' A' ' 5' ' ' ASP . . . -74.95 144.85 80.27 Favored Pre-proline 0 N--CA 1.496 1.846 0 O-C-N 121.358 -0.839 . . . . 0.0 109.81 179.632 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -73.09 88.52 0.95 Allowed 'Trans proline' 0 C--N 1.317 -1.093 0 O-C-N 123.292 1.153 . . . . 0.0 110.568 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.8 mtpt -56.07 -171.57 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.662 -0.649 . . . . 0.0 110.711 -179.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.2 mtt85 -56.64 139.46 75.94 Favored Pre-proline 0 N--CA 1.498 1.933 0 O-C-N 121.412 -0.805 . . . . 0.0 110.456 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.422 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 50.0 Cg_endo -77.03 133.27 13.48 Favored 'Trans proline' 0 C--N 1.318 -1.039 0 O-C-N 123.382 1.201 . . . . 0.0 110.252 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.78 ' CG ' HD21 ' A' ' 18' ' ' LEU . 50.3 Cg_endo -82.42 -162.5 0.18 Allowed 'Trans proline' 0 C--N 1.319 -0.993 0 O-C-N 123.236 1.124 . . . . 0.0 109.903 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.539 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 31.0 t -165.82 63.52 0.11 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.445 -0.784 . . . . 0.0 110.458 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.539 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 67.63 -75.54 0.06 Allowed 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.21 -0.931 . . . . 0.0 109.958 -179.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -47.19 -50.48 20.71 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.424 -0.798 . . . . 0.0 111.386 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -59.18 -39.53 82.82 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.614 -0.679 . . . . 0.0 109.746 179.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.78 HD21 ' CG ' ' A' ' 13' ' ' PRO . 45.0 mt -65.94 -37.19 85.39 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.594 -0.691 . . . . 0.0 109.891 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.492 ' CE2' ' CZ ' ' A' ' 23' ' ' TYR . 28.0 t80 -77.37 -54.06 6.91 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.634 -0.666 . . . . 0.0 110.654 -179.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 14.6 t -56.91 -53.07 62.14 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.459 -0.776 . . . . 0.0 110.707 -179.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 82.7 p -57.77 -25.4 60.44 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.577 -0.702 . . . . 0.0 110.859 -179.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -96.55 -26.44 15.26 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.378 -0.826 . . . . 0.0 111.143 -179.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.492 ' CZ ' ' CE2' ' A' ' 19' ' ' PHE . 6.2 m-85 -88.5 -34.66 17.35 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.322 -0.861 . . . . 0.0 110.96 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.521 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 25.5 mtt180 -48.18 -52.83 38.61 Favored Pre-proline 0 N--CA 1.498 1.947 0 O-C-N 121.338 -0.851 . . . . 0.0 112.12 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.564 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.3 Cg_endo -59.64 -27.62 85.4 Favored 'Trans proline' 0 N--CA 1.494 1.541 0 O-C-N 123.184 1.097 . . . . 0.0 110.233 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.9 tmtt? -69.76 -45.9 67.02 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 177.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.1 mm -57.77 -31.59 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.246 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.564 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 4.8 mmmm -71.26 -36.23 71.67 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 120.004 -0.678 . . . . 0.0 110.427 -177.283 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 39.7 t -63.09 -23.38 67.42 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.393 -0.817 . . . . 0.0 110.8 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -117.14 -18.87 9.9 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.447 -0.783 . . . . 0.0 111.122 -179.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.701 ' HB3' HD23 ' A' ' 34' ' ' LEU . 52.0 m80 -123.25 96.1 44.74 Favored Pre-proline 0 N--CA 1.496 1.85 0 O-C-N 121.374 -0.829 . . . . 0.0 109.676 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -74.87 -36.73 2.49 Favored 'Trans proline' 0 C--N 1.316 -1.171 0 O-C-N 123.461 1.242 . . . . 0.0 110.303 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.403 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -74.37 -16.89 79.73 Favored Glycine 0 N--CA 1.49 2.261 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.701 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -59.74 80.17 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.529 -0.983 . . . . 0.0 111.335 -179.354 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.403 ' N ' ' O ' ' A' ' 33' ' ' GLY . 75.8 p -74.57 173.0 11.01 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.311 -0.868 . . . . 0.0 109.521 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 40.4 mm -52.13 -30.39 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.173 0 O-C-N 121.322 -0.862 . . . . 0.0 110.399 -179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.22 -68.81 1.5 Allowed Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.338 -1.505 . . . . 0.0 109.338 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.428 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 0.4 OUTLIER -67.82 -28.59 67.7 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.686 -0.891 . . . . 0.0 110.655 179.745 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 78.4 m -66.45 -29.75 69.95 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.297 -0.877 . . . . 0.0 110.014 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.53 -46.09 34.21 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.592 -0.692 . . . . 0.0 109.87 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -83.86 -13.01 54.69 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.621 -0.674 . . . . 0.0 111.774 -179.446 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.428 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 3.7 tppt? -77.46 -59.58 2.72 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 120.986 -1.071 . . . . 0.0 109.825 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.508 HD22 ' HG3' ' A' ' 24' ' ' ARG . 1.2 mp -53.33 -28.88 30.88 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.419 -0.801 . . . . 0.0 110.578 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -71.24 -44.57 52.57 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.114 -1.595 . . . . 0.0 109.114 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -55.31 -33.63 63.47 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.605 -0.938 . . . . 0.0 110.532 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 65.5 mmm -76.81 -49.62 15.4 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.634 -0.666 . . . . 0.0 109.564 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 70.1 t-105 -50.37 -53.02 32.24 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.563 -0.711 . . . . 0.0 110.964 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.4 t -62.74 -34.6 77.55 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.46 -0.775 . . . . 0.0 110.129 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -63.9 -39.72 94.83 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.558 -0.714 . . . . 0.0 110.141 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -57.54 157.52 6.84 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.602 -0.686 . . . . 0.0 110.594 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 17.5 t -88.51 -148.91 0.17 Allowed 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -89.31 47.58 1.5 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.154 -0.967 . . . . 0.0 110.257 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 40.7 mttp -126.94 -42.51 1.74 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.464 -0.772 . . . . 0.0 110.095 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -54.9 -26.64 37.17 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.42 -0.8 . . . . 0.0 110.926 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 40.9 tttm -107.29 26.85 9.68 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.43 -0.794 . . . . 0.0 110.963 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.432 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 3.9 mm-40 -99.91 -55.24 0.16 Allowed Pre-proline 0 N--CA 1.497 1.897 0 O-C-N 121.338 -0.851 . . . . 0.0 110.966 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.432 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.1 Cg_endo -83.37 -37.2 0.18 Allowed 'Trans proline' 0 C--N 1.322 -0.851 0 O-C-N 122.935 0.966 . . . . 0.0 110.692 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -80.51 4.9 16.79 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.523 -0.735 . . . . 0.0 111.579 -179.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.07 -19.98 18.33 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.178 -0.951 . . . . 0.0 110.567 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -77.48 -24.63 50.11 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.46 -0.775 . . . . 0.0 110.267 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.431 ' HD3' HD13 ' A' ' 18' ' ' LEU . 35.1 tttt -60.76 -41.52 95.64 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.482 -0.761 . . . . 0.0 109.863 179.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.1 -10.41 59.74 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.564 -0.71 . . . . 0.0 110.939 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -98.01 4.3 49.34 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.246 -0.908 . . . . 0.0 110.83 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.66 -40.7 5.67 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.126 -0.984 . . . . 0.0 109.787 179.569 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.746 HD11 ' HD2' ' A' ' 13' ' ' PRO . 3.4 pp -78.88 -0.16 29.64 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.831 -0.543 . . . . 0.0 110.737 179.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.0 ttpt -92.55 -21.06 20.32 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.243 -0.911 . . . . 0.0 109.871 179.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -83.29 -12.42 56.7 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.46 -0.775 . . . . 0.0 110.196 178.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -105.31 -30.39 9.67 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.327 -0.858 . . . . 0.0 109.347 178.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.67 ' O ' HG22 ' A' ' 73' ' ' ILE . 4.4 t80 -74.8 -53.59 8.88 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.716 -0.615 . . . . 0.0 109.577 179.435 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -56.44 -19.43 15.08 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.614 -0.679 . . . . 0.0 111.405 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.8 mttt -105.95 -29.0 10.24 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.262 -0.899 . . . . 0.0 110.802 -179.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -86.7 -39.57 15.9 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.466 -0.771 . . . . 0.0 111.099 -179.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.67 HG22 ' O ' ' A' ' 69' ' ' TYR . 6.6 tp -61.47 -21.01 24.17 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.378 -0.826 . . . . 0.0 110.919 -179.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.02 -37.0 83.26 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.345 -0.847 . . . . 0.0 109.988 179.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -94.04 -26.06 16.94 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.677 -0.64 . . . . 0.0 110.282 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -63.5 -29.3 70.59 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.45 -0.781 . . . . 0.0 110.157 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 38.7 mtt-85 -78.95 -75.88 0.22 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.573 -0.705 . . . . 0.0 110.133 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 53.97 46.84 24.73 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.356 -0.84 . . . . 0.0 110.74 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.6 ptmt . . . . . 0 N--CA 1.495 1.78 0 CA-C-O 118.0 -1.0 . . . . 0.0 110.355 179.991 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.9 ttt . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.006 0.432 . . . . 0.0 110.187 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 57.2 -84.38 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.692 -0.63 . . . . 0.0 110.954 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 39.8 tttt 54.08 40.88 32.08 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.033 -1.042 . . . . 0.0 110.61 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.5 mttp -166.26 -167.4 1.03 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.645 -0.66 . . . . 0.0 109.997 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -123.36 164.85 25.52 Favored Pre-proline 0 N--CA 1.493 1.717 0 O-C-N 121.503 -0.748 . . . . 0.0 110.375 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.37 -19.21 25.6 Favored 'Trans proline' 0 C--N 1.317 -1.124 0 O-C-N 123.538 1.283 . . . . 0.0 110.949 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 67.1 m-80 -79.85 -30.09 40.23 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.294 -0.879 . . . . 0.0 110.268 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -92.74 136.5 24.94 Favored Pre-proline 0 N--CA 1.493 1.716 0 O-C-N 121.572 -0.705 . . . . 0.0 110.052 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.416 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 50.0 Cg_endo -74.17 94.91 0.9 Allowed 'Trans proline' 0 C--N 1.319 -1.015 0 O-C-N 123.19 1.1 . . . . 0.0 110.578 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.02 -168.25 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.494 -0.754 . . . . 0.0 110.016 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -60.15 137.21 91.32 Favored Pre-proline 0 N--CA 1.498 1.936 0 O-C-N 121.447 -0.783 . . . . 0.0 110.208 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -76.5 136.21 17.21 Favored 'Trans proline' 0 C--N 1.318 -1.063 0 O-C-N 123.36 1.19 . . . . 0.0 109.808 179.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.661 ' CB ' HD21 ' A' ' 18' ' ' LEU . 49.4 Cg_endo -79.94 -169.84 0.88 Allowed 'Trans proline' 0 C--N 1.317 -1.107 0 O-C-N 123.28 1.147 . . . . 0.0 110.213 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.495 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 1.0 OUTLIER -163.22 61.33 0.18 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.491 -0.756 . . . . 0.0 110.773 -179.787 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.495 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 65.77 -78.88 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.166 -0.959 . . . . 0.0 110.64 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 14.1 t80 -46.02 -52.26 12.15 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.237 -0.915 . . . . 0.0 111.729 -179.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -57.42 -33.75 68.22 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.499 -0.75 . . . . 0.0 110.131 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.661 HD21 ' CB ' ' A' ' 13' ' ' PRO . 47.8 mt -70.48 -38.3 74.37 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.613 -0.679 . . . . 0.0 110.204 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.497 ' CE2' ' CE1' ' A' ' 23' ' ' TYR . 52.7 t80 -77.21 -54.91 5.91 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.688 -0.632 . . . . 0.0 110.478 -179.537 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -56.81 -53.06 62.13 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.572 -0.705 . . . . 0.0 110.505 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.7 t -59.49 -17.99 36.23 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.578 -0.702 . . . . 0.0 111.131 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -107.89 -11.73 15.3 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.25 -0.906 . . . . 0.0 111.663 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.497 ' CE1' ' CE2' ' A' ' 19' ' ' PHE . 2.5 m-85 -100.35 -33.9 10.2 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.065 -1.022 . . . . 0.0 110.869 -179.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.523 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 27.7 mtt180 -47.8 -51.7 44.44 Favored Pre-proline 0 N--CA 1.498 1.943 0 O-C-N 121.31 -0.869 . . . . 0.0 112.3 -179.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.567 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.3 Cg_endo -60.43 -26.23 82.26 Favored 'Trans proline' 0 N--CA 1.494 1.539 0 O-C-N 123.252 1.133 . . . . 0.0 110.343 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.2 tmtt? -70.31 -45.38 66.35 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 108.528 -0.915 . . . . 0.0 108.528 178.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 47.8 mm -58.83 -28.79 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 CA-C-O 121.173 0.511 . . . . 0.0 110.309 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.567 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.7 mmmm -73.27 -33.65 65.36 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.593 -0.692 . . . . 0.0 110.547 -177.247 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 13.1 t -67.69 -23.53 65.31 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.397 -0.814 . . . . 0.0 110.636 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -116.09 -14.42 11.18 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.414 -0.804 . . . . 0.0 111.247 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.671 ' HB3' HD23 ' A' ' 34' ' ' LEU . 44.4 m80 -130.62 94.7 28.54 Favored Pre-proline 0 N--CA 1.496 1.834 0 O-C-N 121.301 -0.874 . . . . 0.0 109.376 179.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -74.95 -38.72 1.49 Allowed 'Trans proline' 0 C--N 1.315 -1.192 0 O-C-N 123.465 1.245 . . . . 0.0 110.401 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.416 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -71.99 -22.57 78.74 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 109.864 -1.294 . . . . 0.0 109.864 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.671 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -52.07 86.79 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.627 -0.925 . . . . 0.0 111.775 -179.312 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.416 ' N ' ' O ' ' A' ' 33' ' ' GLY . 17.2 m -76.27 172.06 13.5 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.513 -0.742 . . . . 0.0 109.653 179.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 44.9 mm -56.87 -27.49 26.45 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.975 0 O-C-N 121.407 -0.808 . . . . 0.0 110.095 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.32 -63.78 4.72 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.412 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 17.7 t70 -74.07 -32.35 63.24 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.574 -0.956 . . . . 0.0 110.61 179.796 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.44 ' OG1' HD12 ' A' ' 34' ' ' LEU . 89.8 m -66.34 -33.86 76.68 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.304 -0.872 . . . . 0.0 110.162 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.1 -31.65 68.06 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.629 -0.669 . . . . 0.0 109.956 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -102.2 -8.05 21.65 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.604 -0.685 . . . . 0.0 111.543 -179.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.412 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.1 OUTLIER -87.38 3.64 46.19 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.001 -1.062 . . . . 0.0 110.203 179.062 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.8 mt -102.21 -33.87 9.47 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.023 -1.048 . . . . 0.0 109.493 179.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -68.48 -31.0 73.3 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.427 -1.469 . . . . 0.0 109.427 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -56.93 -45.8 82.49 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.501 -0.999 . . . . 0.0 110.241 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 25.8 mtt -77.25 -49.6 14.71 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.642 -0.661 . . . . 0.0 109.646 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 73.3 t-105 -54.93 -22.14 14.02 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.613 -0.679 . . . . 0.0 110.879 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 69.0 p -88.87 -35.26 16.65 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.322 -0.861 . . . . 0.0 109.885 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.13 -34.98 77.39 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.629 -0.669 . . . . 0.0 109.821 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 87.3 mm-40 -63.08 157.6 21.77 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.59 -0.694 . . . . 0.0 109.809 179.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.2 m -147.33 103.65 3.58 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.514 -0.741 . . . . 0.0 110.339 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 52.95 51.95 14.84 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.472 -0.768 . . . . 0.0 110.994 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.6 tppt? -150.77 -69.77 0.18 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.498 -0.751 . . . . 0.0 109.939 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -64.39 -36.31 83.74 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.353 -0.842 . . . . 0.0 110.437 -179.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -93.28 19.44 8.16 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.436 -0.79 . . . . 0.0 111.358 -179.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.402 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 4.3 mt-30 -92.23 -52.13 0.28 Allowed Pre-proline 0 N--CA 1.496 1.831 0 O-C-N 121.398 -0.814 . . . . 0.0 110.415 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.402 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 55.8 Cg_endo -83.23 -28.53 1.47 Allowed 'Trans proline' 0 C--N 1.319 -0.975 0 O-C-N 123.074 1.039 . . . . 0.0 110.275 179.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -84.28 1.83 42.98 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.543 -0.723 . . . . 0.0 111.649 -179.051 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.07 -24.65 16.23 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.082 -1.012 . . . . 0.0 110.704 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.5 pt20 -75.87 -21.42 57.21 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.413 -0.804 . . . . 0.0 110.217 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 20.0 tttp -59.93 -44.66 94.22 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.46 -0.775 . . . . 0.0 109.932 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.68 -10.41 59.33 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.532 -0.73 . . . . 0.0 110.511 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.09 5.38 37.97 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.235 -0.916 . . . . 0.0 110.383 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 19.9 mmmt -105.48 -33.13 8.23 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.246 -0.909 . . . . 0.0 109.334 179.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.7 mp -80.03 2.87 22.11 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.881 -0.512 . . . . 0.0 111.052 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -95.92 -26.0 15.76 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.081 -1.012 . . . . 0.0 110.009 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -84.88 -15.13 45.68 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.545 -0.722 . . . . 0.0 110.588 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -103.19 -28.83 11.68 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.38 -0.825 . . . . 0.0 109.715 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.453 ' O ' HG22 ' A' ' 73' ' ' ILE . 20.6 t80 -74.61 -53.47 9.3 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.752 -0.593 . . . . 0.0 109.868 179.653 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -68.78 -9.63 51.99 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.737 -0.602 . . . . 0.0 111.587 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 38.5 mttm -104.29 -31.81 9.39 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.143 -0.973 . . . . 0.0 110.779 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -93.99 -28.68 15.64 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.494 -0.754 . . . . 0.0 111.136 -179.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.453 HG22 ' O ' ' A' ' 69' ' ' TYR . 3.5 tp -69.42 -22.13 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 O-C-N 121.426 -0.796 . . . . 0.0 110.917 -179.392 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.28 -49.96 67.56 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.42 -0.8 . . . . 0.0 110.13 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -83.15 -19.54 36.45 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.599 -0.688 . . . . 0.0 110.591 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -67.87 -26.53 66.07 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.412 -0.805 . . . . 0.0 110.487 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -87.26 -80.23 0.26 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.471 -0.768 . . . . 0.0 110.377 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -172.26 48.36 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.324 -0.86 . . . . 0.0 110.126 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.0 mmtm . . . . . 0 N--CA 1.494 1.74 0 CA-C-O 117.969 -1.015 . . . . 0.0 110.311 -179.917 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.669 0 CA-C-O 121.175 0.512 . . . . 0.0 110.124 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.98 122.19 32.77 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.521 -0.737 . . . . 0.0 110.188 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 23.3 ttpt -170.69 155.77 4.97 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.526 -0.734 . . . . 0.0 110.143 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -169.41 -157.72 0.18 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.511 -0.743 . . . . 0.0 109.863 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -61.03 145.04 90.04 Favored Pre-proline 0 N--CA 1.495 1.811 0 O-C-N 121.598 -0.689 . . . . 0.0 110.274 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -74.7 -33.82 4.71 Favored 'Trans proline' 0 C--N 1.318 -1.056 0 O-C-N 123.353 1.186 . . . . 0.0 110.485 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 31.1 t30 -79.29 -20.23 48.54 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.644 -0.66 . . . . 0.0 110.797 -179.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -88.69 136.56 30.93 Favored Pre-proline 0 N--CA 1.494 1.749 0 O-C-N 121.332 -0.855 . . . . 0.0 109.751 179.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -73.1 99.74 1.14 Allowed 'Trans proline' 0 C--N 1.319 -0.984 0 O-C-N 123.111 1.058 . . . . 0.0 110.412 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.3 pttt -59.93 -163.65 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.615 -0.678 . . . . 0.0 110.363 -179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -64.3 141.05 98.09 Favored Pre-proline 0 N--CA 1.496 1.837 0 O-C-N 121.543 -0.723 . . . . 0.0 110.236 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -75.66 132.11 14.24 Favored 'Trans proline' 0 C--N 1.318 -1.063 0 O-C-N 123.26 1.137 . . . . 0.0 109.852 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.691 ' CB ' HD21 ' A' ' 18' ' ' LEU . 49.2 Cg_endo -81.23 -171.2 1.17 Allowed 'Trans proline' 0 C--N 1.317 -1.116 0 O-C-N 123.237 1.125 . . . . 0.0 110.352 -179.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.498 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 32.1 t -166.32 63.02 0.1 Allowed 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.524 -0.735 . . . . 0.0 110.582 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 65.75 -79.0 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.173 -0.954 . . . . 0.0 110.329 -179.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.5 ' CE2' ' CD1' ' A' ' 47' ' ' TRP . 2.8 t80 -47.56 -49.07 27.39 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.217 -0.927 . . . . 0.0 111.403 -179.421 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -58.01 -30.25 65.95 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.658 -0.651 . . . . 0.0 110.074 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.691 HD21 ' CB ' ' A' ' 13' ' ' PRO . 36.0 mt -79.04 -31.76 44.7 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.48 -0.763 . . . . 0.0 110.489 -179.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.5 ' CE1' ' CZ ' ' A' ' 23' ' ' TYR . 59.4 t80 -79.2 -55.04 5.39 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.518 -0.739 . . . . 0.0 110.669 -179.349 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.438 ' SG ' HD13 ' A' ' 43' ' ' LEU . 5.7 t -56.7 -54.63 43.98 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.406 -0.809 . . . . 0.0 110.581 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 84.2 p -55.88 -21.52 20.54 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.444 -0.785 . . . . 0.0 110.967 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 36.5 mm-40 -101.23 -24.87 14.17 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.398 -0.814 . . . . 0.0 110.828 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.5 ' CZ ' ' CE1' ' A' ' 19' ' ' PHE . 8.0 m-85 -95.58 11.83 31.79 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.43 -0.794 . . . . 0.0 111.456 -179.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.524 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 4.5 mtt180 -87.1 -45.13 0.53 Allowed Pre-proline 0 N--CA 1.488 1.454 0 O-C-N 121.173 -0.955 . . . . 0.0 112.263 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.598 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.0 Cg_endo -66.76 -16.93 51.67 Favored 'Trans proline' 0 N--CA 1.49 1.275 0 O-C-N 122.899 0.947 . . . . 0.0 110.449 -179.203 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.8 tmtt? -71.69 -48.74 45.37 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 178.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 26.9 mm -56.67 -33.38 40.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 CA-C-O 121.376 0.608 . . . . 0.0 110.315 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.598 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 4.6 mmmm -72.1 -38.42 69.35 Favored 'General case' 0 N--CA 1.497 1.92 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.337 -177.072 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.7 t -57.81 -26.29 61.77 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.401 -0.812 . . . . 0.0 110.693 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -114.92 -22.68 9.48 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.53 -0.731 . . . . 0.0 110.721 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.741 ' HB3' HD23 ' A' ' 34' ' ' LEU . 36.5 m80 -122.1 95.7 47.17 Favored Pre-proline 0 N--CA 1.496 1.86 0 O-C-N 121.393 -0.817 . . . . 0.0 109.649 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -75.29 -36.2 2.51 Favored 'Trans proline' 0 C--N 1.316 -1.155 0 O-C-N 123.418 1.22 . . . . 0.0 110.346 -179.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.403 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -75.5 -17.87 80.02 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 110.203 -1.159 . . . . 0.0 110.203 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.741 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -55.79 86.99 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.253 0 O-C-N 121.563 -0.963 . . . . 0.0 111.191 -179.469 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.403 ' N ' ' O ' ' A' ' 33' ' ' GLY . 40.6 t -72.44 171.57 12.04 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.581 -0.7 . . . . 0.0 110.011 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.7 mm -55.84 -28.99 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.072 0 O-C-N 121.411 -0.806 . . . . 0.0 110.125 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.91 -64.15 4.45 Favored Glycine 0 N--CA 1.493 2.471 0 N-CA-C 109.178 -1.569 . . . . 0.0 109.178 179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.593 ' HB3' HD13 ' A' ' 34' ' ' LEU . 13.7 t70 -72.19 -34.01 68.09 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.546 -0.973 . . . . 0.0 110.438 179.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 96.4 m -64.21 -33.15 75.15 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.338 -0.851 . . . . 0.0 110.151 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.01 -36.97 69.88 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.638 -0.664 . . . . 0.0 110.062 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -96.24 -9.56 30.09 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.581 -0.699 . . . . 0.0 111.888 -179.332 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -88.8 7.33 34.63 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 120.986 -1.072 . . . . 0.0 110.258 179.158 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.438 HD13 ' SG ' ' A' ' 20' ' ' CYS . 16.2 mt -105.6 -30.18 9.66 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.053 -1.029 . . . . 0.0 109.584 179.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.65 -28.83 73.53 Favored Glycine 0 N--CA 1.493 2.44 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -55.02 -44.16 74.33 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.437 -1.037 . . . . 0.0 110.556 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 34.5 mtm -82.31 -46.74 13.23 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.541 -0.725 . . . . 0.0 109.912 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . 0.5 ' CD1' ' CE2' ' A' ' 16' ' ' PHE . 74.6 t-105 -54.68 -22.03 12.53 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.628 -0.67 . . . . 0.0 111.06 -179.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 11.1 t -97.5 -33.16 11.47 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.359 -0.838 . . . . 0.0 110.216 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -62.73 -36.35 82.73 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.566 -0.709 . . . . 0.0 110.032 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 13.4 mm-40 -58.9 156.98 10.5 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.521 -0.737 . . . . 0.0 110.504 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.8 t -86.6 -148.43 0.13 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.671 -0.643 . . . . 0.0 109.369 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.67 49.26 1.77 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.201 -0.937 . . . . 0.0 110.335 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 17.3 mtmm -126.64 -40.19 1.94 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.523 -0.735 . . . . 0.0 110.29 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -55.79 -32.66 63.7 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.366 -0.834 . . . . 0.0 110.845 -179.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.5 tttm -103.24 26.28 8.5 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.41 -0.806 . . . . 0.0 110.931 -179.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.441 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 3.9 mt-30 -99.0 -55.0 0.18 Allowed Pre-proline 0 N--CA 1.495 1.823 0 O-C-N 121.288 -0.882 . . . . 0.0 110.655 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.441 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.0 Cg_endo -83.94 -35.15 0.23 Allowed 'Trans proline' 0 C--N 1.321 -0.912 0 O-C-N 122.918 0.957 . . . . 0.0 110.779 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -81.54 4.33 21.72 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.411 -0.806 . . . . 0.0 111.446 -179.302 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.408 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -96.71 -23.0 16.65 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.976 -1.077 . . . . 0.0 110.731 -179.806 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -75.61 -22.65 56.69 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.458 -0.777 . . . . 0.0 110.239 179.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 66.0 tttt -60.93 -41.67 96.64 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.426 -0.796 . . . . 0.0 109.93 179.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.78 -11.34 60.76 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.586 -0.696 . . . . 0.0 110.58 179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.68 6.13 36.29 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.327 -0.858 . . . . 0.0 110.503 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 24.7 mmtp -106.12 -33.85 7.73 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.216 -0.928 . . . . 0.0 109.281 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.1 mp -79.42 0.64 28.5 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.881 -0.512 . . . . 0.0 111.004 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 31.7 tttm -91.53 -26.03 18.96 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.171 -0.956 . . . . 0.0 109.839 179.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -85.06 -14.44 47.24 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.5 -0.75 . . . . 0.0 110.656 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 20.4 mtpt -102.92 -29.92 11.13 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.327 -0.858 . . . . 0.0 109.854 179.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.447 ' O ' HG22 ' A' ' 73' ' ' ILE . 21.0 t80 -75.1 -53.24 9.22 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.631 -0.668 . . . . 0.0 109.684 179.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -69.28 -9.02 51.3 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.639 -0.663 . . . . 0.0 111.47 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 43.8 mttm -109.02 -33.71 6.82 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.085 -1.009 . . . . 0.0 110.697 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -87.02 -33.95 19.39 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.418 -0.801 . . . . 0.0 111.003 -179.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.447 HG22 ' O ' ' A' ' 69' ' ' TYR . 3.2 tp -63.34 -19.95 25.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 O-C-N 121.433 -0.792 . . . . 0.0 110.909 -179.45 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.04 -48.16 66.41 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.311 -0.868 . . . . 0.0 109.838 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.3 -27.28 26.07 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.695 -0.628 . . . . 0.0 109.981 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.401 ' HB3' ' HA ' ' A' ' 73' ' ' ILE . 67.8 t80 -62.54 -29.43 70.56 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.608 -0.682 . . . . 0.0 110.102 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 46.3 mtp85 -73.93 -74.16 0.2 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.63 -0.669 . . . . 0.0 110.039 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 57.85 104.82 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.478 -0.764 . . . . 0.0 110.4 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.773 0 CA-C-O 118.052 -0.975 . . . . 0.0 110.246 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 32.6 ttm . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 121.089 0.471 . . . . 0.0 110.172 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.11 95.52 8.62 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.598 -0.689 . . . . 0.0 110.209 179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 11.5 ttmt -170.04 -159.67 0.21 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.542 -0.724 . . . . 0.0 110.133 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 45.6 mttm -147.13 -155.26 0.61 Allowed 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.583 -0.698 . . . . 0.0 109.854 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.38 148.69 98.66 Favored Pre-proline 0 N--CA 1.496 1.848 0 O-C-N 121.371 -0.831 . . . . 0.0 110.084 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -73.01 -40.83 1.57 Allowed 'Trans proline' 0 C--N 1.317 -1.093 0 O-C-N 123.402 1.211 . . . . 0.0 110.468 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -79.65 0.85 28.5 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.548 -0.72 . . . . 0.0 111.282 -179.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -93.36 130.31 36.03 Favored Pre-proline 0 N--CA 1.494 1.758 0 O-C-N 121.114 -0.991 . . . . 0.0 109.879 179.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -74.06 89.26 1.04 Allowed 'Trans proline' 0 C--N 1.319 -0.986 0 O-C-N 123.137 1.072 . . . . 0.0 110.406 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -103.86 33.28 3.49 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.513 -0.742 . . . . 0.0 110.399 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -169.63 100.75 0.47 Allowed Pre-proline 0 N--CA 1.495 1.797 0 O-C-N 121.795 -0.566 . . . . 0.0 110.584 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.42 ' HB3' ' CD2' ' A' ' 69' ' ' TYR . 46.6 Cg_endo -75.26 116.46 4.55 Favored 'Trans proline' 0 C--N 1.319 -1.018 0 O-C-N 123.305 1.161 . . . . 0.0 110.168 179.616 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.649 ' HB2' HD21 ' A' ' 18' ' ' LEU . 46.7 Cg_endo -81.5 163.82 19.06 Favored 'Trans proline' 0 C--N 1.317 -1.087 0 O-C-N 123.255 1.134 . . . . 0.0 110.38 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.504 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 24.7 t -164.98 62.44 0.13 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.582 -0.699 . . . . 0.0 110.518 -179.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.504 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 65.48 -78.1 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.167 -0.958 . . . . 0.0 110.048 -179.504 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -47.66 -50.11 25.62 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.347 -0.845 . . . . 0.0 111.435 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -58.42 -37.23 74.94 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.538 -0.726 . . . . 0.0 109.924 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.77 HD11 ' HB2' ' A' ' 62' ' ' ALA . 43.7 mt -67.95 -39.71 83.38 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.642 -0.661 . . . . 0.0 110.104 -179.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.497 ' CE2' ' CE1' ' A' ' 23' ' ' TYR . 37.9 t80 -72.69 -52.88 13.4 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.667 -0.645 . . . . 0.0 110.868 -179.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.57 ' SG ' HD13 ' A' ' 43' ' ' LEU . 23.3 t -57.57 -50.51 72.86 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.527 -0.733 . . . . 0.0 110.716 -179.638 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 94.4 p -60.19 -26.97 66.76 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.525 -0.734 . . . . 0.0 110.844 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -95.36 -23.84 17.0 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.407 -0.808 . . . . 0.0 111.372 -179.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.497 ' CE1' ' CE2' ' A' ' 19' ' ' PHE . 7.0 m-85 -91.53 -33.64 15.08 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.278 -0.889 . . . . 0.0 111.003 -179.308 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.523 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 17.9 mtt180 -48.5 -52.72 41.57 Favored Pre-proline 0 N--CA 1.498 1.938 0 O-C-N 121.313 -0.867 . . . . 0.0 112.138 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.573 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.2 Cg_endo -59.65 -28.36 87.18 Favored 'Trans proline' 0 N--CA 1.495 1.597 0 O-C-N 123.265 1.14 . . . . 0.0 110.134 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.67 -44.42 74.1 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 178.109 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.3 mm -59.63 -31.09 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.112 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.573 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.4 mmmm -72.78 -38.24 67.35 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 120.032 -0.667 . . . . 0.0 110.575 -177.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 20.9 t -57.7 -26.43 61.72 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.384 -0.822 . . . . 0.0 110.756 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -115.25 -22.85 9.21 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.519 -0.738 . . . . 0.0 110.822 -179.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.702 ' HB3' HD23 ' A' ' 34' ' ' LEU . 33.7 m80 -122.18 95.57 47.16 Favored Pre-proline 0 N--CA 1.496 1.87 0 O-C-N 121.452 -0.78 . . . . 0.0 109.635 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -75.13 -40.49 0.85 Allowed 'Trans proline' 0 C--N 1.315 -1.193 0 O-C-N 123.464 1.244 . . . . 0.0 110.189 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.405 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -70.21 -19.33 75.69 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.702 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -56.63 85.3 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.527 -0.984 . . . . 0.0 111.11 -179.509 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.405 ' N ' ' O ' ' A' ' 33' ' ' GLY . 66.3 m -73.4 174.45 8.14 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.432 -0.792 . . . . 0.0 109.836 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 41.3 mm -54.57 -33.22 26.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 O-C-N 121.393 -0.817 . . . . 0.0 110.238 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.05 -64.89 3.93 Favored Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.445 ' HB3' HD13 ' A' ' 34' ' ' LEU . 0.4 OUTLIER -69.1 -36.06 77.13 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.613 -0.934 . . . . 0.0 110.267 179.516 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.0 m -62.66 -30.7 71.57 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.356 -0.84 . . . . 0.0 110.209 179.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.22 -44.26 38.47 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.51 -0.743 . . . . 0.0 110.119 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.403 ' HG2' ' HA ' ' A' ' 38' ' ' ASP . 0.7 OUTLIER -86.65 -14.15 43.49 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.542 -0.724 . . . . 0.0 111.784 -179.158 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.3 OUTLIER -87.04 6.95 29.88 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.92 -1.113 . . . . 0.0 110.453 179.319 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.57 HD13 ' SG ' ' A' ' 20' ' ' CYS . 14.6 mt -103.89 -29.58 10.89 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.089 -1.007 . . . . 0.0 109.664 179.355 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -66.83 -29.41 74.63 Favored Glycine 0 N--CA 1.492 2.427 0 N-CA-C 109.449 -1.46 . . . . 0.0 109.449 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -52.4 -44.23 65.24 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.474 -1.015 . . . . 0.0 110.731 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 17.4 mtt -86.32 -42.12 13.98 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.631 -0.668 . . . . 0.0 109.873 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . 0.424 ' CH2' ' HG3' ' A' ' 55' ' ' LYS . 73.8 t-105 -55.21 -23.18 20.81 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.577 -0.702 . . . . 0.0 110.894 -179.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 38.1 t -94.55 -32.89 13.26 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.44 -0.788 . . . . 0.0 110.006 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -62.69 -37.08 85.04 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.589 -0.694 . . . . 0.0 109.677 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -63.22 156.4 25.48 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.669 -0.645 . . . . 0.0 109.903 179.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 15.2 m -104.94 -152.3 0.46 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.733 -0.604 . . . . 0.0 109.382 179.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -84.61 54.19 2.94 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.389 -0.819 . . . . 0.0 109.92 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 52.5 mttm -130.04 -51.56 1.12 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.466 -0.771 . . . . 0.0 110.251 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -75.21 -23.46 57.62 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.478 -0.764 . . . . 0.0 111.347 -179.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.424 ' HG3' ' CH2' ' A' ' 47' ' ' TRP . 3.5 mppt? -89.89 -40.23 12.54 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.239 -0.913 . . . . 0.0 110.911 -179.396 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.401 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 7.7 mm100 -43.72 -56.71 6.8 Favored Pre-proline 0 N--CA 1.508 2.437 0 O-C-N 121.585 -0.697 . . . . 0.0 112.497 -178.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.401 ' HD2' ' N ' ' A' ' 56' ' ' GLN . 45.6 Cg_endo -70.47 -35.77 10.02 Favored 'Trans proline' 0 C--N 1.316 -1.164 0 O-C-N 122.993 0.996 . . . . 0.0 110.194 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -76.04 -9.86 58.96 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.608 -0.682 . . . . 0.0 110.786 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -76.5 -58.47 3.26 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.218 -0.926 . . . . 0.0 110.005 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -48.81 -27.95 3.36 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.6 -0.688 . . . . 0.0 111.491 -179.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 41.5 tttt -58.35 -53.33 59.55 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.395 -0.815 . . . . 0.0 109.984 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.77 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -73.52 -9.92 59.18 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.581 -0.7 . . . . 0.0 110.436 179.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.92 -0.16 47.19 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.355 -0.841 . . . . 0.0 110.081 178.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 20.2 mmtt -105.49 -28.12 11.0 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.136 -0.977 . . . . 0.0 109.733 179.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.6 mp -88.24 -10.39 49.86 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.837 -0.54 . . . . 0.0 110.18 178.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 5.3 tppt? -80.55 -32.75 36.6 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.388 -0.82 . . . . 0.0 109.202 179.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -67.94 -60.23 2.66 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 120.071 -0.652 . . . . 0.0 109.401 179.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.0 mmmt -57.37 -24.78 57.41 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.604 -0.685 . . . . 0.0 110.598 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.578 ' O ' HG22 ' A' ' 73' ' ' ILE . 12.8 t80 -73.27 -66.58 0.67 Allowed 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.388 -0.82 . . . . 0.0 109.48 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -61.43 -16.23 44.8 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.848 -0.533 . . . . 0.0 111.38 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.8 ttmm -97.76 -24.19 15.57 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.176 -0.952 . . . . 0.0 111.231 -179.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -103.83 -30.1 10.58 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.398 -0.814 . . . . 0.0 110.862 -179.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.578 HG22 ' O ' ' A' ' 69' ' ' TYR . 7.7 tp -63.97 -27.45 42.84 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.839 0 O-C-N 121.368 -0.832 . . . . 0.0 110.313 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.15 -56.45 9.89 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.573 -0.705 . . . . 0.0 109.635 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.21 -24.37 66.6 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.688 -0.633 . . . . 0.0 109.931 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -67.67 -39.82 84.47 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.564 -0.71 . . . . 0.0 109.921 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 15.1 mtt180 -96.35 11.29 35.28 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.665 -0.647 . . . . 0.0 110.979 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 52.18 85.49 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.064 -1.023 . . . . 0.0 110.851 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.2 mmmt . . . . . 0 N--CA 1.494 1.752 0 CA-C-O 118.062 -0.97 . . . . 0.0 110.351 -179.993 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.5 tpt . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.143 0.497 . . . . 0.0 110.18 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 52.54 59.26 4.62 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.463 -0.773 . . . . 0.0 110.752 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 75.0 tttt -170.62 67.97 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.482 -0.762 . . . . 0.0 110.005 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.404 ' HE3' ' NH2' ' A' ' 11' ' ' ARG . 4.6 mttm -59.88 -76.93 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.592 -0.693 . . . . 0.0 110.523 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.778 ' HB2' ' HB3' ' A' ' 8' ' ' ALA . 3.9 m-20 -121.42 157.33 56.53 Favored Pre-proline 0 N--CA 1.494 1.733 0 O-C-N 121.467 -0.771 . . . . 0.0 110.783 -179.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -73.42 -15.79 24.79 Favored 'Trans proline' 0 N--CA 1.487 1.127 0 O-C-N 123.595 1.313 . . . . 0.0 111.269 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -113.54 -22.3 10.38 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.393 -0.817 . . . . 0.0 110.387 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.778 ' HB3' ' HB2' ' A' ' 5' ' ' ASP . . . -89.91 141.94 28.55 Favored Pre-proline 0 N--CA 1.494 1.773 0 O-C-N 121.466 -0.771 . . . . 0.0 110.099 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -74.76 126.19 9.96 Favored 'Trans proline' 0 C--N 1.318 -1.033 0 O-C-N 123.299 1.158 . . . . 0.0 110.419 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.97 -170.0 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.531 -0.731 . . . . 0.0 110.67 -179.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.404 ' NH2' ' HE3' ' A' ' 4' ' ' LYS . 1.0 OUTLIER -67.72 145.61 98.15 Favored Pre-proline 0 N--CA 1.497 1.884 0 O-C-N 121.498 -0.751 . . . . 0.0 110.437 -179.742 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -76.28 129.65 11.39 Favored 'Trans proline' 0 C--N 1.318 -1.027 0 O-C-N 123.393 1.207 . . . . 0.0 109.883 179.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.692 ' CB ' HD21 ' A' ' 18' ' ' LEU . 50.4 Cg_endo -81.8 -173.65 1.86 Allowed 'Trans proline' 0 C--N 1.317 -1.113 0 O-C-N 123.264 1.139 . . . . 0.0 110.428 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.523 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 60.6 p -161.7 59.64 0.26 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.567 -0.708 . . . . 0.0 110.516 -179.858 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.523 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 66.82 -76.88 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.083 -1.011 . . . . 0.0 110.169 -179.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.428 ' CE2' ' CD1' ' A' ' 47' ' ' TRP . 5.5 t80 -47.74 -49.88 26.97 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.298 -0.876 . . . . 0.0 111.348 -179.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -57.99 -35.98 71.98 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.643 -0.661 . . . . 0.0 109.982 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.692 HD21 ' CB ' ' A' ' 13' ' ' PRO . 41.6 mt -70.9 -36.85 72.9 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.532 -0.73 . . . . 0.0 110.265 -179.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.503 ' CZ ' ' CE2' ' A' ' 23' ' ' TYR . 50.8 t80 -76.15 -54.23 7.12 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.563 -0.71 . . . . 0.0 110.497 -179.412 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.46 ' SG ' HD13 ' A' ' 43' ' ' LEU . 48.8 t -58.03 -51.78 68.25 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.565 -0.709 . . . . 0.0 110.616 -179.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 72.2 p -57.84 -22.95 50.46 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.536 -0.728 . . . . 0.0 111.036 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.4 mm-40 -102.6 -24.98 13.73 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.354 -0.841 . . . . 0.0 111.446 -179.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.503 ' CE2' ' CZ ' ' A' ' 19' ' ' PHE . 10.4 m-85 -93.09 12.61 23.59 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.308 -0.87 . . . . 0.0 111.595 -179.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.532 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 3.6 mtp180 -85.76 -45.33 0.61 Allowed Pre-proline 0 N--CA 1.489 1.478 0 O-C-N 121.145 -0.972 . . . . 0.0 112.03 179.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.589 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 37.7 Cg_endo -65.83 -15.41 48.94 Favored 'Trans proline' 0 N--CA 1.49 1.318 0 O-C-N 122.883 0.938 . . . . 0.0 110.483 -179.13 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.5 tmtm? -73.4 -51.64 16.6 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 177.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 37.5 mm -52.61 -33.71 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.918 0 CA-C-O 121.465 0.65 . . . . 0.0 110.317 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.589 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.7 mmmm -72.18 -37.49 69.3 Favored 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.279 -177.243 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.9 t -59.13 -25.48 63.89 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.466 -0.771 . . . . 0.0 110.753 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -116.8 -23.37 8.13 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.421 -0.8 . . . . 0.0 110.873 -179.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.727 ' HB3' HD23 ' A' ' 34' ' ' LEU . 37.4 m80 -120.65 96.33 48.87 Favored Pre-proline 0 N--CA 1.496 1.87 0 O-C-N 121.403 -0.81 . . . . 0.0 109.574 -179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -75.32 -32.66 4.86 Favored 'Trans proline' 0 C--N 1.316 -1.16 0 O-C-N 123.465 1.245 . . . . 0.0 110.464 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -80.45 -13.44 81.7 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 110.388 -1.085 . . . . 0.0 110.388 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.727 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -60.83 83.19 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.178 0 O-C-N 121.381 -1.07 . . . . 0.0 110.987 -179.5 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 78.2 p -74.72 170.64 15.44 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.541 -0.724 . . . . 0.0 109.78 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.2 mm -52.6 -27.7 11.79 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.155 0 O-C-N 121.218 -0.926 . . . . 0.0 110.369 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -61.56 -71.67 0.77 Allowed Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.118 -1.593 . . . . 0.0 109.118 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.426 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 7.1 t70 -67.33 -25.01 65.8 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.642 -0.917 . . . . 0.0 110.623 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 64.5 m -71.64 -46.98 57.37 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.549 -0.719 . . . . 0.0 109.962 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -52.55 -41.79 63.85 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.545 -0.722 . . . . 0.0 110.069 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -86.03 -10.15 55.52 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.72 -0.613 . . . . 0.0 111.231 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.426 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -74.21 -59.48 2.71 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.004 -1.06 . . . . 0.0 109.449 179.236 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.46 HD13 ' SG ' ' A' ' 20' ' ' CYS . 14.5 mt -53.51 -27.74 27.31 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.806 -0.559 . . . . 0.0 110.899 -179.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -60.34 -45.44 96.15 Favored Glycine 0 N--CA 1.496 2.669 0 N-CA-C 109.614 -1.394 . . . . 0.0 109.614 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -62.32 -48.89 77.84 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.567 -0.96 . . . . 0.0 109.878 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 17.5 mmt -60.13 -24.5 64.75 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.588 -0.695 . . . . 0.0 110.551 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . 0.428 ' CD1' ' CE2' ' A' ' 16' ' ' PHE . 72.4 t-105 -79.71 -48.93 12.84 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.537 -0.727 . . . . 0.0 109.473 179.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.1 t -67.66 -26.96 66.46 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.64 -0.663 . . . . 0.0 110.007 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -68.22 -44.72 75.13 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.557 -0.714 . . . . 0.0 109.596 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 19.7 mm-40 -57.17 153.3 12.06 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.618 -0.676 . . . . 0.0 110.372 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.4 t -98.34 -152.47 0.4 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.649 -0.657 . . . . 0.0 109.533 179.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -88.01 49.55 1.82 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.38 -0.825 . . . . 0.0 110.082 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -127.48 -49.14 1.41 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.512 -0.743 . . . . 0.0 110.289 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -67.2 -27.4 67.23 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.461 -0.774 . . . . 0.0 110.74 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.3 tttt -81.43 -36.53 29.34 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.414 -0.804 . . . . 0.0 110.713 -179.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -43.83 -52.95 13.73 Favored Pre-proline 0 N--CA 1.507 2.386 0 O-C-N 121.507 -0.745 . . . . 0.0 112.324 -178.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -78.53 -37.19 0.73 Allowed 'Trans proline' 0 C--N 1.315 -1.206 0 O-C-N 123.172 1.09 . . . . 0.0 111.073 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.59 1.42 46.1 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.433 -0.792 . . . . 0.0 112.102 -178.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.469 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -97.69 -23.86 15.76 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.023 -1.048 . . . . 0.0 110.601 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -77.85 -22.56 49.72 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.442 -0.786 . . . . 0.0 110.29 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 65.4 tttt -61.32 -43.14 99.37 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.411 -0.806 . . . . 0.0 109.944 179.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -74.2 -10.84 60.01 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.619 -0.676 . . . . 0.0 110.658 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -86.08 3.06 44.17 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.299 -0.875 . . . . 0.0 110.451 179.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 36.7 mmtm -105.64 -31.61 8.84 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.181 -0.949 . . . . 0.0 109.741 179.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.5 mp -82.38 1.73 35.83 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.802 -0.561 . . . . 0.0 110.624 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 65.7 tttt -91.49 -28.46 17.59 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.205 -0.934 . . . . 0.0 109.629 179.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -87.07 -10.89 51.81 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.61 -0.681 . . . . 0.0 110.613 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 34.3 mmtt -103.73 -34.19 8.67 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.336 -0.853 . . . . 0.0 109.551 179.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.421 ' O ' HG22 ' A' ' 73' ' ' ILE . 24.8 t80 -73.78 -53.83 9.41 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.74 -0.6 . . . . 0.0 109.685 179.488 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -68.41 -12.31 60.96 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.7 -0.625 . . . . 0.0 111.219 -179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.83 -31.73 8.7 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.288 -0.882 . . . . 0.0 110.972 -179.471 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -91.22 -35.64 14.39 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.403 -0.811 . . . . 0.0 111.096 -179.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.421 HG22 ' O ' ' A' ' 69' ' ' TYR . 4.5 tp -53.66 -38.88 35.94 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 O-C-N 121.308 -0.87 . . . . 0.0 110.95 -179.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.514 ' HB1' ' HB3' ' A' ' 79' ' ' LYS . . . -56.59 -53.41 57.92 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.497 -0.752 . . . . 0.0 110.392 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.62 -32.44 73.92 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.594 -0.691 . . . . 0.0 109.646 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.691 ' CZ ' ' HB2' ' A' ' 8' ' ' ALA . 79.7 t80 -62.23 -41.99 98.91 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.698 -0.627 . . . . 0.0 110.1 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 11.1 mtp180 -82.78 -80.68 0.17 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.57 -0.706 . . . . 0.0 110.092 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -168.53 44.11 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.306 -0.871 . . . . 0.0 110.199 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.514 ' HB3' ' HB1' ' A' ' 74' ' ' ALA . 22.6 mtmt . . . . . 0 N--CA 1.493 1.701 0 CA-C-O 118.057 -0.973 . . . . 0.0 110.276 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.7 ttt . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 121.119 0.485 . . . . 0.0 110.2 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -98.3 84.46 3.24 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.52 -0.737 . . . . 0.0 110.253 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.8 ttpt -60.01 -48.79 80.24 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.558 -0.714 . . . . 0.0 110.289 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 35.2 mttp -60.01 -74.75 0.07 Allowed 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.597 -0.689 . . . . 0.0 110.4 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -167.35 158.76 10.24 Favored Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.457 -0.777 . . . . 0.0 110.353 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.98 -39.71 2.14 Favored 'Trans proline' 0 C--N 1.318 -1.048 0 O-C-N 123.359 1.189 . . . . 0.0 110.296 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 11.0 p30 -78.94 -7.58 58.14 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.61 -0.681 . . . . 0.0 111.108 -179.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -95.16 135.47 23.4 Favored Pre-proline 0 N--CA 1.494 1.725 0 O-C-N 121.23 -0.918 . . . . 0.0 109.44 179.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -72.3 102.41 1.37 Allowed 'Trans proline' 0 C--N 1.318 -1.05 0 O-C-N 123.189 1.1 . . . . 0.0 110.688 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.61 -161.03 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.638 -0.663 . . . . 0.0 109.974 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.33 140.96 93.13 Favored Pre-proline 0 N--CA 1.497 1.921 0 O-C-N 121.236 -0.915 . . . . 0.0 110.099 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -75.24 135.52 18.75 Favored 'Trans proline' 0 C--N 1.318 -1.077 0 O-C-N 123.314 1.165 . . . . 0.0 109.767 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.543 ' CB ' HD21 ' A' ' 18' ' ' LEU . 49.8 Cg_endo -80.04 -177.32 3.73 Favored 'Trans proline' 0 C--N 1.317 -1.092 0 O-C-N 123.285 1.15 . . . . 0.0 110.262 -179.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.532 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 23.2 t -159.36 59.5 0.4 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.418 -0.801 . . . . 0.0 110.47 -179.668 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.532 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 67.6 -75.53 0.06 Allowed 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.196 -0.94 . . . . 0.0 110.172 -179.508 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -48.49 -48.73 37.82 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.333 -0.855 . . . . 0.0 111.271 -179.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -59.66 -41.41 90.53 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.511 -0.743 . . . . 0.0 109.189 179.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.543 HD21 ' CB ' ' A' ' 13' ' ' PRO . 57.1 mt -62.05 -46.3 89.75 Favored 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 120.363 -0.535 . . . . 0.0 109.993 179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -64.31 -50.37 68.09 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.603 -0.686 . . . . 0.0 110.006 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.596 ' SG ' HD13 ' A' ' 43' ' ' LEU . 6.6 t -68.64 -19.01 64.4 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.59 -0.693 . . . . 0.0 110.28 179.289 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.7 t -76.95 -17.69 58.74 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.286 -0.884 . . . . 0.0 111.725 -178.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -128.58 -14.45 4.65 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.02 -1.05 . . . . 0.0 112.776 -178.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.4 ' HB3' ' CD2' ' A' ' 43' ' ' LEU . 12.4 m-85 -87.92 13.85 10.06 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 120.944 -1.097 . . . . 0.0 111.671 -179.19 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.641 ' HG2' HD11 ' A' ' 43' ' ' LEU . 11.2 mtp180 -87.53 -45.97 0.5 Allowed Pre-proline 0 N--CA 1.49 1.556 0 O-C-N 121.162 -0.961 . . . . 0.0 112.386 179.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.578 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.1 Cg_endo -65.92 -15.97 50.9 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 O-C-N 122.981 0.99 . . . . 0.0 110.663 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.9 tmtt? -73.28 -52.34 14.31 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 177.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 42.1 mm -52.53 -30.98 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 CA-C-O 121.36 0.6 . . . . 0.0 110.439 179.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.578 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 6.2 mmmm -73.11 -36.78 66.82 Favored 'General case' 0 N--CA 1.498 1.945 0 C-N-CA 120.111 -0.636 . . . . 0.0 110.334 -177.246 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.2 t -58.7 -25.26 62.69 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.429 -0.795 . . . . 0.0 110.679 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -118.26 -22.84 7.52 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.515 -0.741 . . . . 0.0 110.949 -179.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.72 ' HB3' HD23 ' A' ' 34' ' ' LEU . 34.4 m80 -121.11 96.54 48.34 Favored Pre-proline 0 N--CA 1.496 1.863 0 O-C-N 121.281 -0.887 . . . . 0.0 109.669 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -75.23 -35.58 2.91 Favored 'Trans proline' 0 C--N 1.315 -1.192 0 O-C-N 123.426 1.224 . . . . 0.0 110.513 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -77.78 -11.27 85.59 Favored Glycine 0 N--CA 1.492 2.409 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.72 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -64.44 80.91 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.209 -1.171 . . . . 0.0 110.55 -179.818 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.4 t -75.03 173.69 10.38 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.522 -0.737 . . . . 0.0 109.485 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 39.0 mm -51.08 -32.02 11.59 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.213 0 O-C-N 121.187 -0.946 . . . . 0.0 110.503 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.6 -74.4 0.37 Allowed Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.223 -1.551 . . . . 0.0 109.223 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.97 -23.24 67.33 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.657 -0.908 . . . . 0.0 110.85 179.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 38.9 m -72.24 -46.22 56.93 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.366 -0.834 . . . . 0.0 109.904 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -53.34 -49.48 67.01 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.416 -0.803 . . . . 0.0 110.073 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.97 -12.37 60.33 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.763 -0.586 . . . . 0.0 111.152 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.57 -57.93 3.66 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.154 -0.966 . . . . 0.0 109.631 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.641 HD11 ' HG2' ' A' ' 24' ' ' ARG . 22.2 mt -54.5 -34.6 61.94 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.725 -0.609 . . . . 0.0 111.064 -179.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -61.02 -49.68 75.86 Favored Glycine 0 N--CA 1.494 2.558 0 N-CA-C 109.974 -1.25 . . . . 0.0 109.974 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -53.69 -35.59 61.27 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.401 -1.058 . . . . 0.0 110.833 -179.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 20.2 mmt -69.1 -50.95 43.55 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.621 -0.674 . . . . 0.0 109.488 179.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 31.2 t-105 -51.37 -58.31 6.59 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.708 -0.62 . . . . 0.0 110.818 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 12.6 t -60.97 -34.57 74.97 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.517 -0.739 . . . . 0.0 110.382 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -58.48 -41.6 85.65 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.576 -0.702 . . . . 0.0 110.432 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 41.7 mm-40 -67.17 167.79 11.47 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.46 -0.775 . . . . 0.0 110.029 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.1 m -141.06 96.09 2.94 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.53 -0.731 . . . . 0.0 110.506 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 51.84 46.4 26.63 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.409 -0.807 . . . . 0.0 111.133 179.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 11.3 tmtt? -141.48 -63.03 0.46 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.538 -0.726 . . . . 0.0 110.254 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -61.89 -17.45 56.64 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.581 -0.699 . . . . 0.0 110.904 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 53.1 tttm -99.29 -32.38 11.22 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.238 -0.913 . . . . 0.0 110.765 -179.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.427 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 7.4 mt-30 -43.51 -56.72 6.54 Favored Pre-proline 0 N--CA 1.508 2.461 0 O-C-N 121.469 -0.769 . . . . 0.0 112.273 -178.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.427 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.4 Cg_endo -78.75 -35.14 1.11 Allowed 'Trans proline' 0 C--N 1.316 -1.18 0 O-C-N 123.059 1.031 . . . . 0.0 110.658 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -83.85 5.8 23.85 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.445 -0.784 . . . . 0.0 112.186 -178.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.528 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -101.35 -21.36 14.86 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 120.965 -1.084 . . . . 0.0 110.625 179.808 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -78.88 -23.55 44.77 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.422 -0.798 . . . . 0.0 110.277 179.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 48.3 tttm -62.91 -41.35 99.43 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.479 -0.763 . . . . 0.0 109.985 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.406 ' HB1' ' HA ' ' A' ' 14' ' ' SER . . . -71.12 -9.21 57.67 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.596 -0.69 . . . . 0.0 110.896 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -89.07 4.57 47.94 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.232 -0.917 . . . . 0.0 110.646 179.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -105.89 -32.61 8.27 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.128 -0.982 . . . . 0.0 109.611 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.9 mp -79.3 1.18 25.88 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.826 -0.546 . . . . 0.0 111.034 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 72.7 tttt -93.2 -23.37 18.57 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.161 -0.962 . . . . 0.0 109.957 179.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 15.5 mt-10 -85.24 -12.66 52.0 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.377 -0.827 . . . . 0.0 110.654 179.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -102.8 -31.24 10.4 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.327 -0.858 . . . . 0.0 109.52 179.474 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.487 ' O ' HG22 ' A' ' 73' ' ' ILE . 22.2 t80 -74.65 -55.08 6.27 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.799 -0.563 . . . . 0.0 109.671 179.532 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -66.3 -12.31 55.74 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.756 -0.59 . . . . 0.0 111.437 -179.433 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -103.68 -31.13 10.03 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.187 -0.945 . . . . 0.0 110.612 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -92.38 -31.12 15.45 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.445 -0.785 . . . . 0.0 110.955 -179.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.487 HG22 ' O ' ' A' ' 69' ' ' TYR . 2.6 tp -66.61 -20.21 26.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 121.361 -0.837 . . . . 0.0 110.839 -179.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.72 -47.66 71.63 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.293 -0.879 . . . . 0.0 109.847 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -82.78 -22.24 34.34 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.679 -0.638 . . . . 0.0 110.421 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 52.5 t80 -63.3 -36.6 84.22 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.447 -0.783 . . . . 0.0 110.097 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 36.3 mtt180 -95.73 17.43 15.05 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.528 -0.733 . . . . 0.0 110.778 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -93.47 46.3 1.19 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.254 -0.904 . . . . 0.0 110.189 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.8 ptmt . . . . . 0 N--CA 1.495 1.821 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.29 -179.988 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.4 tpp . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.053 0.454 . . . . 0.0 110.22 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.9 mttm -86.34 171.9 10.84 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.52 -0.738 . . . . 0.0 110.284 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -174.31 -36.1 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.496 -0.752 . . . . 0.0 110.57 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 20.8 mmtt -49.69 -71.62 0.06 Allowed 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.315 -0.865 . . . . 0.0 111.362 -179.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -172.29 154.95 3.36 Favored Pre-proline 0 N--CA 1.498 1.949 0 O-C-N 121.391 -0.818 . . . . 0.0 110.159 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -73.31 -31.91 8.76 Favored 'Trans proline' 0 C--N 1.318 -1.044 0 O-C-N 123.449 1.236 . . . . 0.0 110.28 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -79.11 -18.57 53.03 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.552 -0.718 . . . . 0.0 110.741 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -100.28 103.52 23.81 Favored Pre-proline 0 N--CA 1.495 1.776 0 O-C-N 121.394 -0.817 . . . . 0.0 109.658 179.486 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.415 ' O ' ' CD1' ' A' ' 69' ' ' TYR . 55.6 Cg_endo -76.83 53.43 4.11 Favored 'Trans proline' 0 N--CA 1.488 1.174 0 O-C-N 123.167 1.088 . . . . 0.0 111.515 -179.456 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.5 tptt -71.97 164.22 26.48 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.021 -1.05 . . . . 0.0 110.228 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 49.17 94.83 0.04 OUTLIER Pre-proline 0 N--CA 1.5 2.056 0 O-C-N 121.579 -0.701 . . . . 0.0 111.604 179.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -73.52 136.51 23.83 Favored 'Trans proline' 0 C--N 1.316 -1.176 0 O-C-N 123.431 1.227 . . . . 0.0 109.769 179.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.736 ' HB2' HD21 ' A' ' 18' ' ' LEU . 49.6 Cg_endo -79.96 167.89 19.63 Favored 'Trans proline' 0 C--N 1.316 -1.134 0 O-C-N 123.273 1.144 . . . . 0.0 110.362 -179.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.517 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 57.5 p -161.37 66.38 0.28 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.569 -0.707 . . . . 0.0 110.456 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 65.79 -77.5 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.166 -0.958 . . . . 0.0 110.015 -179.589 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -51.13 -42.63 60.86 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.246 -0.908 . . . . 0.0 110.924 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -63.99 -25.04 67.95 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.617 -0.677 . . . . 0.0 109.966 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.736 HD21 ' HB2' ' A' ' 13' ' ' PRO . 41.7 mt -84.6 -39.06 19.16 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.508 -0.745 . . . . 0.0 110.363 -179.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.501 ' CE2' ' CZ ' ' A' ' 23' ' ' TYR . 44.5 t80 -69.32 -50.44 46.52 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.578 -0.701 . . . . 0.0 110.464 -179.5 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 35.5 t -65.95 -33.46 75.86 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.541 -0.724 . . . . 0.0 110.083 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 29.4 t -82.16 1.17 37.51 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.513 -0.742 . . . . 0.0 111.599 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -133.96 1.9 3.33 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.975 -1.078 . . . . 0.0 111.881 -179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.501 ' CZ ' ' CE2' ' A' ' 19' ' ' PHE . 8.6 m-85 -110.88 -27.02 9.01 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 120.969 -1.082 . . . . 0.0 110.878 -179.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.523 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 18.5 mtp180 -49.14 -52.03 51.41 Favored Pre-proline 0 N--CA 1.497 1.916 0 O-C-N 121.326 -0.859 . . . . 0.0 112.252 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.571 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 35.7 Cg_endo -59.37 -29.11 89.34 Favored 'Trans proline' 0 N--CA 1.495 1.576 0 O-C-N 123.171 1.09 . . . . 0.0 110.28 -179.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.8 tmtm? -68.26 -43.75 77.13 Favored 'General case' 0 N--CA 1.493 1.675 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 178.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.1 mm -60.99 -30.27 47.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.177 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.571 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.1 mmmm -73.14 -38.2 66.35 Favored 'General case' 0 N--CA 1.497 1.881 0 C-N-CA 119.937 -0.705 . . . . 0.0 110.633 -177.113 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 13.8 t -56.94 -26.83 60.32 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.324 -0.86 . . . . 0.0 110.707 -179.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -114.86 -24.65 8.56 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.567 -0.708 . . . . 0.0 110.738 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.712 ' HB3' HD23 ' A' ' 34' ' ' LEU . 30.5 m80 -120.63 95.69 48.96 Favored Pre-proline 0 N--CA 1.497 1.897 0 O-C-N 121.464 -0.773 . . . . 0.0 109.649 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -75.06 -41.49 0.64 Allowed 'Trans proline' 0 C--N 1.315 -1.193 0 O-C-N 123.409 1.215 . . . . 0.0 110.19 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.416 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -69.07 -19.93 74.31 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 110.077 -1.209 . . . . 0.0 110.077 179.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.712 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -56.42 84.98 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.528 -0.983 . . . . 0.0 111.175 -179.397 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.416 ' N ' ' O ' ' A' ' 33' ' ' GLY . 71.9 p -73.27 175.81 6.52 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.452 -0.78 . . . . 0.0 109.657 179.732 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 43.5 mm -56.31 -32.64 35.8 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 O-C-N 121.395 -0.816 . . . . 0.0 110.128 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.7 -65.18 3.67 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.26 -1.536 . . . . 0.0 109.26 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.406 ' HB3' HD13 ' A' ' 34' ' ' LEU . 0.7 OUTLIER -68.37 -36.55 79.36 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.56 -0.965 . . . . 0.0 110.299 179.573 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 93.8 m -63.29 -29.93 71.16 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.448 -0.782 . . . . 0.0 110.063 179.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.75 -44.89 39.44 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.559 -0.713 . . . . 0.0 109.795 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -86.71 -11.78 50.19 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.606 -0.684 . . . . 0.0 111.892 -179.22 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.404 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 11.5 tptt -87.83 6.75 33.81 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 120.813 -1.18 . . . . 0.0 110.495 179.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.9 mt -101.08 -27.76 13.08 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.193 -0.942 . . . . 0.0 109.515 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -68.96 -28.25 73.19 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.168 -1.573 . . . . 0.0 109.168 179.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -57.5 -54.9 41.62 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.445 -1.032 . . . . 0.0 109.875 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 33.6 mtt -68.48 -52.33 33.53 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 120.125 -0.63 . . . . 0.0 109.398 179.203 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . 0.438 ' CH2' ' HG2' ' A' ' 55' ' ' LYS . 54.6 t-105 -50.77 -58.02 6.96 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.49 -0.756 . . . . 0.0 110.936 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 26.6 t -59.19 -34.2 71.85 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.435 -0.791 . . . . 0.0 110.39 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -61.73 -40.88 96.64 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.596 -0.69 . . . . 0.0 109.973 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 20.0 mm-40 -60.0 155.52 16.63 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.635 -0.666 . . . . 0.0 110.307 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.6 m -106.49 -152.12 0.47 Allowed 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.01 58.72 3.01 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.332 -0.855 . . . . 0.0 109.953 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 8.8 tttp -139.93 -52.6 0.52 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.401 -0.812 . . . . 0.0 110.211 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -62.45 -25.56 68.04 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.511 -0.743 . . . . 0.0 110.586 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.438 ' HG2' ' CH2' ' A' ' 47' ' ' TRP . 14.7 mtpt -81.57 -34.47 31.02 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.404 -0.81 . . . . 0.0 110.607 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -44.64 -52.53 17.68 Favored Pre-proline 0 N--CA 1.507 2.387 0 O-C-N 121.572 -0.705 . . . . 0.0 111.986 -179.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -78.71 -38.22 0.53 Allowed 'Trans proline' 0 C--N 1.315 -1.227 0 O-C-N 123.263 1.138 . . . . 0.0 110.85 179.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.1 5.0 23.97 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.51 -0.744 . . . . 0.0 112.055 -178.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.44 -23.07 15.25 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.053 -1.029 . . . . 0.0 110.363 179.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -77.48 -26.22 51.11 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.474 -0.766 . . . . 0.0 110.214 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 72.8 tttt -59.57 -42.26 92.04 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.538 -0.726 . . . . 0.0 110.115 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.408 ' HB1' ' O ' ' A' ' 13' ' ' PRO . . . -69.48 -11.09 60.54 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.573 -0.705 . . . . 0.0 110.63 179.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.66 4.94 34.17 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.195 -0.941 . . . . 0.0 110.537 179.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 40.4 mmtt -105.82 -34.79 7.55 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.198 -0.939 . . . . 0.0 109.309 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.674 HD22 ' HG3' ' A' ' 13' ' ' PRO . 7.6 mp -82.36 -2.34 52.62 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.828 -0.545 . . . . 0.0 110.362 178.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 30.0 tptt -83.3 -33.94 25.83 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.27 -0.894 . . . . 0.0 109.112 179.166 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -67.7 -61.73 1.75 Allowed 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.168 179.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -58.87 -18.54 33.75 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.736 -0.602 . . . . 0.0 111.067 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.415 ' CD1' ' O ' ' A' ' 9' ' ' PRO . 9.5 t80 -78.49 -60.38 2.4 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.229 -0.919 . . . . 0.0 109.494 179.465 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -76.71 -1.04 25.89 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.599 -0.688 . . . . 0.0 111.561 -179.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.7 ttmt -113.0 -37.61 4.75 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.995 -1.066 . . . . 0.0 111.228 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -86.93 -31.19 20.82 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.417 -0.802 . . . . 0.0 111.284 -179.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.409 HG22 ' O ' ' A' ' 69' ' ' TYR . 3.0 tp -65.25 -17.33 21.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.434 -0.791 . . . . 0.0 111.129 -179.373 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.58 -48.28 64.61 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.344 -0.847 . . . . 0.0 109.87 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -88.21 -24.75 23.19 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.668 -0.645 . . . . 0.0 110.144 179.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.406 ' HB3' ' HA ' ' A' ' 73' ' ' ILE . 48.6 t80 -61.87 -31.39 71.66 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.504 -0.747 . . . . 0.0 110.275 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 29.7 mtt180 -71.26 -73.82 0.17 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.543 -0.723 . . . . 0.0 110.123 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 57.23 103.87 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.435 -0.791 . . . . 0.0 110.505 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 20.1 mttt . . . . . 0 N--CA 1.493 1.678 0 CA-C-O 118.067 -0.968 . . . . 0.0 110.212 179.939 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.9 ttp . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.086 0.469 . . . . 0.0 110.191 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.11 145.19 30.87 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.608 -0.683 . . . . 0.0 110.181 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -169.93 -65.31 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.528 -0.733 . . . . 0.0 110.125 179.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 16.6 mmmt -68.0 -74.97 0.11 Allowed 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.556 -0.715 . . . . 0.0 110.18 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.426 ' HB2' ' HB3' ' A' ' 8' ' ' ALA . 5.9 m-20 -156.15 126.97 3.51 Favored Pre-proline 0 N--CA 1.493 1.711 0 O-C-N 121.552 -0.718 . . . . 0.0 109.986 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -72.43 -37.53 4.22 Favored 'Trans proline' 0 N--CA 1.486 1.06 0 O-C-N 123.127 1.067 . . . . 0.0 110.388 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -80.03 -6.47 57.66 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.618 -0.676 . . . . 0.0 111.172 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.426 ' HB3' ' HB2' ' A' ' 5' ' ' ASP . . . -103.51 136.05 19.28 Favored Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.106 -0.996 . . . . 0.0 110.205 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.404 ' O ' ' CD1' ' A' ' 69' ' ' TYR . 49.2 Cg_endo -77.07 89.1 1.34 Allowed 'Trans proline' 0 C--N 1.319 -0.986 0 O-C-N 123.191 1.101 . . . . 0.0 110.268 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 1.1 pttp -99.66 30.59 3.56 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.479 -0.763 . . . . 0.0 110.853 -179.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.53 100.57 0.43 Allowed Pre-proline 0 N--CA 1.497 1.896 0 O-C-N 121.7 -0.625 . . . . 0.0 110.811 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -76.26 118.69 5.03 Favored 'Trans proline' 0 C--N 1.319 -1.02 0 O-C-N 123.263 1.138 . . . . 0.0 110.1 179.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.701 ' HB2' HD21 ' A' ' 18' ' ' LEU . 48.3 Cg_endo -81.93 166.41 16.95 Favored 'Trans proline' 0 C--N 1.318 -1.077 0 O-C-N 123.236 1.124 . . . . 0.0 110.446 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.535 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 32.4 t -156.69 54.78 0.54 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.466 -0.771 . . . . 0.0 110.582 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.535 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 67.99 -76.23 0.06 Allowed 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.256 -0.902 . . . . 0.0 109.965 -179.527 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -48.81 -49.91 36.84 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.357 -0.839 . . . . 0.0 111.378 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.03 -40.73 81.62 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.541 -0.724 . . . . 0.0 109.629 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.701 HD21 ' HB2' ' A' ' 13' ' ' PRO . 59.9 mt -60.52 -48.07 83.37 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.695 -0.628 . . . . 0.0 110.159 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.409 ' CZ ' ' CE1' ' A' ' 23' ' ' TYR . 60.6 t80 -66.88 -50.19 63.27 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.674 -0.641 . . . . 0.0 110.443 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.462 ' SG ' HD13 ' A' ' 43' ' ' LEU . 1.5 m -64.07 -31.93 73.3 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.507 -0.746 . . . . 0.0 109.966 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.0 m -65.48 -22.9 66.79 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.636 -0.665 . . . . 0.0 110.768 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -107.2 -25.71 11.4 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.405 -0.809 . . . . 0.0 111.55 -179.148 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.409 ' CE1' ' CZ ' ' A' ' 19' ' ' PHE . 0.6 OUTLIER -83.21 -34.75 25.83 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.13 -0.981 . . . . 0.0 110.928 -179.133 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.514 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 35.5 mtt180 -48.43 -53.18 37.25 Favored Pre-proline 0 N--CA 1.498 1.925 0 O-C-N 121.275 -0.89 . . . . 0.0 112.022 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.528 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.4 Cg_endo -59.93 -27.09 84.16 Favored 'Trans proline' 0 N--CA 1.494 1.535 0 O-C-N 123.169 1.089 . . . . 0.0 110.182 179.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.4 tmtt? -69.55 -44.83 70.12 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.1 mm -59.08 -35.0 54.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 CA-C-O 121.084 0.468 . . . . 0.0 110.094 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.544 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 4.8 mmmm -70.15 -39.92 75.08 Favored 'General case' 0 N--CA 1.497 1.908 0 C-N-CA 120.09 -0.644 . . . . 0.0 110.43 -177.173 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.9 t -57.67 -25.64 60.54 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.348 -0.845 . . . . 0.0 110.891 -179.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -114.0 -23.62 9.47 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.508 -0.745 . . . . 0.0 110.654 -179.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.711 ' HB3' HD23 ' A' ' 34' ' ' LEU . 43.6 m80 -120.7 96.06 48.87 Favored Pre-proline 0 N--CA 1.495 1.784 0 O-C-N 121.414 -0.804 . . . . 0.0 109.482 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -74.96 -36.25 2.7 Favored 'Trans proline' 0 C--N 1.316 -1.161 0 O-C-N 123.462 1.243 . . . . 0.0 110.351 -179.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.4 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -75.3 -16.73 80.44 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 110.174 -1.17 . . . . 0.0 110.174 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.711 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -57.86 83.88 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.486 -1.008 . . . . 0.0 111.255 -179.323 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 33' ' ' GLY . 19.9 m -75.71 172.89 11.86 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.502 -0.749 . . . . 0.0 109.758 179.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.413 ' O ' ' HB2' ' A' ' 40' ' ' ALA . 42.5 mm -54.6 -28.36 19.17 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.113 0 O-C-N 121.34 -0.85 . . . . 0.0 110.228 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.18 -70.67 0.94 Allowed Glycine 0 N--CA 1.492 2.398 0 N-CA-C 109.146 -1.582 . . . . 0.0 109.146 179.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.408 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 10.7 t0 -67.49 -31.99 72.5 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.672 -0.899 . . . . 0.0 110.388 179.569 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.409 ' O ' HD12 ' A' ' 43' ' ' LEU . 78.2 m -65.78 -29.93 70.5 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.457 -0.777 . . . . 0.0 109.913 179.42 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.413 ' HB2' ' O ' ' A' ' 36' ' ' ILE . . . -73.16 -44.32 60.19 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.638 -0.664 . . . . 0.0 109.566 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -86.92 -13.39 44.89 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.646 -0.659 . . . . 0.0 111.78 -179.36 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.408 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 9.0 tptt -86.23 6.54 29.05 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 120.941 -1.1 . . . . 0.0 110.696 179.452 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.462 HD13 ' SG ' ' A' ' 20' ' ' CYS . 11.8 mt -102.1 -28.58 12.25 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.107 -0.996 . . . . 0.0 109.495 179.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -70.4 -29.7 69.8 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.092 -1.603 . . . . 0.0 109.092 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -55.41 -49.83 71.36 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.475 -1.014 . . . . 0.0 110.22 179.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 31.3 mmt -73.75 -49.72 24.13 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.663 -0.648 . . . . 0.0 109.643 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 62.2 t-105 -51.71 -59.27 4.49 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.479 -0.763 . . . . 0.0 110.847 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.0 t -61.52 -33.39 73.72 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.479 -0.763 . . . . 0.0 110.274 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -59.58 -39.74 85.11 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.54 -0.725 . . . . 0.0 110.284 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -63.48 162.37 12.76 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.579 -0.701 . . . . 0.0 110.297 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 81.1 p -96.18 -147.37 0.29 Allowed 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -85.72 51.85 2.31 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.152 -0.968 . . . . 0.0 110.095 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 9.8 tptp -125.23 -42.82 1.97 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.42 -0.8 . . . . 0.0 110.121 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -62.34 -37.07 84.23 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.563 -0.71 . . . . 0.0 110.728 -179.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 22.0 tttp -91.03 19.9 5.33 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.375 -0.828 . . . . 0.0 111.348 -179.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.463 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 0.7 OUTLIER -94.25 -57.21 0.22 Allowed Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.012 -1.055 . . . . 0.0 110.341 179.888 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.463 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 57.0 Cg_endo -83.28 -31.26 0.68 Allowed 'Trans proline' 0 N--CA 1.484 0.95 0 O-C-N 122.998 0.999 . . . . 0.0 110.577 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 44.3 m-85 -82.33 2.02 34.2 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.49 -0.757 . . . . 0.0 112.004 -178.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.441 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -96.72 -21.92 17.29 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.035 -1.041 . . . . 0.0 110.736 -179.916 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -82.36 -24.64 34.39 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.425 -0.797 . . . . 0.0 110.201 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 71.0 tttt -62.89 -45.0 94.6 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.514 -0.741 . . . . 0.0 109.846 179.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.469 ' HB2' ' H ' ' A' ' 15' ' ' ALA . . . -74.27 -10.24 59.4 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.623 -0.673 . . . . 0.0 110.835 179.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.87 0.65 52.53 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.256 -0.902 . . . . 0.0 110.372 179.163 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.79 -30.43 9.41 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.225 -0.922 . . . . 0.0 109.92 179.494 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.469 HD12 ' N ' ' A' ' 65' ' ' LEU . 6.5 mp -83.22 -7.16 59.65 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.89 -0.506 . . . . 0.0 110.401 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.7 ttpt -81.34 -27.33 34.98 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.272 -0.892 . . . . 0.0 109.457 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -85.22 -6.29 59.28 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.674 -0.641 . . . . 0.0 110.363 179.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 36.6 mmtm -105.38 -35.24 7.57 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.367 -0.833 . . . . 0.0 108.888 178.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.703 ' O ' HG22 ' A' ' 73' ' ' ILE . 35.8 t80 -75.5 -57.2 4.03 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 179.392 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -57.69 -19.73 29.08 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.665 -0.647 . . . . 0.0 111.218 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 33.2 mmtm -102.75 -24.62 13.71 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.32 -0.863 . . . . 0.0 111.287 -179.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -98.79 -36.53 9.78 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.33 -0.856 . . . . 0.0 111.314 -179.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.703 HG22 ' O ' ' A' ' 69' ' ' TYR . 4.7 tp -70.53 -26.61 28.99 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 O-C-N 121.304 -0.873 . . . . 0.0 110.616 -179.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.19 -45.07 96.09 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.455 -0.778 . . . . 0.0 109.992 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.98 -16.98 36.61 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.709 -0.62 . . . . 0.0 110.615 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -81.44 -32.04 32.83 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.318 -0.864 . . . . 0.0 110.196 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 29.5 mtt180 -100.73 1.38 40.35 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.624 -0.672 . . . . 0.0 111.176 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -71.27 77.17 0.73 Allowed 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.162 -0.961 . . . . 0.0 110.161 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.8 mptt . . . . . 0 N--CA 1.496 1.85 0 CA-C-O 117.955 -1.021 . . . . 0.0 110.165 179.977 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 34.8 ttm . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 121.086 0.469 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.9 mttm -103.36 170.77 7.75 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.565 -0.71 . . . . 0.0 110.307 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -170.05 64.03 0.05 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.592 -0.692 . . . . 0.0 110.083 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 16.3 pttm -85.71 -168.01 2.06 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.541 -0.724 . . . . 0.0 110.128 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.405 ' HB2' ' CB ' ' A' ' 8' ' ' ALA . 0.8 OUTLIER -48.54 149.56 2.84 Favored Pre-proline 0 N--CA 1.501 2.116 0 O-C-N 121.622 -0.674 . . . . 0.0 111.259 -179.9 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -75.92 -30.25 6.08 Favored 'Trans proline' 0 C--N 1.319 -1.017 0 O-C-N 123.465 1.245 . . . . 0.0 111.139 -179.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -114.85 24.71 11.53 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.281 -0.887 . . . . 0.0 111.057 -179.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.405 ' CB ' ' HB2' ' A' ' 5' ' ' ASP . . . -105.7 90.8 4.5 Favored Pre-proline 0 N--CA 1.496 1.833 0 O-C-N 121.427 -0.796 . . . . 0.0 110.095 179.527 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -72.03 81.67 1.38 Allowed 'Trans proline' 0 C--N 1.316 -1.148 0 O-C-N 123.205 1.108 . . . . 0.0 110.543 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.1 tptt -60.93 -157.39 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.651 -0.656 . . . . 0.0 110.143 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -49.47 140.22 13.94 Favored Pre-proline 0 N--CA 1.502 2.169 0 O-C-N 121.269 -0.895 . . . . 0.0 111.227 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.407 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.0 Cg_endo -76.83 128.69 10.23 Favored 'Trans proline' 0 C--N 1.318 -1.032 0 O-C-N 123.276 1.145 . . . . 0.0 110.263 -179.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.472 ' HB2' HD21 ' A' ' 18' ' ' LEU . 50.4 Cg_endo -82.18 179.46 5.51 Favored 'Trans proline' 0 C--N 1.319 -1.022 0 O-C-N 123.212 1.111 . . . . 0.0 110.23 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.537 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -163.17 65.3 0.18 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.554 -0.716 . . . . 0.0 110.257 -179.861 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.537 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 67.02 -76.63 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.185 0 O-C-N 121.183 -0.948 . . . . 0.0 109.938 -179.36 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.415 ' CD2' ' CD1' ' A' ' 47' ' ' TRP . 6.6 t80 -51.78 -43.22 62.93 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.249 -0.907 . . . . 0.0 111.022 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -63.77 -30.25 71.37 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.612 -0.68 . . . . 0.0 109.386 179.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.472 HD21 ' HB2' ' A' ' 13' ' ' PRO . 58.2 mt -75.28 -43.97 48.3 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.589 -0.695 . . . . 0.0 110.037 -179.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -65.56 -48.28 72.96 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.627 -0.671 . . . . 0.0 110.077 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 12.0 t -65.93 -29.5 69.93 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.564 -0.71 . . . . 0.0 109.771 179.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.5 t -90.52 7.12 40.6 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.578 -0.701 . . . . 0.0 111.653 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -138.79 0.75 2.03 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 120.973 -1.08 . . . . 0.0 112.11 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -123.58 22.08 9.2 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 120.872 -1.142 . . . . 0.0 110.905 -179.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.514 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 8.6 mtt180 -85.47 -45.98 0.63 Allowed Pre-proline 0 N--CA 1.488 1.439 0 O-C-N 121.447 -0.783 . . . . 0.0 112.064 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.561 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.3 Cg_endo -66.57 -15.44 47.67 Favored 'Trans proline' 0 N--CA 1.491 1.341 0 O-C-N 122.853 0.922 . . . . 0.0 110.613 -179.286 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? -73.39 -50.84 19.75 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 178.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 30.1 mm -54.51 -33.52 26.86 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.942 0 CA-C-O 121.298 0.57 . . . . 0.0 110.263 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.561 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.2 mmmm -71.27 -37.12 71.92 Favored 'General case' 0 N--CA 1.498 1.953 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.147 -177.26 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 24.8 t -58.6 -25.61 62.79 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.422 -0.799 . . . . 0.0 110.637 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -115.29 -24.22 8.55 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.55 -0.719 . . . . 0.0 110.618 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.783 ' HB3' HD23 ' A' ' 34' ' ' LEU . 41.2 m80 -119.63 96.56 49.72 Favored Pre-proline 0 N--CA 1.496 1.864 0 O-C-N 121.45 -0.781 . . . . 0.0 109.568 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -75.37 -28.42 8.6 Favored 'Trans proline' 0 C--N 1.315 -1.233 0 O-C-N 123.4 1.211 . . . . 0.0 110.502 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -84.44 -13.55 73.15 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.783 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -60.39 82.36 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.356 -1.085 . . . . 0.0 111.019 -179.441 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.1 t -69.74 170.19 11.43 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.487 -0.758 . . . . 0.0 109.977 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 38.6 mm -52.7 -30.08 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.262 -0.899 . . . . 0.0 110.264 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.0 -65.88 3.1 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.33 -1.508 . . . . 0.0 109.33 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.715 ' HB3' HD13 ' A' ' 34' ' ' LEU . 3.4 t70 -69.55 -30.49 68.3 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.617 -0.931 . . . . 0.0 110.591 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.2 m -63.76 -29.32 70.54 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.331 -0.856 . . . . 0.0 110.249 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.41 -44.8 27.9 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.576 -0.702 . . . . 0.0 110.169 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -86.02 -13.28 47.95 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.554 -0.716 . . . . 0.0 111.669 -179.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.9 tptt -76.88 -59.69 2.67 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.055 -1.028 . . . . 0.0 109.718 179.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 45.1 mt -48.67 -25.12 1.62 Allowed 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.474 -0.766 . . . . 0.0 111.458 -179.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -71.08 -36.98 64.14 Favored Glycine 0 N--CA 1.492 2.403 0 N-CA-C 109.051 -1.62 . . . . 0.0 109.051 179.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -53.86 -38.18 64.42 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.577 -0.955 . . . . 0.0 110.746 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 28.3 mtp -76.41 -49.69 16.09 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.599 -0.688 . . . . 0.0 109.861 179.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . 0.415 ' CD1' ' CD2' ' A' ' 16' ' ' PHE . 57.6 t-105 -49.99 -53.39 26.86 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.527 -0.733 . . . . 0.0 111.067 -179.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.3 t -59.34 -36.14 75.14 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.447 -0.783 . . . . 0.0 110.459 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -62.29 -39.29 92.46 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.612 -0.68 . . . . 0.0 110.046 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -57.52 154.21 11.56 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.546 -0.721 . . . . 0.0 110.539 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.1 m -102.01 -151.55 0.42 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.694 -0.629 . . . . 0.0 109.457 179.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.06 52.48 2.53 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.306 -0.871 . . . . 0.0 110.124 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -132.54 -51.75 0.93 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.408 -0.808 . . . . 0.0 110.034 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -64.95 -25.0 67.69 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.687 -0.633 . . . . 0.0 110.47 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 37.7 tttp -81.09 -35.33 31.8 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.524 -0.735 . . . . 0.0 110.534 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -44.23 -52.75 15.57 Favored Pre-proline 0 N--CA 1.507 2.391 0 O-C-N 121.498 -0.751 . . . . 0.0 112.048 -179.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -78.41 -37.42 0.72 Allowed 'Trans proline' 0 C--N 1.315 -1.189 0 O-C-N 123.232 1.122 . . . . 0.0 111.045 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -84.85 4.67 32.11 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.344 -0.847 . . . . 0.0 112.146 -178.433 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -101.02 -24.15 14.38 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.002 -1.061 . . . . 0.0 110.552 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -75.28 -23.32 57.4 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.446 -0.784 . . . . 0.0 110.284 179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 66.7 tttt -60.42 -41.66 94.39 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.561 -0.712 . . . . 0.0 110.145 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -73.41 -11.51 60.49 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.494 -0.754 . . . . 0.0 110.569 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -83.69 2.62 36.83 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.222 -0.923 . . . . 0.0 110.383 179.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 26.6 mmtm -105.33 -32.12 8.74 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.196 -0.94 . . . . 0.0 109.742 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.423 ' N ' HD12 ' A' ' 65' ' ' LEU . 6.2 mp -83.57 1.73 40.67 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.832 -0.543 . . . . 0.0 110.685 179.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 74.4 tttt -92.28 -32.02 15.18 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.232 -0.918 . . . . 0.0 109.508 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -83.53 -12.8 55.75 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.658 -0.651 . . . . 0.0 110.56 179.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -105.07 -28.19 11.18 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.318 -0.864 . . . . 0.0 109.464 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.53 ' O ' HG22 ' A' ' 73' ' ' ILE . 17.5 t80 -76.74 -54.54 6.5 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.775 -0.578 . . . . 0.0 109.6 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -64.04 -14.2 52.65 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.578 -0.702 . . . . 0.0 111.348 -179.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt -106.79 -29.96 9.21 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.26 -0.9 . . . . 0.0 111.125 -179.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -96.02 -34.34 11.8 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.289 -0.882 . . . . 0.0 111.555 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.53 HG22 ' O ' ' A' ' 69' ' ' TYR . 5.0 tp -63.15 -23.11 32.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.187 -0.946 . . . . 0.0 110.731 -179.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.02 -45.84 80.06 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.519 -0.738 . . . . 0.0 109.891 179.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -84.05 -27.76 28.09 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.631 -0.668 . . . . 0.0 110.028 179.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -65.64 -42.07 91.86 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.554 -0.716 . . . . 0.0 110.051 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 33.9 mtt85 -64.56 -74.9 0.09 Allowed 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.589 -0.694 . . . . 0.0 110.119 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 53.76 49.19 19.77 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.29 -0.881 . . . . 0.0 110.567 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 31.6 mttm . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.301 -179.987 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.079 0.466 . . . . 0.0 110.261 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.18 -57.51 3.15 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.555 -0.715 . . . . 0.0 110.079 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 75.0 tttt -59.94 106.66 0.52 Allowed 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.536 -0.727 . . . . 0.0 110.36 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 43.2 mttp -60.58 -73.67 0.09 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.617 -0.677 . . . . 0.0 110.384 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -158.78 168.25 12.8 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.498 -0.751 . . . . 0.0 110.293 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.9 -49.11 0.26 Allowed 'Trans proline' 0 N--CA 1.486 1.058 0 O-C-N 123.396 1.208 . . . . 0.0 110.373 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -78.64 -8.09 58.3 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.614 -0.679 . . . . 0.0 111.167 -179.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -84.88 143.21 39.92 Favored Pre-proline 0 N--CA 1.493 1.71 0 O-C-N 121.143 -0.973 . . . . 0.0 109.309 179.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.442 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 44.4 Cg_endo -70.51 94.2 0.59 Allowed 'Trans proline' 0 C--N 1.316 -1.138 0 O-C-N 123.278 1.147 . . . . 0.0 110.656 -179.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.7 mtpt -67.14 -172.37 0.2 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.694 -0.628 . . . . 0.0 109.956 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.0 mtt85 -52.37 136.34 41.37 Favored Pre-proline 0 N--CA 1.5 2.071 0 O-C-N 121.309 -0.87 . . . . 0.0 110.665 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -74.51 128.85 12.23 Favored 'Trans proline' 0 C--N 1.319 -1.004 0 O-C-N 123.257 1.135 . . . . 0.0 110.262 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.682 ' CB ' HD21 ' A' ' 18' ' ' LEU . 48.5 Cg_endo -82.25 174.47 9.92 Favored 'Trans proline' 0 C--N 1.317 -1.094 0 O-C-N 123.25 1.132 . . . . 0.0 110.223 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.517 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 20.2 t -157.14 67.44 0.53 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.427 -0.796 . . . . 0.0 110.599 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 65.61 -76.44 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.107 -0.996 . . . . 0.0 110.531 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -48.48 -43.86 35.28 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.262 -0.899 . . . . 0.0 111.229 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -63.86 -26.77 68.76 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 120.126 -0.63 . . . . 0.0 109.949 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.682 HD21 ' CB ' ' A' ' 13' ' ' PRO . 20.7 mt -89.23 -28.35 20.01 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.377 -0.827 . . . . 0.0 110.379 -179.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.495 ' CZ ' ' CE2' ' A' ' 23' ' ' TYR . 36.9 t80 -76.92 -54.62 6.35 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.551 -0.718 . . . . 0.0 110.716 -179.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 10.7 t -63.04 -35.66 80.96 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.608 -0.682 . . . . 0.0 110.224 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 46.6 t -69.81 -19.73 63.47 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.564 -0.71 . . . . 0.0 111.063 -179.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -111.6 -17.59 13.0 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.261 -0.899 . . . . 0.0 111.555 -179.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.576 ' HB3' HD22 ' A' ' 43' ' ' LEU . 6.2 m-85 -89.0 -32.24 17.71 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.274 -0.891 . . . . 0.0 110.91 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.528 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 5.3 mtp180 -49.11 -52.23 49.55 Favored Pre-proline 0 N--CA 1.497 1.91 0 O-C-N 121.307 -0.871 . . . . 0.0 111.811 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.532 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.2 Cg_endo -59.55 -28.08 86.55 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 O-C-N 123.133 1.07 . . . . 0.0 110.054 179.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.8 tmtt? -69.9 -46.44 65.44 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 108.107 -1.072 . . . . 0.0 108.107 177.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.601 ' CG1' HD21 ' A' ' 43' ' ' LEU . 41.7 mm -56.94 -34.64 44.9 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.051 179.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.555 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 3.4 mmmm -70.16 -38.85 75.54 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.629 -0.67 . . . . 0.0 110.543 -177.518 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.0 t -58.29 -25.67 62.09 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.482 -0.761 . . . . 0.0 110.941 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -115.86 -24.28 8.24 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.455 -0.778 . . . . 0.0 110.853 -179.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.728 ' HB3' HD23 ' A' ' 34' ' ' LEU . 40.3 m80 -119.96 96.25 49.35 Favored Pre-proline 0 N--CA 1.495 1.802 0 O-C-N 121.522 -0.736 . . . . 0.0 109.456 -179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -75.21 -29.59 7.75 Favored 'Trans proline' 0 C--N 1.315 -1.203 0 O-C-N 123.434 1.228 . . . . 0.0 110.543 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.401 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -82.72 -15.96 71.8 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 110.385 -1.086 . . . . 0.0 110.385 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.728 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -58.52 82.54 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.501 -1.0 . . . . 0.0 111.28 -179.333 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.401 ' N ' ' O ' ' A' ' 33' ' ' GLY . 66.4 m -69.94 -179.15 1.77 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.39 -0.818 . . . . 0.0 109.66 179.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 43.8 mm -56.93 -37.76 56.06 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 O-C-N 121.378 -0.826 . . . . 0.0 110.141 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -57.75 -59.39 10.91 Favored Glycine 0 N--CA 1.494 2.506 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.669 ' CB ' HD13 ' A' ' 34' ' ' LEU . 45.2 m-20 -67.8 -41.01 83.8 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.613 -0.933 . . . . 0.0 109.998 179.135 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 96.3 m -59.77 -26.93 66.11 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.217 -0.927 . . . . 0.0 110.271 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -83.81 -49.18 9.31 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.545 -0.722 . . . . 0.0 110.416 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -81.2 -12.33 59.19 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.548 -0.72 . . . . 0.0 111.975 -179.068 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.471 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -83.94 -61.56 1.79 Allowed 'General case' 0 N--CA 1.5 2.04 0 O-C-N 120.998 -1.064 . . . . 0.0 109.704 179.542 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.601 HD21 ' CG1' ' A' ' 27' ' ' ILE . 61.8 mt -52.18 -24.51 7.25 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.457 -0.777 . . . . 0.0 111.182 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.1 -39.75 83.61 Favored Glycine 0 N--CA 1.493 2.434 0 N-CA-C 109.728 -1.349 . . . . 0.0 109.728 -179.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -56.71 -33.85 66.88 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.467 -1.019 . . . . 0.0 110.584 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 9.6 mtt -75.82 -51.26 12.96 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.601 -0.687 . . . . 0.0 110.18 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 64.3 t-105 -47.69 -38.97 16.19 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 121.593 -0.692 . . . . 0.0 111.602 -179.233 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 15.0 t -81.83 -27.13 33.76 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.33 -0.856 . . . . 0.0 110.341 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -63.61 -41.95 98.27 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.544 -0.722 . . . . 0.0 110.312 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.2 169.33 7.24 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.515 -0.74 . . . . 0.0 109.941 179.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.6 m -155.52 107.16 2.59 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.493 -0.754 . . . . 0.0 110.529 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 51.92 42.05 29.94 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.475 -0.765 . . . . 0.0 110.915 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 12.9 mttm -139.3 -76.37 0.35 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.548 -0.72 . . . . 0.0 110.348 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -61.98 -25.98 67.94 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.508 -0.745 . . . . 0.0 110.701 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.4 ttpm? -82.89 -33.71 26.88 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.427 -0.795 . . . . 0.0 110.603 -179.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 -44.52 -52.17 18.36 Favored Pre-proline 0 N--CA 1.506 2.35 0 O-C-N 121.526 -0.734 . . . . 0.0 111.907 -179.168 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.421 ' HA ' ' NE2' ' A' ' 60' ' ' GLN . 56.1 Cg_endo -79.83 -37.53 0.45 Allowed 'Trans proline' 0 C--N 1.315 -1.186 0 O-C-N 123.262 1.138 . . . . 0.0 110.804 179.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -84.62 8.76 15.71 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.571 -0.706 . . . . 0.0 112.034 -178.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -104.03 -24.28 13.23 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 120.955 -1.091 . . . . 0.0 110.19 179.511 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.421 ' NE2' ' HA ' ' A' ' 57' ' ' PRO . 12.1 pt20 -74.87 -26.6 59.79 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.494 -0.754 . . . . 0.0 110.137 179.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.416 ' CG ' HD13 ' A' ' 18' ' ' LEU . 42.1 tttt -57.21 -43.3 82.67 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.569 -0.707 . . . . 0.0 110.5 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.621 ' HB1' ' O ' ' A' ' 13' ' ' PRO . . . -73.63 -11.18 60.34 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.452 -0.78 . . . . 0.0 110.774 179.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.92 -3.52 57.1 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.249 -0.907 . . . . 0.0 110.515 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 64.8 mmtt -97.55 -33.16 11.46 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.254 -0.904 . . . . 0.0 109.655 179.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.9 mp -84.11 5.44 26.11 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.842 -0.536 . . . . 0.0 110.964 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -98.99 -32.79 11.11 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.333 -0.855 . . . . 0.0 109.331 179.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -63.27 -46.67 85.76 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 120.237 -0.585 . . . . 0.0 110.079 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 22.0 tptt -71.29 -63.84 1.03 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.469 -0.769 . . . . 0.0 109.6 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.442 ' CD2' ' HB2' ' A' ' 9' ' ' PRO . 24.4 t80 -36.06 -49.27 0.64 Allowed 'General case' 0 N--CA 1.509 2.486 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -179.296 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -67.16 -32.18 73.1 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.464 -0.773 . . . . 0.0 111.377 -179.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.7 ttmt -95.73 -23.79 16.81 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.323 -0.861 . . . . 0.0 111.703 -178.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -92.14 -24.9 18.95 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.291 -0.881 . . . . 0.0 111.334 -178.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.406 HG22 ' O ' ' A' ' 69' ' ' TYR . 4.5 tp -77.29 -20.2 14.24 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 121.433 -0.792 . . . . 0.0 110.93 -179.527 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.61 -34.2 77.67 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.398 -0.814 . . . . 0.0 109.868 179.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -102.66 -14.36 16.73 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.654 -0.654 . . . . 0.0 110.635 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -63.98 -35.23 80.02 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.272 -0.892 . . . . 0.0 110.175 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 65.8 mtt180 -103.19 17.81 23.2 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.589 -0.694 . . . . 0.0 110.78 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 52.24 79.67 0.1 Allowed 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.173 -0.955 . . . . 0.0 110.892 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.781 0 CA-C-O 117.993 -1.004 . . . . 0.0 110.211 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 32.9 ttm . . . . . 0 N--CA 1.491 1.585 0 CA-C-O 121.139 0.495 . . . . 0.0 110.274 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 52.81 -177.2 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.185 0 O-C-N 121.48 -0.763 . . . . 0.0 110.803 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 32.9 ttmt 52.87 75.41 0.24 Allowed 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.426 -0.796 . . . . 0.0 110.692 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.9 mtpm? -61.75 -77.14 0.05 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.61 -0.681 . . . . 0.0 110.463 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.599 ' HB2' ' HB3' ' A' ' 8' ' ' ALA . 0.5 OUTLIER -104.11 159.68 28.53 Favored Pre-proline 0 N--CA 1.494 1.762 0 O-C-N 121.55 -0.719 . . . . 0.0 110.57 -179.487 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -76.87 -16.22 16.32 Favored 'Trans proline' 0 N--CA 1.486 1.057 0 O-C-N 123.492 1.259 . . . . 0.0 111.863 -179.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.1 p30 -135.74 18.19 3.3 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.281 -0.887 . . . . 0.0 111.257 -179.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.599 ' HB3' ' HB2' ' A' ' 5' ' ' ASP . . . -105.22 125.94 32.27 Favored Pre-proline 0 N--CA 1.494 1.767 0 O-C-N 121.399 -0.813 . . . . 0.0 110.167 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -72.36 117.72 5.27 Favored 'Trans proline' 0 N--CA 1.485 0.996 0 O-C-N 123.128 1.067 . . . . 0.0 110.229 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -128.82 31.43 4.94 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.553 -0.717 . . . . 0.0 110.514 -179.816 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.1 mtt85 -161.97 85.5 1.6 Allowed Pre-proline 0 N--CA 1.494 1.775 0 O-C-N 121.815 -0.553 . . . . 0.0 110.042 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.403 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.2 Cg_endo -82.24 118.14 2.92 Favored 'Trans proline' 0 C--N 1.317 -1.097 0 O-C-N 123.411 1.216 . . . . 0.0 110.339 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.729 ' HB2' HD21 ' A' ' 18' ' ' LEU . 46.9 Cg_endo -80.45 173.56 12.23 Favored 'Trans proline' 0 C--N 1.318 -1.04 0 O-C-N 123.278 1.146 . . . . 0.0 110.099 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.544 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 41.0 t -166.84 61.29 0.09 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.5 -0.75 . . . . 0.0 110.501 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.544 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 68.27 -77.47 0.05 OUTLIER 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.127 -0.983 . . . . 0.0 110.041 -179.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -50.66 -45.28 57.87 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.194 -0.941 . . . . 0.0 110.893 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -60.84 -29.7 69.66 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 120.201 -0.599 . . . . 0.0 109.801 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.729 HD21 ' HB2' ' A' ' 13' ' ' PRO . 35.4 mt -80.68 -36.54 32.2 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.542 -0.724 . . . . 0.0 110.219 -179.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.499 ' CE2' ' CE2' ' A' ' 23' ' ' TYR . 18.1 t80 -69.41 -52.3 28.25 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.592 -0.692 . . . . 0.0 110.35 -179.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 4.4 t -64.43 -29.81 70.85 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.521 -0.737 . . . . 0.0 109.909 179.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.3 m -70.01 -15.32 63.0 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.6 -0.688 . . . . 0.0 111.536 -179.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.2 -17.64 4.25 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.034 -1.041 . . . . 0.0 112.466 -179.02 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.499 ' CE2' ' CE2' ' A' ' 19' ' ' PHE . 12.9 m-85 -91.27 15.11 12.63 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 120.949 -1.094 . . . . 0.0 111.551 -179.378 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.507 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 17.4 mtt180 -91.92 -42.36 0.37 Allowed Pre-proline 0 N--CA 1.489 1.485 0 O-C-N 121.278 -0.889 . . . . 0.0 112.476 179.429 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.581 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.2 Cg_endo -68.08 -16.19 44.37 Favored 'Trans proline' 0 N--CA 1.49 1.298 0 O-C-N 122.759 0.873 . . . . 0.0 110.386 -179.272 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -73.16 -51.78 16.59 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 177.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 40.3 mm -52.54 -29.07 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 CA-C-O 121.304 0.573 . . . . 0.0 110.495 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.581 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 6.4 mmmm -75.19 -32.68 61.28 Favored 'General case' 0 N--CA 1.496 1.845 0 C-N-CA 120.091 -0.643 . . . . 0.0 110.214 -177.359 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.9 t -62.59 -25.82 68.28 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.576 -0.702 . . . . 0.0 110.422 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -118.2 -19.39 9.02 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.539 -0.726 . . . . 0.0 111.14 -179.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.755 ' HB3' HD23 ' A' ' 34' ' ' LEU . 34.1 m80 -124.4 95.71 42.78 Favored Pre-proline 0 N--CA 1.498 1.97 0 O-C-N 121.294 -0.878 . . . . 0.0 109.706 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -75.57 -33.95 3.7 Favored 'Trans proline' 0 C--N 1.316 -1.163 0 O-C-N 123.472 1.249 . . . . 0.0 110.248 -179.872 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.411 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -77.03 -18.36 78.75 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.755 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -57.21 83.78 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.491 -1.005 . . . . 0.0 111.297 -179.287 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.411 ' N ' ' O ' ' A' ' 33' ' ' GLY . 63.9 m -75.14 171.01 14.9 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.487 -0.758 . . . . 0.0 109.848 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.0 mm -53.1 -27.57 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 121.343 -0.848 . . . . 0.0 110.303 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -61.22 -67.07 2.29 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 109.207 -1.557 . . . . 0.0 109.207 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.454 ' HB3' HD13 ' A' ' 34' ' ' LEU . 7.5 t70 -71.87 -28.55 63.61 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.529 -0.983 . . . . 0.0 110.679 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 86.8 m -65.89 -33.79 76.65 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.36 -0.838 . . . . 0.0 110.159 179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.63 -39.35 67.28 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.56 -0.712 . . . . 0.0 110.276 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -91.51 -12.11 35.48 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.6 -0.687 . . . . 0.0 111.597 -179.577 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.404 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 14.0 tptt -77.61 -59.29 2.84 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.042 -1.036 . . . . 0.0 109.731 179.499 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 34.5 mt -47.28 -28.32 1.91 Allowed 'General case' 0 N--CA 1.504 2.242 0 O-C-N 121.554 -0.716 . . . . 0.0 111.416 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -64.28 -35.07 91.5 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.2 -1.56 . . . . 0.0 109.2 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -50.83 -36.08 35.66 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.535 -0.979 . . . . 0.0 111.037 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 34.0 mtt -86.62 -40.98 14.63 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.522 -0.736 . . . . 0.0 110.237 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . 0.442 ' CH2' ' HG2' ' A' ' 55' ' ' LYS . 73.1 t-105 -55.34 -22.52 19.55 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.551 -0.718 . . . . 0.0 111.028 -179.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 66.6 p -93.55 -33.3 13.8 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.286 -0.884 . . . . 0.0 110.166 -179.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -63.42 -36.72 84.68 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.561 -0.712 . . . . 0.0 110.015 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -63.04 152.66 36.34 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.583 -0.698 . . . . 0.0 110.194 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 9.3 t -101.26 -152.61 0.43 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.685 -0.634 . . . . 0.0 109.423 179.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -83.51 55.44 3.2 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.397 -0.814 . . . . 0.0 110.023 179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 39.6 mttt -132.24 -48.92 0.92 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.415 -0.803 . . . . 0.0 110.324 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -67.86 -28.1 67.25 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.532 -0.73 . . . . 0.0 110.774 -179.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.442 ' HG2' ' CH2' ' A' ' 47' ' ' TRP . 18.7 mtmt -79.79 -36.74 36.58 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.372 -0.83 . . . . 0.0 110.572 -179.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -44.22 -53.37 14.01 Favored Pre-proline 0 N--CA 1.507 2.385 0 O-C-N 121.505 -0.747 . . . . 0.0 112.33 -178.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -77.2 -37.33 1.07 Allowed 'Trans proline' 0 C--N 1.315 -1.226 0 O-C-N 123.129 1.068 . . . . 0.0 111.258 -179.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.48 -5.27 58.6 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.454 -0.779 . . . . 0.0 112.026 -178.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.96 -24.1 21.37 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.992 -1.068 . . . . 0.0 111.072 -179.328 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -78.47 -22.09 48.07 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.325 -0.859 . . . . 0.0 110.626 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 73.8 tttt -64.7 -42.35 95.35 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.365 -0.834 . . . . 0.0 109.803 179.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.551 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -80.86 -15.14 57.14 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.558 -0.714 . . . . 0.0 110.068 179.106 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.34 -35.38 75.52 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.379 -0.826 . . . . 0.0 110.029 179.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -72.62 -62.81 1.31 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.454 -0.779 . . . . 0.0 109.783 179.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.484 HD22 ' HG3' ' A' ' 13' ' ' PRO . 5.0 mp -51.22 -24.05 3.97 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.443 -0.786 . . . . 0.0 111.25 -179.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 10.9 tttt -70.36 -52.54 21.84 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.395 -0.816 . . . . 0.0 109.506 179.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -62.19 -50.33 72.25 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.609 -0.682 . . . . 0.0 109.543 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.8 mttt -58.45 -20.62 46.47 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.557 -0.715 . . . . 0.0 110.548 179.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.511 ' O ' HG22 ' A' ' 73' ' ' ILE . 23.4 t80 -86.82 -58.31 2.65 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.449 -0.782 . . . . 0.0 110.026 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -69.37 -32.67 71.86 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.629 -0.669 . . . . 0.0 111.868 -178.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 37.0 mmtm -85.47 -14.34 46.4 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.267 -0.895 . . . . 0.0 111.823 -178.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -107.31 -20.69 13.2 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.143 -0.973 . . . . 0.0 111.34 -179.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.511 HG22 ' O ' ' A' ' 69' ' ' TYR . 2.7 tp -82.14 -22.31 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.3 -0.875 . . . . 0.0 110.825 -179.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.32 -41.16 96.95 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.384 -0.822 . . . . 0.0 109.869 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -93.17 -4.02 52.89 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.631 -0.668 . . . . 0.0 110.954 179.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.507 ' CZ ' ' HB2' ' A' ' 8' ' ' ALA . 63.8 t80 -87.78 -24.68 23.7 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.117 -0.989 . . . . 0.0 110.659 -179.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 4.8 mtp85 -72.0 -79.86 0.07 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.447 -0.783 . . . . 0.0 110.343 -179.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.457 ' HB3' ' HE2' ' A' ' 79' ' ' LYS . . . -129.44 -144.8 0.28 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.31 -0.869 . . . . 0.0 109.729 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.457 ' HE2' ' HB3' ' A' ' 78' ' ' ALA . 11.9 mtmt . . . . . 0 N--CA 1.503 2.176 0 O-C-N 121.046 -1.034 . . . . 0.0 110.8 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.5 tpt . . . . . 0 N--CA 1.493 1.678 0 CA-C-O 121.01 0.433 . . . . 0.0 110.157 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.1 mttm -95.68 -168.16 1.73 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.549 -0.719 . . . . 0.0 110.378 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -177.09 -33.64 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.466 -0.771 . . . . 0.0 110.64 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -56.46 -168.72 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.466 -0.771 . . . . 0.0 111.207 -179.272 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.416 ' CB ' ' HD2' ' A' ' 6' ' ' PRO . 0.1 OUTLIER -147.4 -180.0 1.06 Allowed Pre-proline 0 N--CA 1.495 1.788 0 O-C-N 121.67 -0.643 . . . . 0.0 109.914 -179.518 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.416 ' HD2' ' CB ' ' A' ' 5' ' ' ASP . 43.3 Cg_endo -69.99 -35.5 11.86 Favored 'Trans proline' 0 N--CA 1.486 1.082 0 O-C-N 123.255 1.134 . . . . 0.0 110.314 -179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -77.92 -22.11 50.13 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.606 -0.684 . . . . 0.0 110.28 -179.362 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.402 ' HB2' ' CZ ' ' A' ' 76' ' ' TYR . . . -105.12 134.71 19.51 Favored Pre-proline 0 N--CA 1.493 1.712 0 O-C-N 121.432 -0.793 . . . . 0.0 108.885 178.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.17 119.31 6.2 Favored 'Trans proline' 0 C--N 1.318 -1.071 0 O-C-N 123.054 1.028 . . . . 0.0 110.425 -179.463 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.48 -166.91 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.586 -0.696 . . . . 0.0 109.917 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -60.94 146.19 87.82 Favored Pre-proline 0 N--CA 1.496 1.872 0 O-C-N 121.509 -0.744 . . . . 0.0 110.085 179.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.429 ' HD3' ' CZ ' ' A' ' 69' ' ' TYR . 47.0 Cg_endo -74.21 124.41 8.99 Favored 'Trans proline' 0 C--N 1.317 -1.13 0 O-C-N 123.299 1.157 . . . . 0.0 110.159 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.725 ' HB2' HD21 ' A' ' 18' ' ' LEU . 47.2 Cg_endo -81.43 -179.93 5.33 Favored 'Trans proline' 0 C--N 1.318 -1.055 0 O-C-N 123.286 1.15 . . . . 0.0 110.079 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.555 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 38.1 t -168.93 62.16 0.06 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.461 -0.775 . . . . 0.0 110.811 -179.766 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.644 ' HB2' ' HA ' ' A' ' 59' ' ' GLU . . . 69.6 -77.65 0.05 Allowed 'General case' 0 N--CA 1.503 2.203 0 O-C-N 120.945 -1.097 . . . . 0.0 110.533 -179.783 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.443 ' CE2' ' CD1' ' A' ' 47' ' ' TRP . 3.3 t80 -49.49 -46.93 48.83 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.12 -0.987 . . . . 0.0 111.114 -179.578 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -60.31 -28.29 68.0 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.551 -0.718 . . . . 0.0 110.281 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.725 HD21 ' HB2' ' A' ' 13' ' ' PRO . 23.7 mt -83.99 -35.63 23.77 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.352 -0.843 . . . . 0.0 110.532 -179.37 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.485 ' CE1' ' CE1' ' A' ' 23' ' ' TYR . 59.0 t80 -71.93 -52.68 16.01 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.531 -0.731 . . . . 0.0 110.718 -179.214 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.556 ' SG ' HD13 ' A' ' 43' ' ' LEU . 36.4 t -56.78 -55.16 37.88 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.395 -0.816 . . . . 0.0 110.658 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 9.2 t -55.35 -23.99 27.01 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.502 -0.749 . . . . 0.0 110.989 -179.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -98.97 -21.19 16.38 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.4 -0.812 . . . . 0.0 111.288 -179.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.485 ' CE1' ' CE1' ' A' ' 19' ' ' PHE . 5.6 m-85 -100.11 15.93 25.75 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.349 -0.845 . . . . 0.0 111.352 -179.364 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.506 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 0.5 OUTLIER -92.25 -42.92 0.36 Allowed Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.314 -0.867 . . . . 0.0 112.744 179.663 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.603 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.2 Cg_endo -67.36 -17.94 49.64 Favored 'Trans proline' 0 N--CA 1.491 1.344 0 O-C-N 122.798 0.893 . . . . 0.0 110.493 -178.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? -71.78 -49.34 39.72 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 178.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 26.4 mm -56.06 -30.13 28.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 CA-C-O 121.257 0.551 . . . . 0.0 110.628 179.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.603 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 6.0 mmmm -73.84 -34.98 64.75 Favored 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 120.058 -0.657 . . . . 0.0 110.259 -177.236 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.9 t -62.76 -24.19 67.58 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.472 -0.767 . . . . 0.0 110.647 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -118.33 -16.57 9.62 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.415 -0.803 . . . . 0.0 111.194 -179.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.707 ' HB3' HD23 ' A' ' 34' ' ' LEU . 41.6 m80 -127.33 95.24 36.5 Favored Pre-proline 0 N--CA 1.498 1.949 0 O-C-N 121.351 -0.843 . . . . 0.0 109.578 179.594 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -74.95 -35.91 2.91 Favored 'Trans proline' 0 C--N 1.315 -1.231 0 O-C-N 123.492 1.259 . . . . 0.0 110.342 -179.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.408 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -74.9 -19.07 80.1 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 110.099 -1.2 . . . . 0.0 110.099 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.707 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -57.2 83.81 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.584 -0.951 . . . . 0.0 111.312 -179.374 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.408 ' N ' ' O ' ' A' ' 33' ' ' GLY . 46.7 t -72.71 175.99 5.95 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.422 -0.799 . . . . 0.0 109.542 179.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 43.0 mm -56.48 -29.82 29.81 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 O-C-N 121.362 -0.836 . . . . 0.0 110.122 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.31 -64.91 3.83 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.445 ' HB3' HD13 ' A' ' 34' ' ' LEU . 0.6 OUTLIER -71.65 -31.81 67.24 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.66 -0.906 . . . . 0.0 110.564 179.803 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.5 m -67.09 -32.2 73.19 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.387 -0.821 . . . . 0.0 109.901 179.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.09 -35.34 69.2 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.621 -0.674 . . . . 0.0 109.914 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -97.92 -12.68 21.79 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.602 -0.686 . . . . 0.0 111.764 -179.422 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.431 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 6.1 tptt -85.16 5.18 31.07 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.044 -1.035 . . . . 0.0 110.528 179.377 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.556 HD13 ' SG ' ' A' ' 20' ' ' CYS . 18.3 mt -101.8 -33.51 9.79 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.029 -1.044 . . . . 0.0 109.316 179.168 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -66.25 -30.31 76.52 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.391 -1.484 . . . . 0.0 109.391 179.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.53 -41.39 63.44 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.38 -1.071 . . . . 0.0 110.679 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 11.6 mmt -87.03 -42.78 12.82 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.59 -0.694 . . . . 0.0 109.999 179.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . 0.443 ' CD1' ' CE2' ' A' ' 16' ' ' PHE . 72.9 t-105 -55.74 -23.76 31.13 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.505 -0.747 . . . . 0.0 110.723 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.4 t -85.79 -35.68 20.56 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.366 -0.834 . . . . 0.0 109.997 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -63.45 -33.67 76.08 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.66 -0.65 . . . . 0.0 109.839 179.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 89.8 mm-40 -63.32 151.26 41.23 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.676 -0.64 . . . . 0.0 110.094 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 88.6 p -103.06 -153.02 0.46 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.733 -0.605 . . . . 0.0 109.578 179.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -82.7 56.4 3.36 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.342 -0.849 . . . . 0.0 110.05 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 15.3 tttt -133.74 -51.18 0.85 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.448 -0.783 . . . . 0.0 110.204 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -67.78 -26.19 65.98 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.542 -0.724 . . . . 0.0 110.616 -179.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.423 ' O ' ' N ' ' A' ' 59' ' ' GLU . 10.9 ttmt -82.7 -36.88 25.49 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.563 -0.711 . . . . 0.0 110.668 -179.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -43.42 -52.53 13.08 Favored Pre-proline 0 N--CA 1.508 2.466 0 O-C-N 121.455 -0.778 . . . . 0.0 112.47 -178.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -78.34 -37.45 0.74 Allowed 'Trans proline' 0 C--N 1.315 -1.218 0 O-C-N 123.129 1.068 . . . . 0.0 111.848 -179.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -84.66 -10.38 57.37 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.345 -0.847 . . . . 0.0 112.409 -177.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.644 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -85.46 -26.9 26.05 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.064 -1.022 . . . . 0.0 110.933 -179.036 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -75.4 -18.26 59.98 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.435 -0.791 . . . . 0.0 110.947 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 59.2 tttt -65.02 -43.67 91.68 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.278 -0.888 . . . . 0.0 110.204 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.551 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -76.38 -12.84 60.12 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.494 -0.754 . . . . 0.0 110.328 179.393 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.96 -40.83 94.85 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.31 -0.869 . . . . 0.0 110.42 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 38.6 mmtm -69.87 -62.39 1.4 Allowed 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.237 -0.914 . . . . 0.0 109.705 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.6 mp -46.29 -24.27 0.45 Allowed 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.606 -0.684 . . . . 0.0 112.142 -179.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.5 tptt -71.33 -45.39 63.07 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.295 -0.878 . . . . 0.0 109.517 179.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -66.1 -57.39 7.78 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.71 -0.619 . . . . 0.0 109.873 179.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 59.1 mttt -54.83 -25.47 28.65 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.56 -0.713 . . . . 0.0 110.71 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.603 ' O ' HG22 ' A' ' 73' ' ' ILE . 46.0 t80 -78.12 -66.19 0.88 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.517 -0.74 . . . . 0.0 109.611 179.514 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -58.58 -22.56 56.3 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.728 -0.608 . . . . 0.0 111.288 -179.267 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 39.2 mttt -93.79 -18.84 21.61 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.288 -0.883 . . . . 0.0 111.574 -179.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -110.04 -27.06 9.38 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.249 -0.907 . . . . 0.0 111.02 -179.376 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.603 HG22 ' O ' ' A' ' 69' ' ' TYR . 4.7 tp -66.98 -33.93 66.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 O-C-N 121.389 -0.819 . . . . 0.0 110.459 -179.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.1 -54.52 44.93 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.596 -0.69 . . . . 0.0 110.135 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.19 -19.21 61.78 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.634 -0.666 . . . . 0.0 110.483 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.402 ' CZ ' ' HB2' ' A' ' 8' ' ' ALA . 74.1 t80 -70.65 -39.96 73.32 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.37 -0.832 . . . . 0.0 110.26 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 13.3 mtt-85 -75.67 -83.55 0.06 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.602 -0.686 . . . . 0.0 110.246 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -172.07 38.92 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.139 -0.975 . . . . 0.0 110.091 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 30.0 mmtt . . . . . 0 N--CA 1.494 1.728 0 CA-C-O 117.973 -1.013 . . . . 0.0 110.376 -179.961 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.1 ttt . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.107 0.48 . . . . 0.0 110.247 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -109.62 88.08 2.66 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.635 -0.666 . . . . 0.0 110.114 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 8.6 tttt -169.69 -154.24 0.11 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.517 -0.739 . . . . 0.0 110.116 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.3 tttp -166.31 -151.08 0.12 Allowed 'General case' 0 N--CA 1.485 1.317 0 O-C-N 121.378 -0.826 . . . . 0.0 109.818 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -109.37 168.45 7.68 Favored Pre-proline 0 N--CA 1.494 1.768 0 O-C-N 121.403 -0.811 . . . . 0.0 110.269 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -72.19 -29.77 13.98 Favored 'Trans proline' 0 C--N 1.316 -1.139 0 O-C-N 123.47 1.248 . . . . 0.0 110.339 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -79.25 -15.16 58.43 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.591 -0.693 . . . . 0.0 110.795 -179.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -102.54 128.65 27.65 Favored Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.273 -0.892 . . . . 0.0 109.632 179.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -70.94 102.8 1.27 Allowed 'Trans proline' 0 N--CA 1.485 1.011 0 O-C-N 123.154 1.081 . . . . 0.0 110.727 -179.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.26 -165.14 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.593 -0.692 . . . . 0.0 110.432 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 7.5 mpt_? -56.83 148.56 47.67 Favored Pre-proline 0 N--CA 1.498 1.953 0 O-C-N 121.455 -0.778 . . . . 0.0 110.732 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.425 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.5 Cg_endo -79.26 126.65 7.05 Favored 'Trans proline' 0 C--N 1.317 -1.1 0 O-C-N 123.387 1.204 . . . . 0.0 110.069 179.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.56 ' HB2' HD21 ' A' ' 18' ' ' LEU . 49.2 Cg_endo -81.68 178.45 6.56 Favored 'Trans proline' 0 C--N 1.318 -1.067 0 O-C-N 123.266 1.14 . . . . 0.0 110.379 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.532 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 14.7 t -160.23 63.33 0.33 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.502 -0.748 . . . . 0.0 110.526 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.532 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 67.19 -76.42 0.05 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.092 -1.005 . . . . 0.0 109.914 -179.37 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.419 ' CD1' ' CD1' ' A' ' 47' ' ' TRP . 18.6 t80 -51.58 -42.54 61.97 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.326 -0.858 . . . . 0.0 110.814 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -62.62 -29.16 70.4 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.696 -0.627 . . . . 0.0 109.357 179.382 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.56 HD21 ' HB2' ' A' ' 13' ' ' PRO . 45.0 mt -81.36 -40.35 23.66 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.67 -0.644 . . . . 0.0 110.276 -179.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -63.4 -49.74 72.58 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.485 -0.759 . . . . 0.0 109.865 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.594 ' HA ' HD22 ' A' ' 43' ' ' LEU . 9.0 t -60.85 -27.52 68.16 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.621 -0.674 . . . . 0.0 109.743 179.422 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 10.6 t -102.9 20.81 16.75 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.587 -0.696 . . . . 0.0 110.875 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -142.26 -12.01 0.83 Allowed 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.19 -0.944 . . . . 0.0 112.099 179.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -119.23 24.38 10.78 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 120.854 -1.154 . . . . 0.0 110.862 -179.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.572 ' HG2' HD11 ' A' ' 43' ' ' LEU . 8.0 mtt180 -85.45 -45.93 0.63 Allowed Pre-proline 0 N--CA 1.489 1.485 0 O-C-N 121.512 -0.742 . . . . 0.0 112.126 179.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.558 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.7 Cg_endo -66.91 -14.76 44.94 Favored 'Trans proline' 0 N--CA 1.49 1.281 0 O-C-N 122.925 0.961 . . . . 0.0 110.675 -179.11 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.84 -53.07 11.04 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 177.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 27.1 mm -52.03 -31.73 14.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 CA-C-O 121.417 0.627 . . . . 0.0 110.48 179.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.558 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.4 mmmm -72.71 -37.28 67.85 Favored 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.225 -177.39 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 26.4 t -58.64 -25.09 62.37 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.495 -0.753 . . . . 0.0 110.764 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -117.52 -21.58 8.53 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.531 -0.73 . . . . 0.0 110.96 -179.59 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.706 ' HB3' HD23 ' A' ' 34' ' ' LEU . 41.0 m80 -121.7 96.59 47.2 Favored Pre-proline 0 N--CA 1.496 1.857 0 O-C-N 121.247 -0.908 . . . . 0.0 109.783 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -75.23 -37.9 1.73 Allowed 'Trans proline' 0 C--N 1.315 -1.195 0 O-C-N 123.446 1.235 . . . . 0.0 110.433 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.32 -9.41 85.78 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 110.452 -1.059 . . . . 0.0 110.452 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.706 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -64.52 82.34 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.163 -1.198 . . . . 0.0 110.33 -179.882 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.6 t -76.49 173.06 11.97 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.503 -0.748 . . . . 0.0 109.703 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 40.0 mm -50.94 -29.72 8.03 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.186 0 O-C-N 121.271 -0.893 . . . . 0.0 110.6 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.87 -75.29 0.29 Allowed Glycine 0 N--CA 1.492 2.389 0 N-CA-C 109.069 -1.612 . . . . 0.0 109.069 179.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.439 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 29.3 t70 -66.2 -18.84 65.6 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.701 -0.882 . . . . 0.0 111.039 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 36.3 m -73.95 -45.58 49.43 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.243 -0.91 . . . . 0.0 109.954 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -52.32 -44.83 65.33 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.442 -0.787 . . . . 0.0 110.15 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.401 ' CD ' ' HA ' ' A' ' 38' ' ' ASP . 0.5 OUTLIER -80.32 -11.19 59.74 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.76 -0.587 . . . . 0.0 111.243 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.439 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -82.0 2.47 30.76 Favored 'General case' 0 N--CA 1.503 2.216 0 O-C-N 120.93 -1.106 . . . . 0.0 110.815 179.111 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.594 HD22 ' HA ' ' A' ' 20' ' ' CYS . 9.4 mt -106.34 -30.35 9.2 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.204 -0.935 . . . . 0.0 109.599 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -78.99 -42.11 12.99 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 108.854 -1.698 . . . . 0.0 108.854 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -55.11 -42.89 73.52 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.533 -0.98 . . . . 0.0 110.401 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 17.6 mmt -74.18 -50.5 18.98 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.571 -0.706 . . . . 0.0 109.535 179.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . 0.419 ' CD1' ' CD1' ' A' ' 16' ' ' PHE . 69.2 t-105 -49.61 -52.95 26.85 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.642 -0.661 . . . . 0.0 111.047 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 45.0 t -59.92 -35.48 74.99 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.407 -0.808 . . . . 0.0 110.326 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -63.58 -40.27 96.52 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.567 -0.708 . . . . 0.0 109.934 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 89.3 mm-40 -57.52 155.2 9.9 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.576 -0.702 . . . . 0.0 110.556 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 21.7 t -99.87 -150.67 0.38 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.722 -0.612 . . . . 0.0 109.511 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -89.65 47.46 1.47 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.281 -0.887 . . . . 0.0 110.275 179.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 62.0 mttt -126.8 -50.71 1.47 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.551 -0.718 . . . . 0.0 110.069 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -64.16 -24.74 67.79 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.67 -0.644 . . . . 0.0 110.405 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 66.1 tttt -81.96 -35.16 29.3 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.467 -0.771 . . . . 0.0 110.432 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -44.44 -52.22 17.89 Favored Pre-proline 0 N--CA 1.506 2.343 0 O-C-N 121.513 -0.742 . . . . 0.0 112.022 -179.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -78.96 -37.73 0.54 Allowed 'Trans proline' 0 C--N 1.315 -1.204 0 O-C-N 123.188 1.099 . . . . 0.0 110.958 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -84.53 4.29 32.64 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.38 -0.825 . . . . 0.0 112.043 -178.325 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.01 -23.89 14.77 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.072 -1.017 . . . . 0.0 110.446 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -76.36 -23.76 54.16 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.394 -0.816 . . . . 0.0 110.251 179.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 50.6 tttm -61.44 -39.82 92.19 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.421 -0.799 . . . . 0.0 109.856 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.489 ' HB1' ' O ' ' A' ' 13' ' ' PRO . . . -78.1 -13.06 60.01 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.6 -0.687 . . . . 0.0 110.365 179.348 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -82.35 1.75 35.58 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.397 -0.814 . . . . 0.0 110.291 178.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 26.3 mmtm -104.35 -30.36 10.15 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.147 -0.971 . . . . 0.0 109.735 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.476 HD12 ' N ' ' A' ' 65' ' ' LEU . 7.1 mp -86.48 1.51 51.22 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.894 -0.504 . . . . 0.0 110.592 179.102 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.5 tptt -94.38 -34.28 12.84 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.156 -0.965 . . . . 0.0 109.428 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -82.93 -11.59 58.05 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.751 -0.593 . . . . 0.0 110.394 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -105.04 -28.78 10.84 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.439 -0.788 . . . . 0.0 109.467 179.111 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.513 ' HE1' HD13 ' A' ' 73' ' ' ILE . 19.3 t80 -75.76 -54.41 6.98 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.6 -0.688 . . . . 0.0 109.59 179.575 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -68.08 -14.68 63.16 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.719 -0.613 . . . . 0.0 111.306 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 60.8 mttt -101.33 -30.53 11.44 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.256 -0.903 . . . . 0.0 110.709 -179.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -92.48 -31.31 15.3 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.483 -0.76 . . . . 0.0 110.852 -179.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.513 HD13 ' HE1' ' A' ' 69' ' ' TYR . 3.7 tp -66.46 -16.05 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 O-C-N 121.398 -0.814 . . . . 0.0 110.953 -179.57 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.44 -47.47 33.42 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.253 -0.905 . . . . 0.0 109.61 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -82.88 -27.08 30.96 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.687 -0.633 . . . . 0.0 109.723 179.233 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 66.8 t80 -63.74 -44.38 93.68 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.586 -0.696 . . . . 0.0 109.88 179.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 35.5 mtt180 -61.54 -73.0 0.11 Allowed 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.572 -0.705 . . . . 0.0 110.09 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 53.08 46.44 26.69 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.429 -0.794 . . . . 0.0 110.674 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 14.8 mttt . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.284 -179.946 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 30.6 ttm . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 121.065 0.46 . . . . 0.0 110.252 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.35 25.93 7.12 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.561 -0.712 . . . . 0.0 110.381 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -69.58 101.02 1.53 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.537 -0.727 . . . . 0.0 110.286 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.4 mttp -158.17 -172.58 3.95 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.522 -0.736 . . . . 0.0 110.317 179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -132.25 176.02 3.23 Favored Pre-proline 0 N--CA 1.495 1.791 0 O-C-N 121.558 -0.714 . . . . 0.0 110.119 -179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.0 -29.48 22.67 Favored 'Trans proline' 0 N--CA 1.487 1.138 0 O-C-N 123.407 1.214 . . . . 0.0 110.296 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -78.29 -19.28 53.92 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.592 -0.693 . . . . 0.0 110.637 -179.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -95.53 134.24 24.56 Favored Pre-proline 0 N--CA 1.494 1.73 0 O-C-N 121.341 -0.85 . . . . 0.0 109.173 179.003 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.466 ' HB2' ' CG ' ' A' ' 69' ' ' TYR . 45.1 Cg_endo -72.89 108.23 2.53 Favored 'Trans proline' 0 C--N 1.319 -1.025 0 O-C-N 123.139 1.073 . . . . 0.0 110.775 -179.415 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.6 pttt -67.06 -153.92 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.575 -0.703 . . . . 0.0 109.615 179.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -57.75 138.21 82.61 Favored Pre-proline 0 N--CA 1.499 2.01 0 O-C-N 121.269 -0.895 . . . . 0.0 110.145 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -74.56 134.37 18.53 Favored 'Trans proline' 0 C--N 1.318 -1.078 0 O-C-N 123.246 1.129 . . . . 0.0 110.082 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.656 ' HB2' HD21 ' A' ' 18' ' ' LEU . 50.8 Cg_endo -80.56 179.7 5.88 Favored 'Trans proline' 0 C--N 1.318 -1.07 0 O-C-N 123.208 1.11 . . . . 0.0 110.164 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.541 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -170.0 61.65 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.398 -0.814 . . . . 0.0 110.827 -179.877 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.657 ' HB2' ' HA ' ' A' ' 59' ' ' GLU . . . 68.13 -78.71 0.04 OUTLIER 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.072 -1.018 . . . . 0.0 110.473 -179.76 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.417 ' CE2' ' CD1' ' A' ' 47' ' ' TRP . 3.9 t80 -48.65 -49.36 37.73 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.163 -0.961 . . . . 0.0 111.231 -179.463 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -57.15 -31.07 64.99 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.575 -0.703 . . . . 0.0 110.14 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.656 HD21 ' HB2' ' A' ' 13' ' ' PRO . 34.2 mt -78.57 -31.63 47.39 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.534 -0.729 . . . . 0.0 110.181 -179.779 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.502 ' CZ ' ' CZ ' ' A' ' 23' ' ' TYR . 52.1 t80 -76.79 -55.03 5.85 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.607 -0.683 . . . . 0.0 110.731 -179.306 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.8 t -57.7 -52.9 63.56 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.435 -0.791 . . . . 0.0 110.526 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 8.0 t -55.71 -24.19 33.24 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.5 -0.75 . . . . 0.0 110.855 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -98.72 -24.85 14.88 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.426 -0.796 . . . . 0.0 111.001 -179.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.658 ' HB3' HD22 ' A' ' 43' ' ' LEU . 2.2 m-85 -88.22 -36.4 16.78 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.378 -0.826 . . . . 0.0 110.685 -179.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.54 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 6.8 mtt180 -48.43 -51.38 51.74 Favored Pre-proline 0 N--CA 1.496 1.861 0 O-C-N 121.44 -0.788 . . . . 0.0 111.992 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.577 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.4 Cg_endo -60.11 -28.69 87.51 Favored 'Trans proline' 0 N--CA 1.495 1.566 0 O-C-N 123.21 1.111 . . . . 0.0 109.977 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.3 tmtt? -67.8 -44.68 76.76 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 178.022 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.635 HG13 HD21 ' A' ' 43' ' ' LEU . 46.4 mm -59.54 -23.37 25.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 CA-C-N 116.152 -0.477 . . . . 0.0 109.877 179.456 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.577 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.9 mmmm -83.56 -38.55 21.54 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.458 -0.777 . . . . 0.0 110.058 -177.693 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.7 t -57.43 -26.62 61.45 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.354 -0.841 . . . . 0.0 110.097 179.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -109.19 -48.05 3.32 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.611 -0.681 . . . . 0.0 109.857 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.826 ' HB3' HD23 ' A' ' 34' ' ' LEU . 14.2 m80 -103.31 103.58 35.93 Favored Pre-proline 0 N--CA 1.497 1.884 0 O-C-N 121.642 -0.661 . . . . 0.0 109.685 -179.456 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -81.38 -40.99 0.15 Allowed 'Trans proline' 0 C--N 1.314 -1.287 0 O-C-N 123.367 1.193 . . . . 0.0 109.975 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -65.08 -23.26 69.52 Favored Glycine 0 N--CA 1.488 2.146 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 179.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.826 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -51.79 91.76 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.529 -0.983 . . . . 0.0 110.909 179.976 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 68.7 m -74.35 175.41 7.69 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.583 -0.698 . . . . 0.0 109.755 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.508 ' H ' HD12 ' A' ' 36' ' ' ILE . 2.5 mp -59.65 -31.81 47.85 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.954 0 O-C-N 121.348 -0.845 . . . . 0.0 109.584 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.15 -61.41 7.36 Favored Glycine 0 N--CA 1.495 2.607 0 N-CA-C 109.02 -1.632 . . . . 0.0 109.02 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.678 ' HB3' HD13 ' A' ' 34' ' ' LEU . 16.5 t0 -71.36 -35.92 71.3 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.694 -0.886 . . . . 0.0 110.091 179.163 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.407 ' HB ' ' HA ' ' A' ' 36' ' ' ILE . 80.5 m -64.6 -29.9 70.92 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.138 -0.976 . . . . 0.0 109.82 179.157 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.56 -37.9 59.62 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.641 -0.662 . . . . 0.0 110.245 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.411 ' HG2' ' HA ' ' A' ' 38' ' ' ASP . 2.3 ptpt -95.87 -13.71 23.75 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.525 -0.734 . . . . 0.0 111.922 -178.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -86.04 4.49 37.77 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 120.974 -1.079 . . . . 0.0 110.626 179.7 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.658 HD22 ' HB3' ' A' ' 23' ' ' TYR . 80.1 mt -106.77 -34.27 7.33 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.262 -0.899 . . . . 0.0 109.488 179.467 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -64.57 -32.7 85.08 Favored Glycine 0 N--CA 1.493 2.476 0 N-CA-C 109.79 -1.324 . . . . 0.0 109.79 -179.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -51.18 -33.95 29.48 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.403 -1.057 . . . . 0.0 110.794 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 39.2 mtt -87.43 -41.05 13.85 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.604 -0.685 . . . . 0.0 109.888 179.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . 0.417 ' CD1' ' CE2' ' A' ' 16' ' ' PHE . 71.7 t-105 -56.19 -23.89 38.23 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.55 -0.718 . . . . 0.0 110.858 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 21.9 t -85.28 -36.08 21.1 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.48 -0.763 . . . . 0.0 110.066 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 27.3 mt-10 -63.03 -33.02 74.53 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.633 -0.667 . . . . 0.0 109.828 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 -64.81 149.64 49.0 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.645 -0.659 . . . . 0.0 110.12 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.6 m -104.44 -153.22 0.48 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.669 -0.644 . . . . 0.0 109.526 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.88 58.29 3.33 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.376 -0.827 . . . . 0.0 109.915 179.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 26.7 tttt -136.24 -50.79 0.7 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.399 -0.813 . . . . 0.0 110.297 -179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -69.81 -27.95 65.31 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.557 -0.715 . . . . 0.0 110.726 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.419 ' O ' ' N ' ' A' ' 59' ' ' GLU . 32.6 ttpt -80.0 -37.71 33.65 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.444 -0.785 . . . . 0.0 110.695 -179.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -44.14 -53.01 14.56 Favored Pre-proline 0 N--CA 1.508 2.439 0 O-C-N 121.472 -0.768 . . . . 0.0 112.513 -178.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -77.66 -37.43 0.92 Allowed 'Trans proline' 0 C--N 1.315 -1.2 0 O-C-N 123.078 1.041 . . . . 0.0 111.744 -179.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -81.86 -14.86 55.67 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.395 -0.815 . . . . 0.0 112.089 -178.111 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.657 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -82.84 -24.97 33.04 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.202 -0.936 . . . . 0.0 111.086 -178.934 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -79.83 -20.59 45.7 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.451 -0.781 . . . . 0.0 110.845 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 43.1 tttm -63.04 -48.39 78.9 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.409 -0.807 . . . . 0.0 110.195 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.65 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -81.12 -13.36 58.76 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.447 -0.783 . . . . 0.0 110.316 179.294 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.87 -28.14 69.83 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.321 -0.862 . . . . 0.0 109.154 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -81.75 -66.06 0.94 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.577 -0.702 . . . . 0.0 109.17 178.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.559 ' H ' HD12 ' A' ' 65' ' ' LEU . 3.1 mp -48.32 -22.56 0.7 Allowed 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.602 -0.687 . . . . 0.0 112.117 -179.356 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 23.9 tptt -65.49 -45.46 83.54 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.14 -0.975 . . . . 0.0 109.851 179.448 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -66.66 -54.51 22.42 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.662 -0.649 . . . . 0.0 110.349 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 68.9 mttt -56.4 -29.93 62.12 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.487 -0.758 . . . . 0.0 110.478 -179.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.538 ' O ' HG22 ' A' ' 73' ' ' ILE . 3.8 m-85 -75.72 -70.07 0.45 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.576 -0.703 . . . . 0.0 109.834 179.652 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -49.53 -29.26 6.56 Favored 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.662 -0.649 . . . . 0.0 111.342 -179.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 14.8 ttmm -84.47 -58.04 2.9 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.529 -0.732 . . . . 0.0 110.47 -179.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -64.11 -30.23 71.31 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.624 -0.673 . . . . 0.0 111.112 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.538 HG22 ' O ' ' A' ' 69' ' ' TYR . 9.7 tp -71.53 -35.42 56.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.351 -0.843 . . . . 0.0 110.442 -179.485 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.9 -48.72 80.53 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.47 -0.769 . . . . 0.0 110.111 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.77 -11.32 59.87 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.634 -0.666 . . . . 0.0 110.746 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -83.71 -30.08 27.03 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.312 -0.867 . . . . 0.0 110.242 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 22.6 mtt180 -85.73 6.13 29.18 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.499 -0.751 . . . . 0.0 111.173 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 51.17 88.86 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.119 0 O-C-N 120.986 -1.071 . . . . 0.0 110.98 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.7 tptt . . . . . 0 N--CA 1.494 1.739 0 CA-C-O 117.999 -1.001 . . . . 0.0 110.253 -179.978 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.0 tpp . . . . . 0 N--CA 1.49 1.573 0 CA-C-O 121.184 0.516 . . . . 0.0 110.229 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 52.74 91.94 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.465 -0.772 . . . . 0.0 110.746 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -170.24 100.42 0.27 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.55 -0.719 . . . . 0.0 110.266 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 17.4 mtpp -60.1 -62.96 1.48 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.56 -0.713 . . . . 0.0 110.415 -179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -162.23 165.21 16.09 Favored Pre-proline 0 N--CA 1.493 1.715 0 O-C-N 121.497 -0.752 . . . . 0.0 110.33 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.65 -40.23 2.17 Favored 'Trans proline' 0 C--N 1.318 -1.043 0 O-C-N 123.436 1.229 . . . . 0.0 110.33 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 35.5 t30 -78.51 -11.33 59.95 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.715 -0.616 . . . . 0.0 111.044 -179.095 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -105.21 132.62 20.72 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.156 -0.965 . . . . 0.0 109.361 178.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.76 114.76 4.11 Favored 'Trans proline' 0 C--N 1.318 -1.032 0 O-C-N 123.095 1.05 . . . . 0.0 110.458 -179.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.5 pttt -60.12 -162.44 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.664 -0.648 . . . . 0.0 110.337 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.68 144.59 98.8 Favored Pre-proline 0 N--CA 1.495 1.821 0 O-C-N 121.421 -0.799 . . . . 0.0 110.069 179.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.405 ' HG3' ' CE2' ' A' ' 69' ' ' TYR . 49.3 Cg_endo -75.24 131.0 13.54 Favored 'Trans proline' 0 C--N 1.317 -1.082 0 O-C-N 123.296 1.156 . . . . 0.0 109.802 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.674 ' CB ' HD21 ' A' ' 18' ' ' LEU . 48.9 Cg_endo -81.26 -176.75 3.27 Favored 'Trans proline' 0 C--N 1.317 -1.115 0 O-C-N 123.197 1.104 . . . . 0.0 110.172 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.535 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 76.4 p -165.48 59.21 0.11 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.513 -0.742 . . . . 0.0 110.807 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.535 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 68.52 -77.09 0.05 Allowed 'General case' 0 N--CA 1.504 2.258 0 O-C-N 121.12 -0.987 . . . . 0.0 110.662 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 6.9 t80 -46.99 -51.6 16.74 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.299 -0.876 . . . . 0.0 111.47 -179.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 29.9 t80 -57.55 -36.95 72.31 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.497 -0.752 . . . . 0.0 109.945 179.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.674 HD21 ' CB ' ' A' ' 13' ' ' PRO . 36.1 mt -70.08 -38.63 75.75 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.619 -0.676 . . . . 0.0 110.347 -179.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.492 ' CE1' ' CE1' ' A' ' 23' ' ' TYR . 63.1 t80 -71.94 -53.05 14.3 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.517 -0.739 . . . . 0.0 110.621 -179.507 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 34.6 t -56.83 -53.82 53.46 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.368 -0.833 . . . . 0.0 110.657 -179.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 11.8 t -56.22 -29.01 60.39 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.534 -0.729 . . . . 0.0 110.822 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -90.82 -27.75 18.65 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.468 -0.77 . . . . 0.0 110.798 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.492 ' CE1' ' CE1' ' A' ' 19' ' ' PHE . 9.1 m-85 -94.74 14.69 20.43 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.511 -0.743 . . . . 0.0 111.287 -179.433 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.527 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 4.2 mtp180 -88.59 -43.82 0.46 Allowed Pre-proline 0 N--CA 1.488 1.446 0 O-C-N 121.253 -0.904 . . . . 0.0 112.53 179.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.566 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 37.8 Cg_endo -65.66 -17.41 56.67 Favored 'Trans proline' 0 N--CA 1.491 1.365 0 O-C-N 122.865 0.929 . . . . 0.0 110.563 -178.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.8 tmtt? -72.02 -50.43 28.64 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 177.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 24.5 mm -54.86 -33.79 29.23 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 CA-C-O 121.224 0.535 . . . . 0.0 110.631 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.566 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 6.2 mmmm -71.01 -38.35 72.64 Favored 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 120.121 -0.632 . . . . 0.0 110.321 -177.073 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.6 t -58.65 -24.47 61.22 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.515 -0.741 . . . . 0.0 110.797 -179.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -117.29 -23.04 7.99 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.435 -0.79 . . . . 0.0 110.978 -179.565 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.747 ' HB3' HD23 ' A' ' 34' ' ' LEU . 43.0 m80 -120.56 96.58 48.91 Favored Pre-proline 0 N--CA 1.495 1.82 0 O-C-N 121.342 -0.848 . . . . 0.0 109.709 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -75.59 -29.07 7.68 Favored 'Trans proline' 0 C--N 1.315 -1.226 0 O-C-N 123.416 1.219 . . . . 0.0 110.54 -179.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -85.04 -12.2 74.55 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 110.571 -1.012 . . . . 0.0 110.571 -179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.747 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -61.56 83.67 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.257 -1.143 . . . . 0.0 110.658 -179.543 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 71.5 p -72.52 171.1 13.0 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.512 -0.742 . . . . 0.0 109.847 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.586 ' H ' HD12 ' A' ' 36' ' ' ILE . 2.7 mp -53.6 -28.6 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.122 0 O-C-N 121.281 -0.887 . . . . 0.0 109.944 179.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.49 -71.13 0.83 Allowed Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.242 -1.543 . . . . 0.0 109.242 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.486 ' HB3' HD13 ' A' ' 34' ' ' LEU . 15.0 t70 -66.53 -27.41 67.74 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.698 -0.883 . . . . 0.0 110.456 179.551 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.433 ' HB ' ' HA ' ' A' ' 36' ' ' ILE . 33.2 m -67.38 -27.72 67.34 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.494 -0.754 . . . . 0.0 109.893 179.404 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.38 -47.37 23.52 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.574 -0.704 . . . . 0.0 109.685 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.69 -17.1 52.18 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.605 -0.684 . . . . 0.0 111.377 -179.64 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.413 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 11.0 tptt -76.66 -59.15 2.9 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.111 -0.993 . . . . 0.0 109.885 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.42 HD12 ' O ' ' A' ' 39' ' ' THR . 54.7 mt -47.03 -27.42 1.32 Allowed 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.648 -0.657 . . . . 0.0 111.544 -179.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.91 -36.2 91.79 Favored Glycine 0 N--CA 1.492 2.394 0 N-CA-C 109.182 -1.567 . . . . 0.0 109.182 179.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -51.01 -37.36 44.65 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.508 -0.995 . . . . 0.0 111.074 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 65.0 mtt -82.47 -42.8 18.03 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.598 -0.689 . . . . 0.0 110.318 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 69.9 t-105 -49.37 -32.93 12.43 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.523 -0.736 . . . . 0.0 111.585 -179.199 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 18.3 t -93.02 -24.06 18.47 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.306 -0.872 . . . . 0.0 110.592 -179.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -64.02 -43.3 96.02 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.413 -0.805 . . . . 0.0 109.993 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 52.2 mm-40 -61.83 157.62 17.74 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.719 -0.613 . . . . 0.0 110.329 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 23.3 t -87.23 -147.7 0.14 Allowed 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -83.58 54.11 2.75 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.181 -0.949 . . . . 0.0 110.125 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.0 tttt -129.62 -37.08 1.6 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.465 -0.772 . . . . 0.0 110.596 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -58.61 -38.62 78.4 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.304 -0.873 . . . . 0.0 110.791 -179.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -92.92 24.13 3.84 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.35 -0.844 . . . . 0.0 111.458 -179.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.454 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 4.4 mm-40 -98.05 -56.89 0.18 Allowed Pre-proline 0 N--CA 1.498 1.959 0 O-C-N 121.219 -0.926 . . . . 0.0 110.539 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.454 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.7 Cg_endo -83.23 -32.16 0.55 Allowed 'Trans proline' 0 N--CA 1.482 0.84 0 O-C-N 122.817 0.904 . . . . 0.0 110.666 179.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -82.09 -0.85 46.47 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.493 -0.754 . . . . 0.0 111.769 -178.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.42 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -92.54 -24.52 18.73 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.084 -1.01 . . . . 0.0 110.814 -179.577 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -79.26 -23.91 43.34 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.443 -0.785 . . . . 0.0 110.332 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -61.66 -44.83 96.21 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.432 -0.792 . . . . 0.0 109.92 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.517 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -70.22 -11.43 60.89 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.598 -0.689 . . . . 0.0 110.482 179.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -88.57 7.45 33.19 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.262 -0.899 . . . . 0.0 110.315 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 58.9 mmtt -107.02 -34.39 7.19 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.222 -0.923 . . . . 0.0 109.111 178.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.413 ' N ' HD12 ' A' ' 65' ' ' LEU . 6.2 mp -81.04 -4.12 54.14 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.984 -0.448 . . . . 0.0 110.342 178.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 2.9 tppt? -80.82 -31.53 35.54 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.264 -0.898 . . . . 0.0 109.301 179.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -69.23 -63.26 1.1 Allowed 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 119.876 -0.73 . . . . 0.0 109.603 179.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -55.2 -24.21 26.04 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.531 -0.731 . . . . 0.0 111.107 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.514 ' O ' HG22 ' A' ' 73' ' ' ILE . 29.5 t80 -79.18 -69.56 0.57 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.306 -0.871 . . . . 0.0 110.29 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -62.9 -14.06 41.93 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.551 -0.718 . . . . 0.0 111.768 -179.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.7 tttt -98.24 -27.02 14.34 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.104 -0.998 . . . . 0.0 110.893 -179.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -104.39 -24.56 13.05 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.434 -0.791 . . . . 0.0 111.079 -179.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.514 HG22 ' O ' ' A' ' 69' ' ' TYR . 3.2 tp -68.97 -30.29 46.26 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 O-C-N 121.407 -0.808 . . . . 0.0 110.421 -179.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.46 -46.83 86.74 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.648 -0.658 . . . . 0.0 109.861 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -81.99 -20.16 39.04 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.701 -0.624 . . . . 0.0 110.498 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 75.1 t80 -67.08 -35.38 79.7 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.409 -0.807 . . . . 0.0 110.129 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 43.8 mtt180 -101.4 10.1 40.85 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.56 -0.712 . . . . 0.0 110.931 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 52.5 81.26 0.08 Allowed 'General case' 0 N--CA 1.501 2.119 0 O-C-N 120.964 -1.085 . . . . 0.0 110.81 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 15.0 mttm . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 118.009 -0.996 . . . . 0.0 110.207 -179.927 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.4 ttt . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.083 0.468 . . . . 0.0 110.177 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 3.1 mttm 52.56 -169.05 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.514 -0.741 . . . . 0.0 110.888 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.1 mmtt 53.62 -163.89 0.1 Allowed 'General case' 0 N--CA 1.503 2.189 0 O-C-N 121.469 -0.769 . . . . 0.0 110.556 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.5 tttt -169.07 -155.36 0.14 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.596 -0.69 . . . . 0.0 109.873 179.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.548 ' HB2' ' HB3' ' A' ' 8' ' ' ALA . 1.0 OUTLIER -63.88 152.89 85.98 Favored Pre-proline 0 N--CA 1.495 1.792 0 O-C-N 121.589 -0.695 . . . . 0.0 110.431 -179.864 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -73.66 -45.12 0.42 Allowed 'Trans proline' 0 C--N 1.317 -1.081 0 O-C-N 123.468 1.247 . . . . 0.0 110.422 179.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -78.81 -22.7 45.85 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.606 -0.684 . . . . 0.0 110.738 -179.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.548 ' HB3' ' HB2' ' A' ' 5' ' ' ASP . . . -78.13 143.19 65.0 Favored Pre-proline 0 N--CA 1.495 1.777 0 O-C-N 121.225 -0.922 . . . . 0.0 109.428 179.186 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -71.58 98.9 0.89 Allowed 'Trans proline' 0 C--N 1.318 -1.062 0 O-C-N 123.258 1.136 . . . . 0.0 110.443 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.6 pttm -65.6 -155.49 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.599 -0.688 . . . . 0.0 109.658 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -55.44 145.88 46.06 Favored Pre-proline 0 N--CA 1.499 2.015 0 O-C-N 121.291 -0.881 . . . . 0.0 110.365 179.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -73.57 126.28 10.75 Favored 'Trans proline' 0 C--N 1.316 -1.162 0 O-C-N 123.378 1.199 . . . . 0.0 110.319 -179.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.476 ' C ' ' HB1' ' A' ' 62' ' ' ALA . 48.8 Cg_endo -81.57 173.44 11.41 Favored 'Trans proline' 0 C--N 1.318 -1.043 0 O-C-N 123.239 1.126 . . . . 0.0 109.799 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.579 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 33.5 t -171.83 64.57 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.429 -0.794 . . . . 0.0 111.001 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.579 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 71.32 -74.26 0.09 Allowed 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.124 -0.985 . . . . 0.0 110.876 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -46.67 -52.87 12.83 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.274 -0.891 . . . . 0.0 111.556 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 14.5 t80 -58.31 -39.24 78.84 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.575 -0.703 . . . . 0.0 109.865 179.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.586 HD11 ' HB2' ' A' ' 62' ' ' ALA . 48.4 mt -64.59 -42.94 95.26 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.667 -0.646 . . . . 0.0 109.814 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.501 ' CE1' ' CE1' ' A' ' 23' ' ' TYR . 80.9 t80 -68.71 -51.73 38.38 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.647 -0.658 . . . . 0.0 110.268 -179.827 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.3 m -55.7 -56.05 24.97 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.545 -0.722 . . . . 0.0 110.69 -179.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 84.8 p -55.87 -30.78 62.07 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.48 -0.762 . . . . 0.0 110.831 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -87.54 -27.31 22.68 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.464 -0.773 . . . . 0.0 110.909 -179.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.501 ' CE1' ' CE1' ' A' ' 19' ' ' PHE . 9.6 m-85 -98.87 14.85 27.46 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.458 -0.776 . . . . 0.0 111.369 -179.5 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.516 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 14.2 mtp180 -87.91 -45.01 0.49 Allowed Pre-proline 0 N--CA 1.488 1.437 0 O-C-N 121.151 -0.968 . . . . 0.0 112.505 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.562 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.0 Cg_endo -65.47 -17.61 57.88 Favored 'Trans proline' 0 N--CA 1.491 1.353 0 O-C-N 122.802 0.896 . . . . 0.0 110.539 -178.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.1 tmtm? -71.71 -49.8 36.08 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 177.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 23.7 mm -55.49 -34.14 34.1 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 CA-C-O 121.322 0.582 . . . . 0.0 110.566 179.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.562 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.7 mmmm -70.98 -38.6 72.75 Favored 'General case' 0 N--CA 1.497 1.886 0 C-N-CA 120.167 -0.613 . . . . 0.0 110.299 -176.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.9 t -59.91 -23.52 63.57 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.461 -0.775 . . . . 0.0 110.816 -179.564 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -117.52 -21.04 8.78 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.484 -0.76 . . . . 0.0 111.116 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.753 ' HB3' HD23 ' A' ' 34' ' ' LEU . 48.5 m80 -121.96 96.45 46.79 Favored Pre-proline 0 N--CA 1.495 1.824 0 O-C-N 121.348 -0.845 . . . . 0.0 109.784 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -75.38 -28.75 8.29 Favored 'Trans proline' 0 C--N 1.315 -1.185 0 O-C-N 123.416 1.219 . . . . 0.0 110.455 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -84.14 -13.83 73.32 Favored Glycine 0 N--CA 1.488 2.127 0 N-CA-C 110.504 -1.038 . . . . 0.0 110.504 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.753 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -61.08 82.8 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.334 -1.097 . . . . 0.0 110.892 -179.522 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 33.4 t -75.05 171.54 13.93 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.506 -0.746 . . . . 0.0 109.78 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 40.8 mm -52.12 -27.73 10.03 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.175 0 O-C-N 121.284 -0.885 . . . . 0.0 110.369 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -61.42 -71.63 0.77 Allowed Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.227 -1.549 . . . . 0.0 109.227 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.423 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 8.2 t70 -67.33 -26.04 66.3 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.628 -0.925 . . . . 0.0 110.765 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 56.2 m -68.46 -28.79 67.36 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.458 -0.777 . . . . 0.0 109.926 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.58 -47.13 34.25 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.536 -0.728 . . . . 0.0 109.747 179.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -81.49 -14.71 56.67 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.573 -0.704 . . . . 0.0 111.366 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 6.9 tptt -76.4 -58.82 3.06 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.085 -1.009 . . . . 0.0 109.727 179.686 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.409 HD11 ' CG ' ' A' ' 24' ' ' ARG . 45.0 mt -48.28 -27.09 2.29 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.493 -0.754 . . . . 0.0 111.287 -179.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.92 -38.73 96.5 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 109.17 -1.572 . . . . 0.0 109.17 179.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -51.7 -39.34 58.14 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.524 -0.986 . . . . 0.0 110.852 -179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 4.0 mmt -72.91 -45.63 57.07 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.617 -0.677 . . . . 0.0 109.516 179.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 51.7 t-105 -52.14 -58.16 7.41 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.671 -0.643 . . . . 0.0 110.771 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 9.0 t -59.35 -32.6 70.26 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.453 -0.779 . . . . 0.0 110.305 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -63.68 -42.33 98.04 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.574 -0.704 . . . . 0.0 109.945 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 68.3 mm-40 -64.43 154.93 34.21 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.651 -0.655 . . . . 0.0 110.404 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 76.2 p -99.31 -150.15 0.37 Allowed 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.94 57.41 3.06 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.203 -0.935 . . . . 0.0 110.15 179.656 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 22.5 tttt -134.99 -43.25 0.73 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.352 -0.842 . . . . 0.0 110.212 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -63.41 -32.29 73.69 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.487 -0.758 . . . . 0.0 110.56 -179.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 28.2 ttpt -91.83 22.97 3.86 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.332 -0.855 . . . . 0.0 111.325 -179.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.46 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 8.0 mm-40 -96.95 -59.98 0.15 Allowed Pre-proline 0 N--CA 1.497 1.881 0 O-C-N 121.103 -0.998 . . . . 0.0 110.843 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.46 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.4 Cg_endo -80.45 -30.29 2.04 Favored 'Trans proline' 0 N--CA 1.486 1.047 0 O-C-N 122.871 0.932 . . . . 0.0 110.897 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.542 ' O ' HD12 ' A' ' 18' ' ' LEU . 3.2 m-85 -82.49 -8.92 59.6 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.492 -0.755 . . . . 0.0 112.01 -178.587 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.57 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -84.3 -25.37 29.34 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.095 -1.003 . . . . 0.0 111.113 -179.331 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -79.09 -21.94 45.96 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.461 -0.774 . . . . 0.0 110.791 -179.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 44.9 tttt -66.0 -44.05 85.92 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.336 -0.853 . . . . 0.0 109.858 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.586 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -79.9 -15.13 57.96 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.534 -0.728 . . . . 0.0 110.134 179.411 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.02 -31.33 69.85 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.269 -0.894 . . . . 0.0 109.42 179.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -74.1 -62.75 1.4 Allowed 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 178.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.459 HD22 ' HG3' ' A' ' 13' ' ' PRO . 0.8 OUTLIER -43.61 -25.36 0.16 Allowed 'General case' 0 N--CA 1.506 2.336 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -179.297 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -65.02 -44.22 89.89 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.223 -0.923 . . . . 0.0 109.169 178.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -66.24 -57.4 7.65 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.755 -0.59 . . . . 0.0 109.787 179.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.7 mptm? -51.31 -31.31 21.12 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.397 -0.815 . . . . 0.0 110.718 -179.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.55 ' O ' HG22 ' A' ' 73' ' ' ILE . 34.8 t80 -75.62 -64.37 1.09 Allowed 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 179.095 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -59.67 -17.81 37.03 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.881 -0.512 . . . . 0.0 111.322 -179.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 21.4 mmmt -99.47 -23.75 15.01 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.169 -0.957 . . . . 0.0 111.45 -179.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -103.95 -28.66 11.43 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.27 -0.894 . . . . 0.0 110.983 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.55 HG22 ' O ' ' A' ' 69' ' ' TYR . 3.1 tp -65.74 -36.02 76.56 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 O-C-N 121.427 -0.796 . . . . 0.0 110.186 -179.655 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.45 -48.48 80.98 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.548 -0.72 . . . . 0.0 109.801 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.52 -22.53 57.05 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.726 -0.609 . . . . 0.0 110.104 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -67.54 -31.39 71.45 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.502 -0.749 . . . . 0.0 109.944 179.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 19.8 mtp85 -107.07 8.4 30.25 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.55 -0.719 . . . . 0.0 110.923 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 55.19 73.83 0.4 Allowed 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.041 -1.037 . . . . 0.0 110.598 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 117.931 -1.033 . . . . 0.0 110.3 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 36.6 ttm . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 121.17 0.51 . . . . 0.0 110.236 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.23 -169.35 2.48 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.52 -0.738 . . . . 0.0 110.149 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.6 tttt 53.99 -168.63 0.06 Allowed 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.424 -0.798 . . . . 0.0 110.611 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.548 ' NZ ' HD23 ' A' ' 65' ' ' LEU . 0.0 OUTLIER -142.67 174.53 10.56 Favored 'General case' 0 C--N 1.307 -1.258 0 O-C-N 121.571 -0.706 . . . . 0.0 110.129 -179.867 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -99.68 156.67 35.1 Favored Pre-proline 0 N--CA 1.494 1.73 0 O-C-N 121.661 -0.649 . . . . 0.0 110.132 -179.85 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -70.99 -21.04 28.29 Favored 'Trans proline' 0 C--N 1.317 -1.098 0 O-C-N 123.392 1.206 . . . . 0.0 110.858 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -96.51 -27.81 14.69 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.465 -0.772 . . . . 0.0 110.132 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -105.88 101.05 31.16 Favored Pre-proline 0 N--CA 1.493 1.713 0 O-C-N 121.501 -0.75 . . . . 0.0 110.156 179.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -71.87 86.63 0.89 Allowed 'Trans proline' 0 C--N 1.317 -1.113 0 O-C-N 123.167 1.088 . . . . 0.0 110.218 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.53 -155.0 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.63 -0.669 . . . . 0.0 110.323 -179.715 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -61.0 133.92 92.67 Favored Pre-proline 0 N--CA 1.497 1.899 0 O-C-N 121.492 -0.755 . . . . 0.0 110.153 -179.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.44 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.8 Cg_endo -76.82 137.72 18.08 Favored 'Trans proline' 0 C--N 1.319 -0.992 0 O-C-N 123.192 1.101 . . . . 0.0 109.847 179.4 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.674 ' CG ' HD21 ' A' ' 18' ' ' LEU . 50.3 Cg_endo -79.29 -169.41 0.79 Allowed 'Trans proline' 0 C--N 1.316 -1.177 0 O-C-N 123.174 1.092 . . . . 0.0 110.154 -179.745 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.509 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 66.5 p -163.0 63.67 0.19 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.439 -0.788 . . . . 0.0 110.92 -179.728 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.509 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 66.49 -78.06 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.002 -1.061 . . . . 0.0 110.518 -179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -48.47 -48.19 37.9 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.351 -0.843 . . . . 0.0 111.447 -179.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -59.78 -33.99 72.42 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.583 -0.698 . . . . 0.0 109.737 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.674 HD21 ' CG ' ' A' ' 13' ' ' PRO . 42.4 mt -72.29 -33.03 67.12 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.707 -0.621 . . . . 0.0 109.488 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.492 ' CZ ' ' CZ ' ' A' ' 23' ' ' TYR . 22.9 t80 -73.3 -52.48 13.76 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.78 -0.575 . . . . 0.0 110.489 -179.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 17.0 p -60.81 -31.79 71.18 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.477 -0.764 . . . . 0.0 110.38 -179.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 91.8 p -71.14 -23.86 62.16 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.781 -0.574 . . . . 0.0 112.111 -178.451 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.9 -24.71 9.39 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.022 -1.049 . . . . 0.0 112.384 -178.611 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.492 ' CZ ' ' CZ ' ' A' ' 19' ' ' PHE . 4.9 m-85 -80.33 -36.93 33.51 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 120.925 -1.109 . . . . 0.0 111.099 -179.207 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.556 ' HG2' HD11 ' A' ' 43' ' ' LEU . 10.3 mtp180 -48.0 -52.91 36.85 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.319 -0.863 . . . . 0.0 112.198 -179.61 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.562 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.2 Cg_endo -59.67 -27.7 85.57 Favored 'Trans proline' 0 N--CA 1.495 1.614 0 O-C-N 123.274 1.144 . . . . 0.0 110.261 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.8 tmtm? -69.63 -45.95 67.33 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 177.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.2 mm -57.77 -29.67 35.72 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.28 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.562 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.4 mmmm -73.09 -35.49 66.63 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 119.968 -0.693 . . . . 0.0 110.571 -177.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 28.9 t -66.27 -22.6 66.31 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.445 -0.784 . . . . 0.0 110.62 -179.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -116.19 -16.06 11.01 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.528 -0.733 . . . . 0.0 111.142 -179.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.692 ' HB3' HD23 ' A' ' 34' ' ' LEU . 44.6 m80 -129.83 94.75 30.76 Favored Pre-proline 0 N--CA 1.497 1.889 0 O-C-N 121.306 -0.871 . . . . 0.0 109.238 179.46 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -74.72 -36.09 3.03 Favored 'Trans proline' 0 C--N 1.316 -1.148 0 O-C-N 123.514 1.27 . . . . 0.0 110.479 -179.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -75.34 -19.17 79.71 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 110.051 -1.22 . . . . 0.0 110.051 179.608 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.692 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -55.11 86.28 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.522 -0.987 . . . . 0.0 111.378 -179.385 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.404 ' N ' ' O ' ' A' ' 33' ' ' GLY . 42.8 t -80.34 171.24 15.32 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.549 -0.719 . . . . 0.0 109.471 179.552 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.44 ' O ' ' HB2' ' A' ' 40' ' ' ALA . 43.3 mm -53.33 -26.2 11.92 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 O-C-N 121.326 -0.859 . . . . 0.0 110.347 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -61.08 -71.77 0.74 Allowed Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.238 -1.545 . . . . 0.0 109.238 179.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.429 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 16.4 t70 -69.32 -28.22 66.06 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.688 -0.889 . . . . 0.0 110.502 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.433 ' OG1' HD12 ' A' ' 34' ' ' LEU . 86.6 m -68.68 -32.27 71.98 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.413 -0.804 . . . . 0.0 109.769 179.437 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.44 ' HB2' ' O ' ' A' ' 36' ' ' ILE . . . -69.89 -39.61 76.14 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 120.073 -0.651 . . . . 0.0 109.484 179.693 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -91.51 -15.12 29.24 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.644 -0.66 . . . . 0.0 111.493 -179.399 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.429 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 30.7 tptt -83.29 1.14 42.5 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.022 -1.049 . . . . 0.0 110.526 179.378 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.556 HD11 ' HG2' ' A' ' 24' ' ' ARG . 25.7 mt -97.45 -35.1 10.77 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.12 -0.987 . . . . 0.0 108.958 178.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.35 -31.98 71.75 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 108.841 -1.704 . . . . 0.0 108.841 179.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -55.35 -47.63 75.45 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.595 -0.944 . . . . 0.0 110.179 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 16.2 mtp -70.61 -48.98 52.43 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 70.0 t-105 -52.92 -58.42 7.01 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.708 -0.62 . . . . 0.0 110.555 179.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 46.6 t -60.76 -34.34 74.31 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.472 -0.767 . . . . 0.0 110.26 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -58.02 -39.11 77.52 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.603 -0.686 . . . . 0.0 110.26 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 57.5 mm-40 -67.54 164.96 17.83 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.592 -0.692 . . . . 0.0 110.075 179.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.1 m -150.09 107.2 3.58 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.544 -0.723 . . . . 0.0 110.17 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 53.01 47.1 25.41 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.347 -0.845 . . . . 0.0 110.655 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.9 mtpt -149.26 -64.76 0.23 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.556 -0.715 . . . . 0.0 109.86 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -59.78 -31.28 69.53 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.5 -0.75 . . . . 0.0 110.562 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 13.4 tttm -96.05 22.36 7.64 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.427 -0.796 . . . . 0.0 111.191 -179.447 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.436 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 1.3 mm-40 -99.1 -55.02 0.18 Allowed Pre-proline 0 N--CA 1.496 1.842 0 O-C-N 121.195 -0.941 . . . . 0.0 110.61 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.436 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.0 Cg_endo -83.73 -36.76 0.18 Allowed 'Trans proline' 0 C--N 1.321 -0.873 0 O-C-N 122.925 0.961 . . . . 0.0 110.825 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -80.6 5.33 15.76 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.539 -0.725 . . . . 0.0 111.787 -179.306 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.492 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -97.8 -20.35 17.59 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.079 -1.013 . . . . 0.0 110.619 179.943 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -77.67 -24.33 49.38 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.441 -0.787 . . . . 0.0 110.364 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.429 ' HD3' HD13 ' A' ' 18' ' ' LEU . 26.4 tttp -58.81 -45.36 90.09 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.409 -0.807 . . . . 0.0 110.027 179.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.7 -10.08 59.24 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.596 -0.69 . . . . 0.0 110.58 179.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -86.31 2.97 45.35 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.253 -0.905 . . . . 0.0 110.503 179.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 24.4 mmtp -105.12 -32.86 8.49 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.231 -0.918 . . . . 0.0 109.462 179.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.548 HD23 ' NZ ' ' A' ' 4' ' ' LYS . 4.8 mp -80.83 4.25 19.8 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.909 -0.494 . . . . 0.0 111.039 179.553 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -97.29 -26.76 14.79 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.141 -0.974 . . . . 0.0 109.926 179.503 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -84.71 -14.52 48.13 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.521 -0.737 . . . . 0.0 110.62 179.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.4 mmtt -103.57 -29.19 11.28 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.309 -0.869 . . . . 0.0 109.711 179.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.548 ' O ' HG22 ' A' ' 73' ' ' ILE . 11.6 t80 -75.26 -53.34 8.95 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.63 -0.669 . . . . 0.0 109.628 179.71 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -63.99 -13.34 45.63 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.618 -0.676 . . . . 0.0 111.494 -179.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.4 mmtm -108.1 -32.42 7.53 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.129 -0.982 . . . . 0.0 110.901 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -89.69 -36.39 15.25 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.443 -0.785 . . . . 0.0 111.281 -179.079 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.548 HG22 ' O ' ' A' ' 69' ' ' TYR . 3.7 tp -65.59 -18.78 24.5 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 O-C-N 121.27 -0.894 . . . . 0.0 110.864 -179.316 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.73 -45.77 70.63 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.296 -0.877 . . . . 0.0 109.858 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -87.03 -26.03 23.93 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.633 -0.667 . . . . 0.0 110.216 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -61.96 -50.04 73.69 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.546 -0.722 . . . . 0.0 110.05 179.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 61.8 mtt-85 -106.04 10.32 32.21 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.54 -0.725 . . . . 0.0 111.034 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 56.63 69.82 0.71 Allowed 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.084 -1.01 . . . . 0.0 110.346 -179.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 1.7 tptt . . . . . 0 N--CA 1.494 1.736 0 CA-C-O 117.936 -1.03 . . . . 0.0 110.244 -179.967 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.0 ttp . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 121.054 0.454 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.26 160.89 17.84 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.595 -0.691 . . . . 0.0 110.217 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 10.2 tttt -169.97 151.66 4.14 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.545 -0.722 . . . . 0.0 110.186 179.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.5 -71.53 0.13 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.585 -0.697 . . . . 0.0 110.423 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -163.65 156.84 16.06 Favored Pre-proline 0 N--CA 1.493 1.715 0 O-C-N 121.583 -0.698 . . . . 0.0 110.202 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.64 -46.32 0.46 Allowed 'Trans proline' 0 C--N 1.316 -1.136 0 O-C-N 123.457 1.241 . . . . 0.0 110.415 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -81.31 2.7 27.02 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.573 -0.704 . . . . 0.0 111.166 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -93.92 142.34 24.9 Favored Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.144 -0.973 . . . . 0.0 110.037 179.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.432 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 53.3 Cg_endo -78.91 87.45 1.55 Allowed 'Trans proline' 0 C--N 1.318 -1.041 0 O-C-N 123.22 1.116 . . . . 0.0 110.282 -179.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -110.0 26.34 10.77 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.465 -0.772 . . . . 0.0 110.98 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.5 ttm180 -159.19 94.61 1.77 Allowed Pre-proline 0 N--CA 1.493 1.681 0 O-C-N 121.734 -0.604 . . . . 0.0 110.488 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -76.98 114.05 3.74 Favored 'Trans proline' 0 C--N 1.317 -1.127 0 O-C-N 123.491 1.259 . . . . 0.0 110.491 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.736 ' CB ' HD21 ' A' ' 18' ' ' LEU . 47.2 Cg_endo -81.04 164.65 19.8 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 O-C-N 123.282 1.149 . . . . 0.0 110.251 179.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.544 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 94.6 p -157.06 53.9 0.51 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.43 -0.794 . . . . 0.0 110.806 -179.677 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.636 ' HB2' ' HA ' ' A' ' 59' ' ' GLU . . . 68.12 -76.57 0.05 Allowed 'General case' 0 N--CA 1.503 2.221 0 O-C-N 121.135 -0.978 . . . . 0.0 109.993 -179.613 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -48.16 -50.62 28.21 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.315 -0.866 . . . . 0.0 111.227 -179.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -57.52 -40.09 77.97 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.596 -0.69 . . . . 0.0 109.528 179.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.736 HD21 ' CB ' ' A' ' 13' ' ' PRO . 49.3 mt -64.43 -44.26 91.74 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.757 -0.589 . . . . 0.0 110.242 179.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -66.3 -51.81 53.59 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.573 -0.705 . . . . 0.0 110.359 -179.538 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.483 ' SG ' HD13 ' A' ' 43' ' ' LEU . 48.1 t -66.77 -21.39 66.06 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.579 -0.7 . . . . 0.0 110.299 179.582 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.9 m -73.57 -20.63 60.57 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.383 -0.823 . . . . 0.0 111.728 -179.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -127.15 -14.28 5.48 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.017 -1.052 . . . . 0.0 112.972 -178.456 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -88.69 16.02 7.33 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 120.774 -1.204 . . . . 0.0 111.73 -178.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.531 ' HG2' HD11 ' A' ' 43' ' ' LEU . 33.2 mtp180 -92.16 -44.27 0.35 Allowed Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.197 -0.939 . . . . 0.0 112.543 179.615 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.572 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.1 Cg_endo -66.82 -15.15 46.4 Favored 'Trans proline' 0 N--CA 1.49 1.307 0 O-C-N 122.917 0.956 . . . . 0.0 110.382 -179.299 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.76 -54.28 8.42 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 177.531 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 38.2 mm -51.2 -26.02 4.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.985 0 O-C-N 121.89 -0.507 . . . . 0.0 110.738 179.381 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.572 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 6.8 mmmm -78.22 -31.71 49.46 Favored 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 119.84 -0.744 . . . . 0.0 110.014 -177.853 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 15.1 t -67.09 -21.96 65.84 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.563 -0.711 . . . . 0.0 110.525 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -119.54 -13.67 9.18 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.384 -0.822 . . . . 0.0 111.282 -179.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.766 ' HB3' HD23 ' A' ' 34' ' ' LEU . 38.1 m80 -130.63 94.75 28.38 Favored Pre-proline 0 N--CA 1.497 1.899 0 O-C-N 121.19 -0.944 . . . . 0.0 109.502 179.453 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -75.25 -35.45 2.96 Favored 'Trans proline' 0 C--N 1.316 -1.173 0 O-C-N 123.575 1.303 . . . . 0.0 110.061 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.15 -15.33 81.5 Favored Glycine 0 N--CA 1.489 2.23 0 N-CA-C 110.073 -1.211 . . . . 0.0 110.073 179.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.766 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.3 OUTLIER -56.62 87.78 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.327 -1.102 . . . . 0.0 110.887 -179.611 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 80.1 p -79.91 169.19 18.25 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.594 -0.691 . . . . 0.0 109.56 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 36.9 mm -50.01 -27.02 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.237 0 O-C-N 121.449 -0.782 . . . . 0.0 110.379 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.452 ' O ' ' HD3' ' A' ' 41' ' ' LYS . . . -58.95 -68.78 1.52 Allowed Glycine 0 N--CA 1.489 2.211 0 N-CA-C 109.135 -1.586 . . . . 0.0 109.135 179.554 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -78.09 -15.97 58.41 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.719 -0.871 . . . . 0.0 111.876 -179.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.6 ' HA ' HD12 ' A' ' 34' ' ' LEU . 51.2 m -61.49 -40.88 96.18 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.023 -1.048 . . . . 0.0 109.277 179.545 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.58 -37.69 87.4 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.32 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.452 ' HD3' ' O ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -70.15 -31.72 69.35 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.789 -0.57 . . . . 0.0 110.133 -179.481 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.51 -11.75 60.55 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.26 -0.9 . . . . 0.0 110.515 179.683 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.531 HD11 ' HG2' ' A' ' 24' ' ' ARG . 77.2 mt -97.04 -27.87 14.41 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.301 -0.874 . . . . 0.0 110.172 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -89.63 -46.34 4.32 Favored Glycine 0 N--CA 1.493 2.472 0 N-CA-C 109.629 -1.389 . . . . 0.0 109.629 -179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -51.43 -31.9 24.62 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.388 -1.066 . . . . 0.0 110.825 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 75.7 mtp -87.77 -41.47 13.27 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.563 -0.711 . . . . 0.0 109.817 179.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 76.7 t-105 -57.2 -22.2 38.99 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.609 -0.682 . . . . 0.0 110.804 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -94.04 -35.67 12.48 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.381 -0.825 . . . . 0.0 110.131 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -61.38 -34.23 74.98 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.524 -0.735 . . . . 0.0 109.968 179.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -58.04 150.2 21.52 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.572 -0.705 . . . . 0.0 110.507 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 17.1 t -89.43 -151.63 0.23 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.616 -0.678 . . . . 0.0 109.588 179.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -84.01 54.66 3.0 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.249 -0.907 . . . . 0.0 110.181 179.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 44.4 mttp -136.87 -41.59 0.6 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.473 -0.767 . . . . 0.0 110.435 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -62.31 -37.45 85.63 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.522 -0.736 . . . . 0.0 110.388 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -96.28 20.41 10.45 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.371 -0.83 . . . . 0.0 110.918 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.469 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 3.7 mt-30 -88.33 -59.03 0.26 Allowed Pre-proline 0 N--CA 1.496 1.867 0 O-C-N 121.165 -0.959 . . . . 0.0 109.759 179.571 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.469 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 57.3 Cg_endo -81.58 -23.89 4.63 Favored 'Trans proline' 0 C--N 1.32 -0.971 0 O-C-N 122.99 0.995 . . . . 0.0 110.353 179.013 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -81.56 -20.31 40.19 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.59 -0.694 . . . . 0.0 111.827 -178.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.636 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -82.37 -22.06 35.63 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.145 -0.972 . . . . 0.0 110.79 -179.564 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -84.02 -24.09 30.65 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.379 -0.825 . . . . 0.0 110.422 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -62.39 -47.29 84.78 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.44 -0.787 . . . . 0.0 109.778 179.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.643 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -74.53 -9.44 58.58 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.595 -0.691 . . . . 0.0 110.916 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.64 -0.61 55.58 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.3 -0.875 . . . . 0.0 110.283 179.015 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 47.7 mmtt -105.48 -29.18 10.37 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.21 -0.931 . . . . 0.0 109.943 179.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.2 mp -86.85 -14.23 42.66 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.963 -0.461 . . . . 0.0 110.031 178.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.8 tptt -76.3 -30.35 57.7 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.284 -0.885 . . . . 0.0 109.469 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -67.42 -59.72 3.16 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.651 -0.655 . . . . 0.0 109.484 179.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.9 mmpt? -60.25 -25.71 65.88 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.641 -0.662 . . . . 0.0 110.511 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.633 ' O ' HG22 ' A' ' 73' ' ' ILE . 21.4 t80 -71.5 -65.14 0.79 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.37 -0.831 . . . . 0.0 109.255 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -61.29 -17.5 53.86 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.836 -0.54 . . . . 0.0 111.082 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -98.62 -20.83 16.78 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.283 -0.885 . . . . 0.0 111.568 -179.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -106.36 -32.69 8.03 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.23 -0.919 . . . . 0.0 111.064 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.633 HG22 ' O ' ' A' ' 69' ' ' TYR . 8.4 tp -65.72 -30.58 50.54 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 O-C-N 121.419 -0.801 . . . . 0.0 110.372 -179.573 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.9 -58.24 8.69 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.611 -0.681 . . . . 0.0 109.964 179.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.37 -19.84 65.91 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.572 -0.705 . . . . 0.0 110.399 179.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -74.51 -38.78 62.73 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.372 -0.83 . . . . 0.0 110.125 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 8.9 mtt180 -71.42 -81.05 0.05 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.559 -0.713 . . . . 0.0 110.036 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -168.92 38.17 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.285 -0.884 . . . . 0.0 110.066 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.6 mtmm . . . . . 0 N--CA 1.494 1.772 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.196 -179.921 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 37.8 ttm . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 121.099 0.476 . . . . 0.0 110.187 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.9 mttm -133.11 26.61 4.22 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.578 -0.701 . . . . 0.0 110.397 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.4 tttt -65.02 -162.0 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.58 -0.7 . . . . 0.0 110.223 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.2 mtpt -144.72 -146.86 0.2 Allowed 'General case' 0 N--CA 1.485 1.283 0 O-C-N 121.626 -0.671 . . . . 0.0 109.239 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -92.33 163.22 27.61 Favored Pre-proline 0 N--CA 1.493 1.684 0 O-C-N 121.088 -1.008 . . . . 0.0 110.208 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -73.06 -29.52 11.74 Favored 'Trans proline' 0 C--N 1.317 -1.13 0 O-C-N 123.452 1.238 . . . . 0.0 110.495 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 18.3 p-10 -101.81 29.34 5.02 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.606 -0.683 . . . . 0.0 110.275 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -100.11 134.78 20.62 Favored Pre-proline 0 N--CA 1.494 1.726 0 O-C-N 121.646 -0.659 . . . . 0.0 110.178 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -72.84 69.5 3.69 Favored 'Trans proline' 0 C--N 1.318 -1.042 0 O-C-N 123.209 1.11 . . . . 0.0 110.008 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 35.87 -156.49 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.324 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 178.596 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -108.43 153.92 41.78 Favored Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.583 -0.698 . . . . 0.0 109.483 179.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -73.15 113.96 3.91 Favored 'Trans proline' 0 C--N 1.316 -1.155 0 O-C-N 123.316 1.166 . . . . 0.0 110.803 -179.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.739 ' HB2' HD21 ' A' ' 18' ' ' LEU . 49.9 Cg_endo -82.98 173.18 10.34 Favored 'Trans proline' 0 C--N 1.318 -1.045 0 O-C-N 123.37 1.194 . . . . 0.0 110.122 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.513 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 42.2 t -165.4 63.33 0.12 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.492 -0.755 . . . . 0.0 110.616 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.513 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 66.64 -77.25 0.04 OUTLIER 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.114 -0.991 . . . . 0.0 110.361 -179.78 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 10.6 t80 -47.7 -49.49 27.66 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.302 -0.874 . . . . 0.0 111.401 -179.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -59.07 -35.86 74.08 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.616 -0.677 . . . . 0.0 109.945 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.739 HD21 ' HB2' ' A' ' 13' ' ' PRO . 23.0 mt -74.27 -32.62 62.99 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.624 -0.673 . . . . 0.0 110.323 -179.599 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.422 ' CE1' ' CZ ' ' A' ' 23' ' ' TYR . 68.1 t80 -79.65 -55.26 5.15 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.498 -0.751 . . . . 0.0 110.647 -179.363 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.9 t -57.15 -54.58 45.13 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.526 -0.734 . . . . 0.0 110.686 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.1 t -55.74 -22.49 24.13 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.438 -0.788 . . . . 0.0 110.982 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 41.1 mm-40 -100.93 -25.1 14.2 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.406 -0.809 . . . . 0.0 110.936 -179.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.435 ' O ' HD21 ' A' ' 43' ' ' LEU . 10.9 m-85 -96.71 12.43 31.94 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.395 -0.815 . . . . 0.0 111.522 -179.376 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.524 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 50.9 mtt180 -87.04 -45.02 0.53 Allowed Pre-proline 0 N--CA 1.489 1.482 0 O-C-N 121.226 -0.921 . . . . 0.0 112.164 179.538 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.591 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.1 Cg_endo -66.71 -15.67 48.11 Favored 'Trans proline' 0 N--CA 1.49 1.308 0 O-C-N 122.89 0.942 . . . . 0.0 110.484 -179.231 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -72.88 -50.19 25.32 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 177.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 28.0 mm -54.62 -32.96 26.15 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 CA-C-O 121.377 0.608 . . . . 0.0 110.288 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.591 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.0 mmmm -72.3 -36.59 68.98 Favored 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.3 -177.149 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.8 t -60.02 -25.76 65.56 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.551 -0.718 . . . . 0.0 110.661 -179.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -115.35 -22.73 9.22 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.545 -0.722 . . . . 0.0 110.766 -179.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.756 ' HB3' HD23 ' A' ' 34' ' ' LEU . 39.2 m80 -121.41 96.07 48.01 Favored Pre-proline 0 N--CA 1.496 1.865 0 O-C-N 121.485 -0.76 . . . . 0.0 109.596 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -75.21 -31.17 6.16 Favored 'Trans proline' 0 C--N 1.315 -1.221 0 O-C-N 123.393 1.207 . . . . 0.0 110.344 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.409 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -80.38 -16.37 76.23 Favored Glycine 0 N--CA 1.489 2.193 0 N-CA-C 110.298 -1.121 . . . . 0.0 110.298 179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.756 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -59.16 82.64 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.255 0 O-C-N 121.408 -1.054 . . . . 0.0 111.222 -179.356 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.409 ' N ' ' O ' ' A' ' 33' ' ' GLY . 71.8 m -69.55 172.43 7.34 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.479 -0.763 . . . . 0.0 109.701 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.556 ' H ' HD12 ' A' ' 36' ' ' ILE . 2.5 mp -56.15 -28.39 25.33 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.108 0 O-C-N 121.273 -0.892 . . . . 0.0 109.735 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.79 -65.34 3.39 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 109.235 -1.546 . . . . 0.0 109.235 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.591 ' HB3' HD13 ' A' ' 34' ' ' LEU . 7.9 t0 -70.02 -30.82 68.22 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.604 -0.939 . . . . 0.0 110.466 179.642 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.442 ' HB ' ' HA ' ' A' ' 36' ' ' ILE . 54.7 m -63.97 -30.66 71.72 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.494 -0.754 . . . . 0.0 109.96 179.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.78 -43.29 47.19 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.562 -0.711 . . . . 0.0 110.118 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.419 ' HG2' ' HA ' ' A' ' 38' ' ' ASP . 0.5 OUTLIER -87.72 -10.02 52.38 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.62 -0.675 . . . . 0.0 111.695 -179.525 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.42 -60.99 2.11 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.05 -1.031 . . . . 0.0 109.683 179.571 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.435 HD21 ' O ' ' A' ' 23' ' ' TYR . 21.8 mt -49.23 -25.66 2.43 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.518 -0.739 . . . . 0.0 111.378 -179.719 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -66.28 -36.89 92.34 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 109.365 -1.494 . . . . 0.0 109.365 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -51.92 -34.61 42.35 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.474 -1.015 . . . . 0.0 111.016 -179.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 7.6 mtt -85.14 -43.01 14.23 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.495 -0.753 . . . . 0.0 109.998 179.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . 0.444 ' CH2' ' HG2' ' A' ' 55' ' ' LYS . 64.4 t-105 -51.19 -36.69 42.58 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.528 -0.733 . . . . 0.0 111.174 -179.532 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 6.9 t -85.53 -27.8 25.34 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.438 -0.789 . . . . 0.0 110.117 179.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -58.63 -39.04 79.39 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.479 -0.763 . . . . 0.0 110.113 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.28 167.33 16.58 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.58 -0.7 . . . . 0.0 109.749 179.523 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.4 m -146.57 101.39 3.46 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.608 -0.683 . . . . 0.0 110.498 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 51.51 48.55 22.71 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.409 -0.807 . . . . 0.0 110.969 179.724 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 14.1 tttp -141.6 -65.57 0.42 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.553 -0.717 . . . . 0.0 110.236 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -64.48 -24.88 67.77 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.524 -0.735 . . . . 0.0 110.721 -179.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.444 ' HG2' ' CH2' ' A' ' 47' ' ' TRP . 39.9 mtpt -80.45 -35.14 35.34 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.476 -0.765 . . . . 0.0 110.759 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -46.4 -53.22 24.88 Favored Pre-proline 0 N--CA 1.505 2.303 0 O-C-N 121.51 -0.744 . . . . 0.0 112.021 -179.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -77.62 -39.98 0.47 Allowed 'Trans proline' 0 C--N 1.314 -1.257 0 O-C-N 123.171 1.09 . . . . 0.0 110.956 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -80.21 5.33 14.86 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.453 -0.779 . . . . 0.0 112.07 -178.404 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.32 -18.68 16.68 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.876 -1.14 . . . . 0.0 110.727 179.466 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -79.86 -28.12 40.02 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.261 -0.9 . . . . 0.0 110.224 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.4 ' CG ' HD13 ' A' ' 18' ' ' LEU . 45.6 tttm -60.25 -41.24 92.77 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.544 -0.722 . . . . 0.0 110.097 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.443 ' HB2' ' H ' ' A' ' 15' ' ' ALA . . . -69.05 -10.93 60.03 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.596 -0.69 . . . . 0.0 110.817 179.591 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -90.27 6.17 44.04 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.122 -0.986 . . . . 0.0 110.634 179.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -106.2 -36.94 6.73 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.254 -0.903 . . . . 0.0 109.028 178.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.739 HD22 ' HG3' ' A' ' 13' ' ' PRO . 6.8 mp -76.85 -0.08 22.75 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.912 -0.493 . . . . 0.0 111.07 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 19.1 tttm -91.3 -22.83 20.35 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.062 -1.024 . . . . 0.0 110.005 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -84.02 -16.16 44.94 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.475 -0.765 . . . . 0.0 110.522 179.55 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.9 mppt? -102.2 -27.57 12.8 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.307 -0.871 . . . . 0.0 109.981 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.544 ' O ' HG22 ' A' ' 73' ' ' ILE . 17.0 t80 -78.05 -51.05 10.92 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.62 -0.675 . . . . 0.0 109.799 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -60.67 -15.53 29.68 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.783 -0.573 . . . . 0.0 111.419 -179.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -107.3 -30.47 8.7 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.092 -1.005 . . . . 0.0 110.056 179.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -86.14 -31.27 21.92 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.559 -0.713 . . . . 0.0 110.488 -179.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.544 HG22 ' O ' ' A' ' 69' ' ' TYR . 6.0 tp -66.36 -29.48 46.76 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.539 -0.725 . . . . 0.0 109.993 -179.905 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -50.63 -32.77 19.94 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.603 -0.686 . . . . 0.0 110.749 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -76.08 -8.0 56.0 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.609 -0.682 . . . . 0.0 110.568 179.282 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -105.77 -2.68 22.91 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.238 -0.914 . . . . 0.0 110.713 179.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 13.3 mtt180 -119.64 -29.02 5.16 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.31 -0.869 . . . . 0.0 110.771 -179.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 52.83 74.85 0.27 Allowed 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.206 -0.934 . . . . 0.0 110.724 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.791 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.293 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.9 ttp . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 121.121 0.486 . . . . 0.0 110.187 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.5 mttm -89.02 178.89 6.28 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.576 -0.703 . . . . 0.0 110.291 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt 52.79 94.55 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.494 -0.754 . . . . 0.0 110.784 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 46.2 mttm -60.02 -70.62 0.16 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.696 -0.627 . . . . 0.0 110.389 -179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.527 ' HB2' ' HB3' ' A' ' 8' ' ' ALA . 4.3 m-20 -118.24 165.98 14.94 Favored Pre-proline 0 N--CA 1.494 1.736 0 O-C-N 121.62 -0.675 . . . . 0.0 110.354 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.52 -20.79 23.21 Favored 'Trans proline' 0 C--N 1.317 -1.116 0 O-C-N 123.426 1.224 . . . . 0.0 110.809 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -105.6 -24.64 12.53 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.399 -0.813 . . . . 0.0 110.322 179.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.604 ' HB2' ' CZ ' ' A' ' 76' ' ' TYR . . . -81.08 141.63 50.61 Favored Pre-proline 0 N--CA 1.493 1.721 0 O-C-N 121.517 -0.739 . . . . 0.0 110.114 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -74.24 138.24 24.75 Favored 'Trans proline' 0 C--N 1.317 -1.108 0 O-C-N 123.299 1.157 . . . . 0.0 110.27 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.31 -165.98 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.522 -0.736 . . . . 0.0 109.993 179.823 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -70.57 145.8 93.08 Favored Pre-proline 0 N--CA 1.496 1.874 0 O-C-N 121.429 -0.795 . . . . 0.0 110.207 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.438 ' HD3' ' CZ ' ' A' ' 69' ' ' TYR . 47.8 Cg_endo -76.25 128.85 10.8 Favored 'Trans proline' 0 C--N 1.318 -1.04 0 O-C-N 123.342 1.18 . . . . 0.0 109.993 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.589 ' CB ' HD21 ' A' ' 18' ' ' LEU . 49.1 Cg_endo -81.65 -175.82 2.77 Favored 'Trans proline' 0 C--N 1.318 -1.048 0 O-C-N 123.24 1.126 . . . . 0.0 110.181 -179.842 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.558 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 33.6 t -168.74 56.77 0.05 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.53 -0.731 . . . . 0.0 110.628 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.558 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 70.32 -76.92 0.06 Allowed 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.15 -0.969 . . . . 0.0 110.198 -179.515 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -49.19 -49.81 40.98 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.228 -0.92 . . . . 0.0 111.058 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -57.88 -37.72 74.47 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.604 -0.685 . . . . 0.0 109.457 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.773 HD11 ' HB2' ' A' ' 62' ' ' ALA . 56.3 mt -67.06 -45.48 77.24 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.725 -0.609 . . . . 0.0 109.992 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.405 ' HB2' ' CZ3' ' A' ' 47' ' ' TRP . 46.4 t80 -63.58 -50.17 70.5 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.541 -0.724 . . . . 0.0 109.728 179.826 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.9 t -62.87 -29.38 70.71 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 120.05 -0.66 . . . . 0.0 109.597 179.309 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.404 ' HG ' ' HA ' ' A' ' 18' ' ' LEU . 65.4 p -95.26 14.74 21.29 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.627 -0.671 . . . . 0.0 111.034 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -139.51 -5.02 1.41 Allowed 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.137 -0.977 . . . . 0.0 111.965 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -121.19 -29.22 4.56 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.902 -1.124 . . . . 0.0 110.895 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.746 ' HG2' HD11 ' A' ' 43' ' ' LEU . 5.9 mtt180 -47.64 -53.28 31.75 Favored Pre-proline 0 N--CA 1.498 1.944 0 O-C-N 121.284 -0.885 . . . . 0.0 112.491 -179.506 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.533 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 35.3 Cg_endo -58.61 -27.74 83.79 Favored 'Trans proline' 0 N--CA 1.495 1.611 0 O-C-N 123.188 1.099 . . . . 0.0 110.202 -179.594 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.1 tmtt? -69.23 -45.73 69.11 Favored 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 177.505 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.9 mm -60.4 -17.46 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.847 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.533 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 8.2 mmmm -86.89 -27.37 23.46 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.078 -1.014 . . . . 0.0 110.39 -177.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 6.6 t -70.11 -14.32 62.6 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.425 -0.797 . . . . 0.0 110.992 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -133.26 2.47 3.57 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.14 -0.975 . . . . 0.0 111.784 -179.551 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.634 ' HB3' HD23 ' A' ' 34' ' ' LEU . 31.5 m80 -142.39 93.46 7.1 Favored Pre-proline 0 N--CA 1.498 1.927 0 O-C-N 121.073 -1.017 . . . . 0.0 109.298 179.029 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -75.0 -33.98 4.18 Favored 'Trans proline' 0 C--N 1.315 -1.204 0 O-C-N 123.52 1.274 . . . . 0.0 110.29 -179.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.407 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -72.48 -30.93 63.73 Favored Glycine 0 N--CA 1.487 2.076 0 N-CA-C 109.304 -1.518 . . . . 0.0 109.304 179.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.634 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.3 OUTLIER -46.01 90.65 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.76 -0.847 . . . . 0.0 111.925 -179.487 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.407 ' N ' ' O ' ' A' ' 33' ' ' GLY . 22.8 t -88.72 170.94 10.35 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.558 -0.714 . . . . 0.0 109.596 179.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.618 ' H ' HD12 ' A' ' 36' ' ' ILE . 3.2 mp -53.12 -24.63 8.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.073 0 O-C-N 121.372 -0.83 . . . . 0.0 110.26 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.3 -66.4 2.62 Favored Glycine 0 N--CA 1.493 2.467 0 N-CA-C 108.958 -1.657 . . . . 0.0 108.958 179.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.45 ' HA ' ' HG2' ' A' ' 41' ' ' LYS . 6.1 t70 -75.16 -28.29 60.04 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.755 -0.85 . . . . 0.0 110.216 179.486 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.559 ' O ' HD12 ' A' ' 43' ' ' LEU . 88.3 m -68.87 -28.51 66.78 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.573 -0.704 . . . . 0.0 110.347 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -79.6 -25.37 41.51 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.453 -0.78 . . . . 0.0 109.975 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.45 ' HG2' ' HA ' ' A' ' 38' ' ' ASP . 3.3 ptpt -105.17 -11.94 16.33 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.617 -0.677 . . . . 0.0 111.014 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 9.4 tptt -84.77 -10.76 56.9 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.026 -1.046 . . . . 0.0 110.483 179.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.746 HD11 ' HG2' ' A' ' 24' ' ' ARG . 28.8 mt -90.16 -31.99 16.83 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.331 -0.856 . . . . 0.0 109.294 179.096 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.53 -32.3 71.3 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 108.717 -1.753 . . . . 0.0 108.717 179.119 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -55.96 -40.05 72.67 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.62 -0.929 . . . . 0.0 110.576 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 9.2 mmt -78.73 -46.09 19.74 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.568 -0.708 . . . . 0.0 110.209 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . 0.551 ' CZ2' ' HB1' ' A' ' 15' ' ' ALA . 67.1 t-105 -59.95 -17.3 36.89 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.543 -0.723 . . . . 0.0 111.245 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 17.6 t -103.48 -37.72 7.47 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.226 -0.921 . . . . 0.0 111.575 -179.095 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -75.12 -32.89 61.51 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.284 -0.885 . . . . 0.0 111.745 -178.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.401 ' CB ' ' HB2' ' A' ' 54' ' ' ASP . 13.5 mm-40 -59.27 156.78 11.86 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.21 -0.931 . . . . 0.0 110.919 -179.031 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 77.2 p -77.87 -137.8 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 179.161 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -90.5 36.1 0.89 Allowed 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.854 -1.154 . . . . 0.0 110.795 179.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 11.6 mptt -116.11 -35.56 4.35 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.359 -0.838 . . . . 0.0 109.67 179.483 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.401 ' HB2' ' CB ' ' A' ' 50' ' ' GLN . 1.3 t70 -92.92 53.66 2.04 Favored 'General case' 0 N--CA 1.497 1.886 0 N-CA-C 108.485 -0.932 . . . . 0.0 108.485 178.399 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.433 ' HG2' ' CE2' ' A' ' 47' ' ' TRP . 0.0 OUTLIER -173.01 -65.18 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 179.696 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.406 ' CB ' ' CD ' ' A' ' 57' ' ' PRO . 0.3 OUTLIER -40.2 -58.05 2.53 Favored Pre-proline 0 N--CA 1.506 2.346 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -179.253 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.406 ' CD ' ' CB ' ' A' ' 56' ' ' GLN . 42.4 Cg_endo -67.37 -32.38 32.6 Favored 'Trans proline' 0 N--CA 1.488 1.16 0 O-C-N 123.072 1.038 . . . . 0.0 110.833 -179.285 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.53 ' O ' HD12 ' A' ' 18' ' ' LEU . 13.6 m-85 -82.99 -14.18 54.53 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.5 -0.75 . . . . 0.0 110.69 179.578 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.437 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 29.0 mm-40 -77.9 -64.03 1.25 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.348 -0.845 . . . . 0.0 110.132 -179.757 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -53.05 -23.52 7.84 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.548 -0.72 . . . . 0.0 111.366 -179.486 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 66.4 tttt -63.08 -48.73 77.37 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.465 -0.772 . . . . 0.0 110.13 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.773 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -78.05 -16.31 58.16 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.559 -0.713 . . . . 0.0 110.176 179.187 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.7 -35.08 77.0 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.428 -0.795 . . . . 0.0 110.454 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 67.5 mmtt -74.58 -63.41 1.25 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.322 -0.861 . . . . 0.0 110.102 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.459 ' H ' HD12 ' A' ' 65' ' ' LEU . 4.0 mp -45.59 -26.59 0.62 Allowed 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.599 -0.688 . . . . 0.0 111.882 -179.406 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 32.4 tptt -65.68 -45.08 84.21 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.324 -0.86 . . . . 0.0 109.507 179.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 15.6 tt0 -66.17 -55.16 17.73 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.665 -0.647 . . . . 0.0 110.121 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 5.9 mptt -55.0 -31.49 61.06 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.466 -0.771 . . . . 0.0 110.485 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.545 ' O ' HG22 ' A' ' 73' ' ' ILE . 76.5 t80 -75.92 -68.64 0.56 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.538 -0.726 . . . . 0.0 109.674 179.621 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -48.73 -28.45 3.62 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.687 -0.633 . . . . 0.0 111.284 -179.612 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.2 mmmt -86.22 -57.72 2.91 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.6 -0.687 . . . . 0.0 110.545 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -62.88 -30.92 71.9 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.504 -0.747 . . . . 0.0 110.968 -179.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.545 HG22 ' O ' ' A' ' 69' ' ' TYR . 2.7 tp -72.12 -35.6 53.88 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 O-C-N 121.419 -0.8 . . . . 0.0 110.496 -179.475 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.6 -42.52 78.89 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.441 -0.787 . . . . 0.0 110.493 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.33 -11.52 54.45 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.631 -0.668 . . . . 0.0 110.821 179.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.604 ' CZ ' ' HB2' ' A' ' 8' ' ' ALA . 71.5 t80 -79.35 -26.34 42.12 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.241 -0.912 . . . . 0.0 110.426 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 50.1 mtt180 -101.79 2.35 38.26 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.531 -0.731 . . . . 0.0 111.282 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 51.8 95.61 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.95 -1.094 . . . . 0.0 111.01 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.7 ptmt . . . . . 0 N--CA 1.493 1.723 0 CA-C-O 118.028 -0.986 . . . . 0.0 110.354 179.889 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.7 ttt . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.01 0.433 . . . . 0.0 110.188 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 3.1 mttm -106.87 94.99 5.41 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.62 -0.675 . . . . 0.0 110.222 179.918 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 71.1 tttt -170.19 132.68 1.07 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.456 -0.778 . . . . 0.0 110.247 179.926 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 38.6 mtpt -60.08 -72.28 0.11 Allowed 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.557 -0.714 . . . . 0.0 110.352 -179.96 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -163.91 157.47 15.96 Favored Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.59 -0.693 . . . . 0.0 110.34 -179.913 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -73.2 -37.87 3.1 Favored 'Trans proline' 0 C--N 1.317 -1.095 0 O-C-N 123.432 1.228 . . . . 0.0 110.444 179.929 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 -79.21 -20.59 47.93 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.591 -0.693 . . . . 0.0 110.817 -179.491 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -99.38 135.26 20.74 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.379 -0.826 . . . . 0.0 109.729 179.521 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -72.05 108.59 2.5 Favored 'Trans proline' 0 C--N 1.319 -1.001 0 O-C-N 123.144 1.076 . . . . 0.0 110.561 -179.69 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -166.2 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.484 -0.76 . . . . 0.0 110.018 179.94 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.72 141.24 92.69 Favored Pre-proline 0 N--CA 1.497 1.913 0 O-C-N 121.509 -0.745 . . . . 0.0 109.938 179.943 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -74.37 132.56 16.46 Favored 'Trans proline' 0 C--N 1.317 -1.099 0 O-C-N 123.309 1.163 . . . . 0.0 109.972 179.786 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.473 ' CB ' HD21 ' A' ' 18' ' ' LEU . 49.5 Cg_endo -81.12 -173.15 1.72 Allowed 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.184 1.097 . . . . 0.0 110.004 -179.737 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.555 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 31.1 t -167.98 59.41 0.07 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.41 -0.806 . . . . 0.0 110.549 -179.898 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.555 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 69.43 -75.76 0.07 Allowed 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.256 -0.902 . . . . 0.0 110.303 -179.527 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -47.3 -52.53 16.05 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.323 -0.861 . . . . 0.0 111.439 -179.388 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -58.1 -39.98 80.01 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.578 -0.701 . . . . 0.0 109.656 179.666 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.477 HD11 ' HB2' ' A' ' 62' ' ' ALA . 51.4 mt -62.32 -45.41 93.33 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.646 -0.659 . . . . 0.0 109.84 179.833 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.497 ' CZ ' ' CE2' ' A' ' 23' ' ' TYR . 43.0 t80 -68.48 -51.62 41.39 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.757 -0.59 . . . . 0.0 110.421 -179.649 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.6 m -56.4 -54.98 39.21 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.523 -0.735 . . . . 0.0 110.813 -179.613 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 88.7 p -57.42 -30.09 64.68 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.466 -0.771 . . . . 0.0 110.856 -179.666 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 -89.95 -23.55 21.52 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.475 -0.766 . . . . 0.0 111.302 -179.29 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.497 ' CE2' ' CZ ' ' A' ' 19' ' ' PHE . 9.0 m-85 -96.02 -34.25 11.83 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.352 -0.842 . . . . 0.0 110.927 -179.423 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.518 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 29.8 mtt-85 -48.28 -53.02 37.72 Favored Pre-proline 0 N--CA 1.498 1.959 0 O-C-N 121.376 -0.828 . . . . 0.0 112.109 -179.881 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.587 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.1 Cg_endo -59.38 -28.61 88.03 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 O-C-N 123.218 1.115 . . . . 0.0 110.155 179.968 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 12.0 tmtt? -68.89 -45.2 71.54 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 177.918 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 47.4 mm -58.93 -27.4 35.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.233 179.755 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.587 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.6 mmmm -75.66 -35.23 60.46 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 119.789 -0.765 . . . . 0.0 110.214 -177.53 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 13.4 t -64.94 -21.39 66.82 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.444 -0.785 . . . . 0.0 110.591 179.932 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -121.42 -10.36 8.89 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.307 -0.871 . . . . 0.0 111.415 -179.56 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.716 ' HB3' HD23 ' A' ' 34' ' ' LEU . 41.4 m80 -134.36 94.2 17.98 Favored Pre-proline 0 N--CA 1.497 1.911 0 O-C-N 121.227 -0.92 . . . . 0.0 109.449 179.175 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -74.95 -32.63 5.29 Favored 'Trans proline' 0 C--N 1.315 -1.198 0 O-C-N 123.531 1.28 . . . . 0.0 110.193 -179.679 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.411 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -76.36 -23.11 71.69 Favored Glycine 0 N--CA 1.488 2.118 0 N-CA-C 109.767 -1.333 . . . . 0.0 109.767 179.674 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.716 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.6 OUTLIER -54.78 86.01 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.696 -0.885 . . . . 0.0 111.37 -179.548 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.411 ' N ' ' O ' ' A' ' 33' ' ' GLY . 75.7 m -77.6 172.09 13.92 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.466 -0.771 . . . . 0.0 109.523 179.573 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 42.2 mm -52.74 -30.02 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.133 0 O-C-N 121.31 -0.868 . . . . 0.0 110.322 -179.934 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.98 -66.64 2.55 Favored Glycine 0 N--CA 1.491 2.332 0 N-CA-C 109.197 -1.561 . . . . 0.0 109.197 179.7 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.409 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 1.2 m-20 -69.87 -31.41 69.22 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.622 -0.928 . . . . 0.0 110.381 179.639 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 91.1 m -65.26 -31.35 72.46 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.403 -0.81 . . . . 0.0 110.0 179.514 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.89 -42.63 48.55 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.551 -0.718 . . . . 0.0 110.303 179.973 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.4 ' HG2' ' HA ' ' A' ' 38' ' ' ASP . 0.6 OUTLIER -88.2 -12.58 43.41 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.522 -0.736 . . . . 0.0 111.853 -179.284 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.409 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 9.7 tptt -77.73 -58.86 3.04 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 120.941 -1.099 . . . . 0.0 109.869 179.694 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.414 HD22 ' HB3' ' A' ' 23' ' ' TYR . 39.9 mt -48.11 -28.27 2.81 Favored 'General case' 0 N--CA 1.504 2.229 0 O-C-N 121.528 -0.732 . . . . 0.0 111.184 -179.579 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -64.56 -37.58 94.59 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.236 -1.545 . . . . 0.0 109.236 179.6 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -49.42 -34.98 17.81 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.551 -0.97 . . . . 0.0 111.225 -179.639 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 7.9 mmt -89.63 -36.64 15.16 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.578 -0.701 . . . . 0.0 110.112 179.763 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . 0.439 ' CZ2' ' HG2' ' A' ' 55' ' ' LYS . 73.6 t-105 -65.27 -12.29 50.06 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.603 -0.686 . . . . 0.0 111.254 -179.596 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 27.8 t -99.94 -42.7 6.67 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.109 -0.994 . . . . 0.0 110.781 -179.684 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -66.13 -29.21 69.47 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.441 -0.787 . . . . 0.0 110.493 -179.696 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -58.37 150.36 22.39 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.506 -0.746 . . . . 0.0 110.309 179.902 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 8.4 t -94.13 -154.08 0.4 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.612 -0.68 . . . . 0.0 109.684 179.75 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -86.19 52.32 2.46 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.361 -0.837 . . . . 0.0 110.028 179.624 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 22.4 mttp -127.63 -46.89 1.42 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.544 -0.722 . . . . 0.0 110.302 -179.855 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -67.97 -31.32 70.96 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.577 -0.702 . . . . 0.0 111.214 -179.203 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.439 ' HG2' ' CZ2' ' A' ' 47' ' ' TRP . 34.3 mtpt -80.43 -37.64 31.65 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.344 -0.847 . . . . 0.0 111.127 -179.198 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -43.46 -56.12 7.37 Favored Pre-proline 0 N--CA 1.509 2.476 0 O-C-N 121.451 -0.781 . . . . 0.0 112.7 -178.443 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -76.2 -35.92 2.12 Favored 'Trans proline' 0 C--N 1.315 -1.203 0 O-C-N 123.049 1.026 . . . . 0.0 111.417 -179.35 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -82.04 -8.85 59.69 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.39 -0.819 . . . . 0.0 112.132 -178.314 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.07 -23.76 22.46 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.021 -1.049 . . . . 0.0 111.201 -179.193 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -78.98 -20.79 48.27 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.376 -0.828 . . . . 0.0 110.804 -179.823 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 22.1 tttp -60.43 -50.04 75.18 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.365 -0.834 . . . . 0.0 110.301 179.997 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.477 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -77.48 -10.84 59.71 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 119.839 -0.744 . . . . 0.0 110.429 179.493 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.9 -25.73 67.29 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.286 -0.884 . . . . 0.0 109.469 179.277 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.5 ttpt -79.57 -64.8 1.1 Allowed 'General case' 0 N--CA 1.493 1.718 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 178.835 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.54 ' H ' HD12 ' A' ' 65' ' ' LEU . 2.8 mp -42.07 -20.52 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.279 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 -178.914 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 57.2 tttt -70.39 -32.83 70.64 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.646 -1.284 . . . . 0.0 109.067 178.491 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -85.99 -5.3 59.25 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.703 -0.623 . . . . 0.0 110.751 179.451 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.2 tptt -102.4 -37.77 7.89 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.251 -0.906 . . . . 0.0 108.952 179.234 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.628 ' CZ ' HD13 ' A' ' 73' ' ' ILE . 19.0 t80 -75.7 -56.58 4.55 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 179.149 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -57.22 -20.28 26.21 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.839 -0.538 . . . . 0.0 111.236 -179.674 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.0 mttt -98.9 -23.64 15.26 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.226 -0.921 . . . . 0.0 111.07 -179.379 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -103.3 -31.35 10.1 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.428 -0.795 . . . . 0.0 111.125 -179.216 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.628 HD13 ' CZ ' ' A' ' 69' ' ' TYR . 2.5 tp -66.96 -33.57 64.29 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 O-C-N 121.43 -0.794 . . . . 0.0 110.539 -179.422 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -55.78 -42.91 76.26 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.533 -0.729 . . . . 0.0 110.584 -179.784 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -89.73 -20.46 23.55 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.589 -0.694 . . . . 0.0 110.476 179.726 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 59.0 t80 -75.34 -30.89 60.4 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.38 -0.825 . . . . 0.0 110.352 -179.853 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 27.9 mtp180 -78.65 -83.4 0.09 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.614 -0.679 . . . . 0.0 110.32 -179.846 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -136.98 -143.1 0.17 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.252 -0.905 . . . . 0.0 109.701 -179.751 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 16.6 mtmt . . . . . 0 N--CA 1.502 2.155 0 O-C-N 120.981 -1.074 . . . . 0.0 110.793 179.823 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.2 0.524 . . . . 0.0 110.243 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 52.82 69.78 0.65 Allowed 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.393 -0.817 . . . . 0.0 110.814 179.997 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 9.0 ttpt -170.85 -158.07 0.14 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.505 -0.747 . . . . 0.0 109.953 179.935 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 8.8 mtpt -155.64 -164.16 1.67 Allowed 'General case' 0 N--CA 1.485 1.277 0 O-C-N 121.611 -0.68 . . . . 0.0 109.64 179.838 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.68 145.65 98.2 Favored Pre-proline 0 N--CA 1.494 1.728 0 O-C-N 121.664 -0.647 . . . . 0.0 110.275 -179.992 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -73.93 -19.08 21.05 Favored 'Trans proline' 0 C--N 1.317 -1.128 0 O-C-N 123.376 1.198 . . . . 0.0 110.903 179.877 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -83.9 -26.81 29.07 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.329 -0.857 . . . . 0.0 110.477 -179.725 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -92.36 154.99 42.85 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.473 -0.767 . . . . 0.0 110.352 -179.825 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.429 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 48.0 Cg_endo -73.66 133.85 19.36 Favored 'Trans proline' 0 C--N 1.317 -1.111 0 O-C-N 123.425 1.224 . . . . 0.0 110.521 -179.94 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.4 pttm -144.18 31.37 1.24 Allowed 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.646 -0.659 . . . . 0.0 110.451 -179.966 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 43.1 mtt180 -147.17 68.78 11.49 Favored Pre-proline 0 N--CA 1.493 1.711 0 C-N-CA 120.444 -0.502 . . . . 0.0 110.183 -179.807 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -77.31 123.6 6.69 Favored 'Trans proline' 0 C--N 1.316 -1.149 0 O-C-N 123.264 1.139 . . . . 0.0 110.452 -179.932 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.766 ' HG3' HD22 ' A' ' 65' ' ' LEU . 48.2 Cg_endo -81.52 176.44 8.58 Favored 'Trans proline' 0 C--N 1.318 -1.053 0 O-C-N 123.26 1.137 . . . . 0.0 109.835 179.793 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.539 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 52.4 p -167.48 56.54 0.07 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.379 -0.826 . . . . 0.0 111.043 -179.753 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.539 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 68.94 -79.81 0.04 OUTLIER 'General case' 0 N--CA 1.505 2.305 0 O-C-N 121.143 -0.973 . . . . 0.0 110.807 -179.905 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -47.36 -51.04 20.77 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.117 -0.989 . . . . 0.0 111.412 -179.33 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -54.97 -27.73 46.14 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.523 -0.735 . . . . 0.0 110.28 179.743 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.68 HD11 ' HB2' ' A' ' 62' ' ' ALA . 21.3 mt -85.17 -24.63 27.84 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.523 -0.735 . . . . 0.0 110.386 -179.925 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.496 ' CE1' ' CE1' ' A' ' 23' ' ' TYR . 80.5 t80 -81.27 -57.45 3.49 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.469 -0.769 . . . . 0.0 110.756 -179.267 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.7 t -60.18 -48.8 80.19 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.502 -0.749 . . . . 0.0 110.403 -179.717 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 30.7 t -57.43 -21.5 37.13 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.636 -0.665 . . . . 0.0 110.881 -179.768 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.5 mm-40 -107.67 -13.61 15.0 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.35 -0.843 . . . . 0.0 111.442 -179.489 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.507 ' HB3' HD22 ' A' ' 43' ' ' LEU . 2.6 m-85 -94.69 -37.76 11.14 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.173 -0.955 . . . . 0.0 110.602 -179.592 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.527 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 5.9 mtt180 -46.88 -51.77 37.04 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.437 -0.789 . . . . 0.0 112.265 -179.625 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.539 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.5 Cg_endo -60.2 -26.52 82.77 Favored 'Trans proline' 0 N--CA 1.493 1.486 0 O-C-N 123.24 1.126 . . . . 0.0 110.089 179.779 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.0 tmtt? -69.65 -47.37 63.57 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 177.494 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.665 HG13 HD21 ' A' ' 43' ' ' LEU . 46.4 mm -57.97 -18.67 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.607 179.543 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.539 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 7.1 mmmm -85.24 -28.58 25.29 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.189 -0.944 . . . . 0.0 110.293 -177.843 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.1 t -68.55 -18.74 64.41 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.507 -0.745 . . . . 0.0 110.846 -179.979 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -127.59 -1.59 6.14 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.313 -0.867 . . . . 0.0 111.611 -179.598 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.679 ' HB3' HD23 ' A' ' 34' ' ' LEU . 26.7 m80 -140.71 93.58 8.49 Favored Pre-proline 0 N--CA 1.497 1.925 0 O-C-N 121.135 -0.978 . . . . 0.0 109.057 179.035 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -74.68 -37.32 2.32 Favored 'Trans proline' 0 C--N 1.316 -1.155 0 O-C-N 123.511 1.269 . . . . 0.0 110.384 -179.467 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -70.68 -26.73 73.56 Favored Glycine 0 N--CA 1.488 2.159 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 179.571 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.679 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.3 OUTLIER -48.2 90.87 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.375 0 O-C-N 121.616 -0.932 . . . . 0.0 111.704 -179.501 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.1 p -76.71 -179.67 5.49 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.533 -0.729 . . . . 0.0 109.475 179.595 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.487 ' N ' HD12 ' A' ' 36' ' ' ILE . 2.0 mp -60.54 -33.91 56.29 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 O-C-N 121.37 -0.831 . . . . 0.0 109.297 179.822 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.09 -54.61 36.6 Favored Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.024 -1.631 . . . . 0.0 109.024 179.483 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.6 ' CB ' HD13 ' A' ' 34' ' ' LEU . 23.8 m-20 -73.39 -36.9 66.1 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.763 -0.845 . . . . 0.0 110.031 179.017 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.481 ' O ' HD12 ' A' ' 43' ' ' LEU . 87.9 m -65.3 -25.13 67.49 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.238 -0.914 . . . . 0.0 110.263 179.265 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -84.43 -33.02 23.79 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.418 -0.802 . . . . 0.0 110.328 -179.942 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.429 ' HG2' ' HA ' ' A' ' 38' ' ' ASP . 3.0 ptpt -100.06 -14.7 18.5 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.442 -0.786 . . . . 0.0 111.79 -179.179 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -85.06 -5.21 59.35 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.921 -1.112 . . . . 0.0 110.547 179.338 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.665 HD21 HG13 ' A' ' 27' ' ' ILE . 86.4 mt -96.83 -38.74 9.74 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.283 -0.886 . . . . 0.0 109.237 179.337 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -59.22 -32.76 72.59 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 109.863 -1.295 . . . . 0.0 109.863 -179.943 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -55.36 -37.22 67.21 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.513 -0.992 . . . . 0.0 110.419 -179.992 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 14.3 mtt -76.14 -44.42 38.47 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.621 -0.674 . . . . 0.0 109.598 179.408 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 70.7 t-105 -54.64 -22.69 14.34 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.621 -0.674 . . . . 0.0 110.897 -179.955 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 23.1 t -88.82 -31.49 18.3 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.282 -0.886 . . . . 0.0 110.117 179.94 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -90.88 -4.8 56.27 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.533 -0.73 . . . . 0.0 110.995 179.674 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.414 ' HB2' ' CB ' ' A' ' 54' ' ' ASP . 4.4 pp0? -59.03 -167.35 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.217 -0.927 . . . . 0.0 110.621 179.928 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.2 t -156.75 -147.07 0.18 Allowed 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 179.897 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.88 -3.82 31.2 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.135 -0.978 . . . . 0.0 111.035 179.684 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.4 mtmt -90.89 -38.78 12.69 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.92 -1.113 . . . . 0.0 110.901 -179.524 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.414 ' CB ' ' HB2' ' A' ' 50' ' ' GLN . 0.8 OUTLIER -87.91 49.87 1.88 Allowed 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.339 -0.851 . . . . 0.0 110.777 -179.366 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.417 ' O ' ' N ' ' A' ' 59' ' ' GLU . 17.6 mtmt -159.82 -59.81 0.06 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.581 -0.699 . . . . 0.0 109.697 178.673 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.407 ' N ' ' HD2' ' A' ' 57' ' ' PRO . 5.0 mm100 -41.15 -52.29 7.29 Favored Pre-proline 0 N--CA 1.506 2.352 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -179.097 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.407 ' HD2' ' N ' ' A' ' 56' ' ' GLN . 52.8 Cg_endo -75.29 -36.03 2.61 Favored 'Trans proline' 0 N--CA 1.489 1.213 0 O-C-N 123.129 1.068 . . . . 0.0 112.182 -179.208 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.409 ' O ' HD12 ' A' ' 18' ' ' LEU . 8.0 m-85 -87.68 -17.85 30.87 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 121.221 -0.925 . . . . 0.0 111.848 -178.611 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.417 ' N ' ' O ' ' A' ' 55' ' ' LYS . 0.2 OUTLIER -85.35 -30.9 23.3 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.25 -0.907 . . . . 0.0 110.018 -179.417 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.412 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 5.7 pt20 -77.71 -24.74 49.11 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.748 -0.595 . . . . 0.0 110.159 179.494 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 73.1 tttt -62.91 -43.1 99.71 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.46 -0.775 . . . . 0.0 109.858 179.728 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.68 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -78.94 -16.38 57.04 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.515 -0.741 . . . . 0.0 109.943 178.987 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.412 ' HB3' ' O ' ' A' ' 60' ' ' GLN . . . -58.25 -42.75 87.08 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.404 -0.81 . . . . 0.0 110.449 179.954 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -70.08 -62.27 1.45 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.306 -0.871 . . . . 0.0 110.055 -179.989 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.766 HD22 ' HG3' ' A' ' 13' ' ' PRO . 4.3 mp -45.69 -27.15 0.75 Allowed 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.688 -0.632 . . . . 0.0 111.815 -179.419 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.1 tptt -64.25 -51.85 61.56 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.42 -0.8 . . . . 0.0 109.421 179.142 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -60.82 -52.0 66.94 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.647 -0.658 . . . . 0.0 109.846 179.499 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 69.5 mttt -56.19 -26.11 49.5 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.527 -0.733 . . . . 0.0 110.536 179.926 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.495 ' O ' HG22 ' A' ' 73' ' ' ILE . 32.8 t80 -81.92 -63.37 1.4 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.396 -0.815 . . . . 0.0 109.538 179.468 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.435 ' C ' HG22 ' A' ' 73' ' ' ILE . 9.6 mt-10 -55.21 -23.87 24.36 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.475 -0.766 . . . . 0.0 110.682 179.718 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 25.3 ttmt -89.42 -59.86 2.1 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.452 -0.78 . . . . 0.0 110.426 -179.924 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -56.28 -23.09 34.29 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.529 -0.732 . . . . 0.0 111.084 -179.403 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.495 HG22 ' O ' ' A' ' 69' ' ' TYR . 7.1 tp -78.15 -32.05 16.86 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 121.342 -0.849 . . . . 0.0 109.88 179.764 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -51.9 -30.66 25.13 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.453 -0.78 . . . . 0.0 110.514 -179.86 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -83.1 -2.58 55.77 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.65 -0.656 . . . . 0.0 110.594 179.098 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.406 ' O ' ' CG ' ' A' ' 76' ' ' TYR . 83.5 t80 -106.1 20.85 18.3 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.153 -0.967 . . . . 0.0 109.963 178.858 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 40.9 mtp85 -130.5 -32.76 1.71 Allowed 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.331 -0.855 . . . . 0.0 111.301 -179.169 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 53.06 75.39 0.25 Allowed 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.187 -0.946 . . . . 0.0 110.777 -179.935 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 8.9 tttt . . . . . 0 N--CA 1.494 1.753 0 CA-C-O 118.035 -0.984 . . . . 0.0 110.196 -179.918 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 121.167 0.508 . . . . 0.0 110.116 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.96 150.47 23.43 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.555 -0.715 . . . . 0.0 110.154 179.842 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.1 tttp 53.78 -172.09 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.148 0 O-C-N 121.459 -0.775 . . . . 0.0 110.611 -179.952 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.7 mttt -166.19 -75.83 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.626 -0.671 . . . . 0.0 110.135 179.791 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -168.28 167.21 6.61 Favored Pre-proline 0 N--CA 1.494 1.744 0 O-C-N 121.437 -0.789 . . . . 0.0 110.313 -179.939 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -72.92 -39.95 2.07 Favored 'Trans proline' 0 C--N 1.317 -1.124 0 O-C-N 123.501 1.263 . . . . 0.0 110.319 179.883 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 10.9 p30 -78.88 -14.23 59.35 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.618 -0.676 . . . . 0.0 110.996 -179.305 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -96.77 130.99 28.88 Favored Pre-proline 0 N--CA 1.493 1.724 0 O-C-N 121.238 -0.914 . . . . 0.0 109.595 179.349 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -72.47 105.49 1.89 Allowed 'Trans proline' 0 C--N 1.319 -1.005 0 O-C-N 123.161 1.085 . . . . 0.0 110.286 -179.715 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.53 -164.78 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.631 -0.668 . . . . 0.0 110.438 -179.779 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.4 mpt_? -60.6 142.27 91.5 Favored Pre-proline 0 N--CA 1.496 1.854 0 O-C-N 121.618 -0.677 . . . . 0.0 110.124 -179.989 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -75.13 131.55 14.28 Favored 'Trans proline' 0 C--N 1.318 -1.076 0 O-C-N 123.324 1.171 . . . . 0.0 110.053 179.876 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.626 ' CB ' HD21 ' A' ' 18' ' ' LEU . 48.7 Cg_endo -81.72 -177.08 3.36 Favored 'Trans proline' 0 C--N 1.318 -1.075 0 O-C-N 123.195 1.103 . . . . 0.0 110.21 -179.815 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.534 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 24.7 t -166.31 65.2 0.1 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.513 -0.742 . . . . 0.0 110.527 -179.846 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.534 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 66.91 -76.59 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.057 -1.027 . . . . 0.0 110.043 -179.388 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 14.2 t80 -48.8 -46.81 42.23 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.354 -0.841 . . . . 0.0 111.274 -179.812 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -60.38 -32.75 71.6 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.597 -0.689 . . . . 0.0 110.118 179.784 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.626 HD21 ' CB ' ' A' ' 13' ' ' PRO . 22.2 mt -79.4 -30.43 42.42 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.571 -0.706 . . . . 0.0 110.433 -179.496 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.498 ' CE2' ' CE1' ' A' ' 23' ' ' TYR . 31.0 t80 -77.41 -54.43 6.45 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.562 -0.711 . . . . 0.0 110.685 -179.392 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.716 ' SG ' HD13 ' A' ' 43' ' ' LEU . 45.3 t -57.91 -50.38 73.53 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.578 -0.702 . . . . 0.0 110.675 -179.539 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 99.5 p -59.01 -24.48 62.83 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.553 -0.717 . . . . 0.0 110.944 -179.688 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -99.36 -25.62 14.41 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.398 -0.813 . . . . 0.0 111.305 -179.251 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.498 ' CE1' ' CE2' ' A' ' 19' ' ' PHE . 4.6 m-85 -86.5 -34.41 20.03 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.345 -0.847 . . . . 0.0 111.123 -179.281 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.479 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 4.0 mtt180 -46.6 -54.45 18.95 Favored Pre-proline 0 N--CA 1.499 1.995 0 O-C-N 121.384 -0.823 . . . . 0.0 112.251 -179.59 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.55 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 37.0 Cg_endo -61.09 -25.73 81.65 Favored 'Trans proline' 0 N--CA 1.494 1.507 0 O-C-N 123.305 1.161 . . . . 0.0 110.194 179.895 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -69.87 -46.6 65.16 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.179 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 35.9 mm -57.67 -29.61 35.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 CA-C-O 121.171 0.51 . . . . 0.0 110.402 179.873 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.55 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.5 mmmm -74.04 -36.28 64.39 Favored 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 120.01 -0.676 . . . . 0.0 110.204 -177.068 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.4 t -67.51 -19.15 65.28 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.458 -0.776 . . . . 0.0 110.48 179.7 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -118.65 -12.28 9.75 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.333 -0.854 . . . . 0.0 111.356 -179.628 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.684 ' HB3' HD23 ' A' ' 34' ' ' LEU . 42.3 m80 -133.54 94.25 19.86 Favored Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 121.152 -0.967 . . . . 0.0 109.737 179.515 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -75.65 -33.73 3.78 Favored 'Trans proline' 0 C--N 1.316 -1.155 0 O-C-N 123.592 1.312 . . . . 0.0 110.109 -179.841 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -76.43 -21.15 75.88 Favored Glycine 0 N--CA 1.489 2.198 0 N-CA-C 109.845 -1.302 . . . . 0.0 109.845 179.643 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.684 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.2 OUTLIER -50.18 91.11 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.497 -1.002 . . . . 0.0 111.373 -179.691 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 50.6 p -77.35 165.49 24.38 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.53 -0.731 . . . . 0.0 109.757 179.707 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.584 ' H ' HD12 ' A' ' 36' ' ' ILE . 2.4 mp -52.12 -27.38 9.62 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 O-C-N 121.432 -0.793 . . . . 0.0 110.171 -179.953 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.15 -61.44 6.65 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.054 -1.618 . . . . 0.0 109.054 179.607 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.445 ' HA ' ' HB2' ' A' ' 41' ' ' LYS . 32.8 t0 -76.86 -25.26 52.91 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.735 -0.862 . . . . 0.0 110.584 179.865 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.623 ' HA ' HD12 ' A' ' 34' ' ' LEU . 49.3 m -52.93 -45.55 67.7 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 120.867 -1.146 . . . . 0.0 110.072 179.451 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.637 ' HA ' HD12 ' A' ' 43' ' ' LEU . . . -76.15 -44.04 40.08 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 178.475 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.445 ' HB2' ' HA ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -57.74 -30.3 65.46 Favored 'General case' 0 N--CA 1.497 1.924 0 CA-C-O 121.378 0.609 . . . . 0.0 110.034 179.272 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.422 ' N ' ' O ' ' A' ' 38' ' ' ASP . 2.7 tptt -88.19 -3.02 58.93 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.636 -0.665 . . . . 0.0 110.964 -179.583 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.716 HD13 ' SG ' ' A' ' 20' ' ' CYS . 9.9 mt -90.17 -42.79 10.85 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.261 -0.9 . . . . 0.0 109.064 179.322 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -70.7 -32.24 67.25 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 108.762 -1.735 . . . . 0.0 108.762 179.264 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -58.58 -54.28 48.84 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.65 -0.912 . . . . 0.0 109.835 179.522 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 58.4 mtt -65.86 -54.59 24.69 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.643 -0.661 . . . . 0.0 109.438 179.206 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 68.2 t-105 -51.21 -56.45 12.78 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.605 -0.684 . . . . 0.0 110.787 -179.858 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 35.1 t -61.41 -34.34 75.2 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.436 -0.79 . . . . 0.0 110.252 -179.972 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -61.71 -39.84 92.92 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.578 -0.701 . . . . 0.0 110.114 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 31.4 mm-40 -57.97 155.69 10.38 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.62 -0.675 . . . . 0.0 110.614 -179.906 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.0 t -92.75 -149.58 0.26 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.69 -0.631 . . . . 0.0 109.41 179.527 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.04 50.33 1.99 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.211 -0.931 . . . . 0.0 110.312 179.726 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -129.59 -42.91 1.28 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.445 -0.784 . . . . 0.0 110.044 179.944 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -60.08 -29.79 68.8 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.454 -0.779 . . . . 0.0 110.584 -179.671 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 44.2 tttt -95.3 22.7 6.55 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.283 -0.886 . . . . 0.0 111.214 -179.368 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.436 ' HB2' ' HD3' ' A' ' 57' ' ' PRO . 10.0 mp0 -100.36 -61.09 0.1 OUTLIER Pre-proline 0 N--CA 1.497 1.876 0 O-C-N 121.349 -0.844 . . . . 0.0 111.047 179.683 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.436 ' HD3' ' HB2' ' A' ' 56' ' ' GLN . 55.5 Cg_endo -76.96 -36.76 1.33 Allowed 'Trans proline' 0 N--CA 1.485 0.987 0 O-C-N 122.618 0.799 . . . . 0.0 110.7 179.884 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -79.79 3.6 19.02 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.407 -0.808 . . . . 0.0 111.916 -178.929 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.416 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -98.31 -18.86 18.12 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.075 -1.016 . . . . 0.0 110.882 179.983 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -77.64 -24.39 49.5 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.286 -0.884 . . . . 0.0 110.363 179.817 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.441 ' HD3' HD13 ' A' ' 18' ' ' LEU . 55.0 tttt -59.82 -40.02 87.04 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.462 -0.774 . . . . 0.0 109.718 179.456 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.401 ' CB ' ' HA ' ' A' ' 14' ' ' SER . . . -69.42 -10.71 59.2 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.626 -0.671 . . . . 0.0 110.537 179.312 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -87.85 6.78 33.78 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.163 -0.961 . . . . 0.0 110.439 179.218 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 38.1 mmtt -105.78 -35.04 7.48 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.255 -0.903 . . . . 0.0 109.078 178.86 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.1 mp -78.38 -0.0 27.38 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.936 -0.478 . . . . 0.0 110.888 179.44 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 59.5 tttt -89.3 -26.16 21.28 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.168 -0.958 . . . . 0.0 109.805 179.292 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 13.3 mt-10 -83.27 -15.77 48.96 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.573 -0.704 . . . . 0.0 110.478 179.425 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 32.8 mtpt -101.48 -27.17 13.27 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.307 -0.87 . . . . 0.0 109.992 179.688 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.442 ' O ' HG22 ' A' ' 73' ' ' ILE . 23.0 t80 -77.68 -51.47 10.55 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.557 -0.714 . . . . 0.0 109.642 179.627 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -70.51 -6.82 38.95 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.685 -0.634 . . . . 0.0 111.589 -179.632 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 47.8 mttt -110.66 -33.9 6.43 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.077 -1.014 . . . . 0.0 110.174 179.868 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -87.34 -29.88 21.23 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.556 -0.715 . . . . 0.0 110.833 -179.47 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.442 HG22 ' O ' ' A' ' 69' ' ' TYR . 3.2 tp -66.8 -24.22 32.33 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 O-C-N 121.401 -0.812 . . . . 0.0 110.436 -179.69 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -55.48 -30.54 60.77 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.394 -0.816 . . . . 0.0 110.225 179.934 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -84.19 -10.81 57.43 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.688 -0.632 . . . . 0.0 110.501 179.201 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 42.5 t80 -105.46 26.33 9.6 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.248 -0.908 . . . . 0.0 109.984 179.531 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 6.2 mtt180 -128.39 -33.19 2.14 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.55 -0.719 . . . . 0.0 111.151 -179.468 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 53.24 72.83 0.4 Allowed 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.119 -0.988 . . . . 0.0 110.652 -179.865 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.229 -179.974 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.7 tpt . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 121.129 0.49 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -137.2 71.23 1.4 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.576 -0.703 . . . . 0.0 110.26 -179.982 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -170.02 -48.8 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.49 -0.756 . . . . 0.0 110.323 179.842 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.5 mttt -168.53 -165.69 0.61 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.477 -0.764 . . . . 0.0 110.36 179.966 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -118.61 174.28 2.8 Favored Pre-proline 0 N--CA 1.494 1.748 0 O-C-N 121.551 -0.718 . . . . 0.0 110.171 -179.825 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.4 -34.35 12.62 Favored 'Trans proline' 0 N--CA 1.486 1.086 0 O-C-N 123.36 1.189 . . . . 0.0 110.205 179.821 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 29.0 m120 -78.4 -10.19 59.59 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.598 -0.689 . . . . 0.0 110.876 -179.356 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -100.61 133.46 21.24 Favored Pre-proline 0 N--CA 1.493 1.692 0 O-C-N 121.127 -0.983 . . . . 0.0 109.278 179.07 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -73.2 107.71 2.44 Favored 'Trans proline' 0 C--N 1.318 -1.05 0 O-C-N 123.078 1.041 . . . . 0.0 110.628 -179.519 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -59.56 -163.08 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.803 -0.56 . . . . 0.0 110.302 -179.821 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 7.1 mpt_? -55.22 154.62 10.62 Favored Pre-proline 0 N--CA 1.5 2.045 0 O-C-N 121.37 -0.831 . . . . 0.0 110.768 -179.889 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -73.74 121.9 7.38 Favored 'Trans proline' 0 C--N 1.317 -1.122 0 O-C-N 123.541 1.285 . . . . 0.0 110.01 179.795 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.76 ' HB2' HD21 ' A' ' 18' ' ' LEU . 47.8 Cg_endo -82.23 162.48 17.62 Favored 'Trans proline' 0 C--N 1.317 -1.099 0 O-C-N 123.208 1.11 . . . . 0.0 110.353 -179.614 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.535 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 0.9 OUTLIER -162.75 65.76 0.21 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.554 -0.716 . . . . 0.0 110.223 -179.758 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.535 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 66.83 -76.58 0.05 OUTLIER 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.171 -0.956 . . . . 0.0 109.926 -179.35 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.439 ' CD1' ' CD1' ' A' ' 47' ' ' TRP . 11.7 t80 -51.64 -42.16 61.85 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.206 -0.934 . . . . 0.0 110.807 179.878 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -65.16 -26.34 68.13 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 120.085 -0.646 . . . . 0.0 109.824 179.716 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.76 HD21 ' HB2' ' A' ' 13' ' ' PRO . 35.9 mt -84.03 -39.2 19.92 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.5 -0.75 . . . . 0.0 110.064 -179.736 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -67.16 -49.77 63.56 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.557 -0.715 . . . . 0.0 110.223 -179.862 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 9.0 t -67.2 -28.29 67.96 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.62 -0.675 . . . . 0.0 109.964 179.561 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 42.0 t -87.57 4.23 44.46 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.491 -0.756 . . . . 0.0 111.632 -179.415 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 50.8 mm-40 -141.51 2.58 1.64 Allowed 'General case' 0 N--CA 1.499 1.997 0 O-C-N 120.974 -1.079 . . . . 0.0 112.367 -179.568 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 33.9 m-85 -122.27 22.2 10.17 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 120.826 -1.171 . . . . 0.0 111.129 -179.671 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.507 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 15.3 mtp180 -87.82 -45.49 0.49 Allowed Pre-proline 0 N--CA 1.489 1.49 0 O-C-N 121.361 -0.837 . . . . 0.0 112.403 179.815 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.582 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.4 Cg_endo -66.83 -14.68 44.71 Favored 'Trans proline' 0 N--CA 1.492 1.393 0 O-C-N 122.917 0.956 . . . . 0.0 110.686 -179.035 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -74.25 -52.58 11.92 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 177.837 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 30.2 mm -52.46 -31.26 15.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 CA-C-O 121.297 0.57 . . . . 0.0 110.454 179.649 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.582 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.9 mmmm -72.54 -33.45 66.84 Favored 'General case' 0 N--CA 1.496 1.855 0 C-N-CA 120.123 -0.631 . . . . 0.0 110.176 -177.303 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.7 t -62.03 -25.98 67.98 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.589 -0.694 . . . . 0.0 110.508 -179.922 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -115.7 -24.55 8.19 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.551 -0.718 . . . . 0.0 110.79 -179.669 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.768 ' HB3' HD23 ' A' ' 34' ' ' LEU . 38.3 m80 -119.3 96.75 50.13 Favored Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.476 -0.765 . . . . 0.0 109.543 -179.889 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -75.33 -28.79 8.36 Favored 'Trans proline' 0 C--N 1.313 -1.293 0 O-C-N 123.444 1.234 . . . . 0.0 110.49 -179.813 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.404 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -83.88 -13.94 73.81 Favored Glycine 0 N--CA 1.488 2.129 0 N-CA-C 110.506 -1.037 . . . . 0.0 110.506 -179.947 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.768 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -61.71 79.56 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.413 -1.051 . . . . 0.0 111.273 -179.333 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.404 ' N ' ' O ' ' A' ' 33' ' ' GLY . 79.5 p -69.48 174.79 4.55 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.394 -0.816 . . . . 0.0 109.581 179.847 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 40.3 mm -54.33 -29.9 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 O-C-N 121.308 -0.87 . . . . 0.0 110.15 179.895 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -59.7 -65.91 3.1 Favored Glycine 0 N--CA 1.491 2.319 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 179.906 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.463 ' HB3' HD13 ' A' ' 34' ' ' LEU . 0.5 OUTLIER -69.83 -29.72 67.05 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.622 -0.928 . . . . 0.0 110.757 179.857 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 73.7 m -64.65 -31.0 72.02 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.393 -0.817 . . . . 0.0 110.133 179.707 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.38 -43.78 48.41 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.584 -0.698 . . . . 0.0 110.158 -179.983 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -87.23 -12.06 47.87 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.596 -0.69 . . . . 0.0 111.822 -179.403 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.407 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 9.4 tptt -77.59 -59.64 2.7 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.987 -1.071 . . . . 0.0 109.797 179.529 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 43.8 mt -48.95 -26.08 2.3 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.413 -0.805 . . . . 0.0 111.336 -179.729 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.1 -37.87 82.79 Favored Glycine 0 N--CA 1.492 2.425 0 N-CA-C 109.277 -1.529 . . . . 0.0 109.277 179.673 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -50.9 -35.04 30.94 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.462 -1.022 . . . . 0.0 110.919 -179.839 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 22.8 mmt -81.84 -42.85 19.05 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.66 -0.65 . . . . 0.0 109.591 179.587 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . 0.439 ' CD1' ' CD1' ' A' ' 16' ' ' PHE . 45.4 t-105 -51.86 -52.66 47.93 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.526 -0.734 . . . . 0.0 110.788 -179.862 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.9 t -68.17 -32.1 72.11 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.381 -0.824 . . . . 0.0 110.506 -179.572 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -58.68 -38.84 79.1 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.516 -0.74 . . . . 0.0 110.252 -179.86 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -73.63 172.09 12.04 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.514 -0.741 . . . . 0.0 109.944 179.668 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 88.6 p -164.17 110.86 1.07 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.486 -0.758 . . . . 0.0 110.507 -179.918 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 51.6 35.34 14.49 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.429 -0.794 . . . . 0.0 111.054 179.611 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 70.8 mttt -135.39 -73.51 0.46 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.547 -0.721 . . . . 0.0 110.302 179.961 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -66.87 -20.67 65.96 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.511 -0.743 . . . . 0.0 110.687 -179.937 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.437 ' HG2' ' CH2' ' A' ' 47' ' ' TRP . 50.3 mttt -82.99 -35.27 26.0 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.368 -0.833 . . . . 0.0 110.678 -179.763 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -45.78 -51.55 29.26 Favored Pre-proline 0 N--CA 1.507 2.395 0 O-C-N 121.569 -0.707 . . . . 0.0 111.759 -179.176 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -79.09 -39.29 0.35 Allowed 'Trans proline' 0 C--N 1.314 -1.239 0 O-C-N 123.186 1.098 . . . . 0.0 110.747 179.889 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -81.51 4.68 20.38 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.605 -0.684 . . . . 0.0 112.104 -178.657 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.84 -20.35 17.56 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 120.996 -1.065 . . . . 0.0 110.358 179.387 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -77.72 -26.35 49.97 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.442 -0.786 . . . . 0.0 110.085 179.598 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 50.4 tttt -61.89 -40.38 95.24 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.571 -0.706 . . . . 0.0 110.092 179.855 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.636 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -79.34 -14.0 59.27 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.482 -0.761 . . . . 0.0 110.539 179.606 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -81.16 0.34 36.84 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.313 -0.867 . . . . 0.0 110.299 179.159 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 24.0 mmtp -105.72 -29.81 9.84 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.164 -0.96 . . . . 0.0 109.93 179.4 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.9 mp -87.15 -2.47 58.65 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.882 -0.511 . . . . 0.0 110.361 178.834 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.5 tptt -83.98 -35.64 23.79 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.299 -0.876 . . . . 0.0 108.771 178.916 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -66.95 -59.57 3.38 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 119.939 -0.704 . . . . 0.0 109.324 179.323 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 92.6 mttt -58.85 -20.3 49.56 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.607 -0.683 . . . . 0.0 111.02 -179.888 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.462 ' O ' HG22 ' A' ' 73' ' ' ILE . 32.6 t80 -77.5 -61.25 2.05 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.158 -0.964 . . . . 0.0 109.579 179.471 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -64.2 -12.49 41.03 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.613 -0.679 . . . . 0.0 111.334 -179.955 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.1 mmtm -102.49 -29.31 11.67 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.131 -0.981 . . . . 0.0 110.516 -179.949 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -99.78 -26.96 13.87 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.528 -0.732 . . . . 0.0 110.95 -179.612 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.462 HG22 ' O ' ' A' ' 69' ' ' TYR . 4.3 tp -61.5 -27.19 41.51 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.886 0 O-C-N 121.276 -0.89 . . . . 0.0 109.907 179.891 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -50.56 -43.98 56.42 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.474 -0.766 . . . . 0.0 110.576 179.841 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.38 -15.29 63.6 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.416 -0.803 . . . . 0.0 110.112 178.625 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -107.88 -1.23 20.94 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.406 -0.809 . . . . 0.0 109.755 176.727 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -148.03 75.01 1.32 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.476 -0.765 . . . . 0.0 111.328 -178.311 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -80.98 -1.39 43.57 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.414 -0.803 . . . . 0.0 110.918 178.991 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.494 1.732 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.333 -179.914 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 121.069 0.462 . . . . 0.0 110.194 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.62 153.09 36.52 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.536 -0.727 . . . . 0.0 110.371 -179.914 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.7 tttt -169.93 163.31 9.51 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.552 -0.717 . . . . 0.0 110.22 179.806 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.837 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 11.9 mttp -60.04 -26.83 66.44 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.556 -0.715 . . . . 0.0 110.487 -179.821 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 59.3 163.13 0.09 OUTLIER Pre-proline 0 N--CA 1.501 2.111 0 O-C-N 121.338 -0.851 . . . . 0.0 110.363 -179.633 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -73.04 -19.47 22.98 Favored 'Trans proline' 0 C--N 1.316 -1.137 0 O-C-N 123.355 1.187 . . . . 0.0 111.205 -179.416 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -78.93 -29.94 44.42 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.281 -0.887 . . . . 0.0 110.605 -179.034 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.837 ' HB3' ' O ' ' A' ' 4' ' ' LYS . . . -95.33 176.27 2.35 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.268 -0.895 . . . . 0.0 109.879 179.709 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.715 ' HD2' ' HB1' ' A' ' 8' ' ' ALA . 45.8 Cg_endo -73.92 134.83 20.36 Favored 'Trans proline' 0 C--N 1.318 -1.065 0 O-C-N 123.323 1.17 . . . . 0.0 110.123 179.806 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.35 -166.43 0.09 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.616 -0.678 . . . . 0.0 110.326 -179.706 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -58.37 146.34 72.06 Favored Pre-proline 0 N--CA 1.497 1.883 0 O-C-N 121.551 -0.718 . . . . 0.0 110.408 -179.92 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -74.35 125.3 9.57 Favored 'Trans proline' 0 C--N 1.317 -1.113 0 O-C-N 123.433 1.228 . . . . 0.0 110.009 179.783 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.729 ' HB2' HD21 ' A' ' 18' ' ' LEU . 49.4 Cg_endo -82.21 174.81 9.67 Favored 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.232 1.122 . . . . 0.0 110.181 -179.731 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.535 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 0.6 OUTLIER -169.59 69.07 0.06 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.556 -0.715 . . . . 0.0 110.495 -179.956 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.535 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 67.11 -77.64 0.04 OUTLIER 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.045 -1.035 . . . . 0.0 110.574 -179.794 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -47.79 -47.87 30.69 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.237 -0.914 . . . . 0.0 111.508 -179.34 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -61.83 -29.92 70.49 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.621 -0.674 . . . . 0.0 109.87 179.812 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.729 HD21 ' HB2' ' A' ' 13' ' ' PRO . 18.2 mt -83.16 -29.9 28.26 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.479 -0.763 . . . . 0.0 109.989 -179.82 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.498 ' CE2' ' CE1' ' A' ' 23' ' ' TYR . 55.8 t80 -77.56 -54.58 6.24 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.542 -0.724 . . . . 0.0 110.481 -179.463 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.444 ' SG ' HD13 ' A' ' 43' ' ' LEU . 7.7 t -58.43 -50.93 71.93 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.535 -0.728 . . . . 0.0 110.646 -179.704 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.1 t -58.23 -21.67 48.95 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.518 -0.739 . . . . 0.0 110.916 -179.798 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -101.63 -23.63 14.23 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.343 -0.848 . . . . 0.0 111.003 -179.662 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.498 ' CE1' ' CE2' ' A' ' 19' ' ' PHE . 2.4 m-85 -86.7 -33.87 19.9 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.479 -0.763 . . . . 0.0 110.681 -179.61 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.53 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 4.4 mtt-85 -48.35 -52.23 44.46 Favored Pre-proline 0 N--CA 1.498 1.93 0 O-C-N 121.318 -0.864 . . . . 0.0 111.85 179.903 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.571 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.2 Cg_endo -60.28 -27.9 85.8 Favored 'Trans proline' 0 N--CA 1.492 1.431 0 O-C-N 123.218 1.115 . . . . 0.0 109.933 179.797 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.8 tmtm? -69.64 -46.64 65.73 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 177.872 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.601 HG13 HD21 ' A' ' 43' ' ' LEU . 44.5 mm -56.42 -31.2 32.76 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.032 179.711 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.571 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 4.7 mmmm -72.95 -37.58 67.07 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 120.079 -0.649 . . . . 0.0 110.449 -177.552 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.4 t -60.56 -24.43 65.4 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.501 -0.749 . . . . 0.0 110.649 -179.633 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -117.62 -17.03 10.04 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.49 -0.756 . . . . 0.0 111.158 -179.625 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.716 ' HB3' HD23 ' A' ' 34' ' ' LEU . 39.8 m80 -127.77 95.15 35.54 Favored Pre-proline 0 N--CA 1.496 1.865 0 O-C-N 121.297 -0.877 . . . . 0.0 109.528 179.736 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -75.1 -36.14 2.66 Favored 'Trans proline' 0 C--N 1.315 -1.197 0 O-C-N 123.54 1.284 . . . . 0.0 110.307 -179.736 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.402 ' O ' ' N ' ' A' ' 35' ' ' SER . . . -75.58 -18.46 79.77 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 110.162 -1.175 . . . . 0.0 110.162 179.771 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.824 HD13 ' HB3' ' A' ' 38' ' ' ASP . 0.3 OUTLIER -53.79 88.14 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.465 -1.021 . . . . 0.0 111.375 -179.507 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.402 ' N ' ' O ' ' A' ' 33' ' ' GLY . 45.2 t -70.88 175.91 4.7 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.517 -0.739 . . . . 0.0 109.741 179.722 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.463 ' N ' HD12 ' A' ' 36' ' ' ILE . 2.1 mp -59.64 -34.23 54.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.306 -0.871 . . . . 0.0 109.513 179.953 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -58.13 -58.83 12.53 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 109.104 -1.598 . . . . 0.0 109.104 179.63 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.824 ' HB3' HD13 ' A' ' 34' ' ' LEU . 6.5 t70 -70.21 -37.76 75.13 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.742 -0.858 . . . . 0.0 110.063 179.107 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.9 m -61.78 -31.08 71.26 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.159 -0.963 . . . . 0.0 110.107 179.268 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.94 -43.03 46.84 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.568 -0.708 . . . . 0.0 110.398 -179.845 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.42 ' HG2' ' HA ' ' A' ' 38' ' ' ASP . 2.3 ptpt -89.44 -12.97 38.69 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.595 -0.691 . . . . 0.0 111.979 -178.925 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.472 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -88.98 5.7 42.98 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 120.892 -1.13 . . . . 0.0 110.602 179.721 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.601 HD21 HG13 ' A' ' 27' ' ' ILE . 91.0 mt -107.92 -31.23 8.08 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.133 -0.979 . . . . 0.0 109.546 179.486 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.56 -31.9 82.34 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 -179.973 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -61.76 -53.84 50.51 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.564 -0.963 . . . . 0.0 109.895 179.918 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 23.6 mtt -64.19 -23.55 67.36 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.589 -0.694 . . . . 0.0 110.345 179.803 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 77.0 t-105 -78.08 -38.92 43.12 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.46 -0.775 . . . . 0.0 110.121 179.794 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 3.9 m -80.14 -25.07 40.01 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.514 -0.741 . . . . 0.0 110.58 -179.899 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -70.21 -43.86 69.8 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.42 -0.8 . . . . 0.0 109.774 179.72 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 16.3 mm-40 -56.27 154.39 8.14 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.514 -0.742 . . . . 0.0 110.579 -179.92 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.4 m -93.52 -149.76 0.27 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.653 -0.654 . . . . 0.0 109.571 179.698 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -92.26 41.81 1.08 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.262 -0.899 . . . . 0.0 110.259 179.685 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -119.46 -49.06 2.38 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.529 -0.732 . . . . 0.0 110.109 179.899 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -61.62 -27.5 68.7 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.584 -0.698 . . . . 0.0 110.533 -179.831 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.8 ttpt -82.92 -34.38 26.61 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.434 -0.791 . . . . 0.0 110.638 -179.747 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -43.33 -53.09 11.84 Favored Pre-proline 0 N--CA 1.507 2.407 0 O-C-N 121.472 -0.768 . . . . 0.0 112.317 -178.861 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -79.12 -36.44 0.71 Allowed 'Trans proline' 0 C--N 1.315 -1.19 0 O-C-N 123.14 1.074 . . . . 0.0 111.273 179.999 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -85.21 0.02 53.16 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.454 -0.779 . . . . 0.0 112.319 -178.065 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.84 -25.41 15.04 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 120.938 -1.101 . . . . 0.0 110.699 -179.384 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.462 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 3.9 pt20 -73.99 -21.56 59.95 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.468 -0.77 . . . . 0.0 110.644 179.94 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.428 ' CG ' HD13 ' A' ' 18' ' ' LEU . 31.7 tttt -60.32 -43.11 96.67 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.49 -0.756 . . . . 0.0 110.233 179.877 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -77.23 -12.32 59.93 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.4 -0.813 . . . . 0.0 110.131 179.153 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.462 ' HB3' ' O ' ' A' ' 60' ' ' GLN . . . -58.38 -38.99 78.42 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.244 -0.91 . . . . 0.0 109.229 179.223 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.6 ttpt -67.52 -61.47 1.88 Allowed 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 178.513 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.57 HD22 ' HG3' ' A' ' 13' ' ' PRO . 0.7 OUTLIER -44.74 -23.63 0.14 Allowed 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.798 -0.564 . . . . 0.0 112.328 -179.582 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 58.9 tttt -71.89 -44.43 63.76 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.256 -0.902 . . . . 0.0 108.658 178.241 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -82.26 -9.93 59.31 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.738 -0.601 . . . . 0.0 110.058 178.597 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.94 -32.56 11.6 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.309 -0.869 . . . . 0.0 109.153 179.267 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.463 ' O ' HG22 ' A' ' 73' ' ' ILE . 58.8 t80 -77.28 -51.13 11.42 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 179.131 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -70.91 -8.31 51.99 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.606 -0.684 . . . . 0.0 111.113 179.837 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.7 ttmm -108.87 -34.35 6.67 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.063 -1.023 . . . . 0.0 110.596 -179.907 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -82.24 -31.11 30.36 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.466 -0.772 . . . . 0.0 110.502 -179.853 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.463 HG22 ' O ' ' A' ' 69' ' ' TYR . 4.4 tp -68.72 -19.23 23.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 121.517 -0.739 . . . . 0.0 110.447 179.964 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -64.25 -33.5 75.95 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.48 -0.763 . . . . 0.0 109.011 179.427 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -83.09 -14.35 53.88 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.888 -0.507 . . . . 0.0 110.117 178.824 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.436 ' CD2' ' HB2' ' A' ' 8' ' ' ALA . 32.1 t80 -93.81 30.7 1.75 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.242 -0.911 . . . . 0.0 110.605 179.844 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 76.4 mtp85 -137.76 -104.76 0.19 Allowed 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 179.041 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -145.17 51.78 1.21 Allowed 'General case' 0 N--CA 1.496 1.825 0 O-C-N 120.763 -1.21 . . . . 0.0 110.239 -179.969 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.779 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.031 -179.992 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.5 ptp . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.124 0.487 . . . . 0.0 110.3 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -97.59 41.73 1.11 Allowed 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.519 -0.738 . . . . 0.0 110.233 179.984 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 27.8 ttmt -59.2 -56.39 22.71 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.523 -0.736 . . . . 0.0 110.357 -179.982 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.4 mtpt -153.45 -167.92 2.84 Favored 'General case' 0 N--CA 1.484 1.253 0 O-C-N 121.605 -0.684 . . . . 0.0 109.731 179.597 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -57.19 145.06 67.91 Favored Pre-proline 0 N--CA 1.497 1.896 0 O-C-N 121.55 -0.719 . . . . 0.0 110.488 -179.9 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -73.75 -25.29 14.77 Favored 'Trans proline' 0 C--N 1.317 -1.098 0 O-C-N 123.377 1.199 . . . . 0.0 110.459 179.96 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -79.21 -16.83 55.95 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.534 -0.728 . . . . 0.0 111.0 -179.359 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -105.4 134.14 19.82 Favored Pre-proline 0 N--CA 1.494 1.734 0 O-C-N 121.25 -0.906 . . . . 0.0 109.566 179.327 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -72.68 113.63 3.8 Favored 'Trans proline' 0 N--CA 1.486 1.033 0 O-C-N 123.097 1.051 . . . . 0.0 110.722 -179.712 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 6.7 pttt -59.47 -160.38 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.644 -0.66 . . . . 0.0 110.452 -179.724 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -57.05 149.35 45.96 Favored Pre-proline 0 N--CA 1.499 1.995 0 O-C-N 121.282 -0.886 . . . . 0.0 110.786 -179.884 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.408 ' HD3' ' CE2' ' A' ' 69' ' ' TYR . 49.6 Cg_endo -76.41 124.37 7.68 Favored 'Trans proline' 0 C--N 1.317 -1.114 0 O-C-N 123.455 1.24 . . . . 0.0 109.651 179.31 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.513 ' C ' ' HB1' ' A' ' 62' ' ' ALA . 47.6 Cg_endo -81.2 177.08 8.17 Favored 'Trans proline' 0 C--N 1.316 -1.139 0 O-C-N 123.261 1.137 . . . . 0.0 110.158 -179.644 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.566 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 8.9 t -167.77 60.13 0.07 Allowed 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.458 -0.776 . . . . 0.0 110.684 -179.766 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.593 ' HB2' ' HA ' ' A' ' 59' ' ' GLU . . . 70.14 -74.79 0.08 Allowed 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.199 -0.938 . . . . 0.0 110.1 -179.469 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 20.1 t80 -48.76 -50.42 33.97 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.347 -0.846 . . . . 0.0 111.241 -179.643 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -58.91 -40.96 86.11 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.593 -0.692 . . . . 0.0 109.477 179.431 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.743 HD11 ' HB2' ' A' ' 62' ' ' ALA . 53.2 mt -61.67 -46.61 89.01 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.681 -0.637 . . . . 0.0 109.884 179.732 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.499 ' CE2' ' CE2' ' A' ' 23' ' ' TYR . 23.6 t80 -65.88 -50.43 64.56 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.715 -0.616 . . . . 0.0 110.252 -179.891 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.3 m -65.71 -29.1 69.59 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.673 -0.642 . . . . 0.0 110.057 179.981 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.7 m -67.85 -23.68 65.18 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.559 -0.713 . . . . 0.0 110.75 -179.749 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -110.2 -27.76 8.97 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.38 -0.825 . . . . 0.0 111.42 -179.104 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.499 ' CE2' ' CE2' ' A' ' 19' ' ' PHE . 7.2 m-85 -81.6 -37.23 27.96 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.18 -0.95 . . . . 0.0 110.849 -179.238 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.534 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 11.2 mtt85 -48.76 -51.75 51.27 Favored Pre-proline 0 N--CA 1.495 1.802 0 O-C-N 121.305 -0.872 . . . . 0.0 111.823 -179.974 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.534 ' HD2' ' N ' ' A' ' 24' ' ' ARG . 36.0 Cg_endo -59.71 -27.62 85.39 Favored 'Trans proline' 0 N--CA 1.492 1.421 0 O-C-N 123.137 1.072 . . . . 0.0 109.821 179.455 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.88 -48.09 48.23 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 177.349 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.643 HG13 HD21 ' A' ' 43' ' ' LEU . 41.6 mm -54.71 -33.02 26.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.479 179.826 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.553 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER -68.23 -31.26 70.63 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.569 -0.707 . . . . 0.0 110.399 -177.579 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.9 t -82.11 -17.86 45.02 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.505 -0.747 . . . . 0.0 111.195 -179.853 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -114.72 -15.94 11.85 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.179 -0.951 . . . . 0.0 111.362 -179.485 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.567 ' HB3' ' CB ' ' A' ' 34' ' ' LEU . 25.0 m80 -117.26 91.92 38.43 Favored Pre-proline 0 N--CA 1.499 1.977 0 O-C-N 121.27 -0.894 . . . . 0.0 109.634 -179.702 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -77.43 -71.74 0.01 OUTLIER 'Trans proline' 0 N--CA 1.484 0.969 0 O-C-N 123.378 1.199 . . . . 0.0 111.689 -179.199 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -56.26 -21.93 34.89 Favored Glycine 0 N--CA 1.499 2.867 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 -179.752 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.786 HD23 ' O ' ' A' ' 34' ' ' LEU . 7.8 tt -53.41 92.85 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.48 -1.012 . . . . 0.0 110.845 179.506 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 18.8 m -57.7 175.53 0.18 Allowed 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.461 -0.774 . . . . 0.0 110.116 -179.386 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.414 HD13 ' HA ' ' A' ' 36' ' ' ILE . 14.7 mm -56.19 -61.32 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 O-C-N 121.351 -0.843 . . . . 0.0 110.312 -179.897 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.444 ' O ' ' HE2' ' A' ' 41' ' ' LYS . . . -48.59 -38.19 21.15 Favored Glycine 0 N--CA 1.497 2.701 0 N-CA-C 110.319 -1.112 . . . . 0.0 110.319 -179.12 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.42 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 33.4 m-20 -65.39 -36.5 84.15 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.558 -0.966 . . . . 0.0 109.737 178.755 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.599 ' CA ' HD21 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -60.95 -36.43 79.36 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.571 -0.705 . . . . 0.0 110.678 179.743 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.98 -49.64 17.12 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.526 -0.734 . . . . 0.0 110.242 -179.713 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.444 ' HE2' ' O ' ' A' ' 37' ' ' GLY . 0.9 OUTLIER -74.71 -13.41 60.61 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.602 -0.686 . . . . 0.0 111.294 -179.621 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.42 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 5.4 tptt -84.63 -59.73 2.28 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 120.933 -1.104 . . . . 0.0 109.836 179.339 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.643 HD21 HG13 ' A' ' 27' ' ' ILE . 16.3 mt -49.15 -29.25 5.17 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.541 -0.724 . . . . 0.0 111.043 -179.819 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.27 -38.58 96.69 Favored Glycine 0 N--CA 1.493 2.444 0 N-CA-C 109.425 -1.47 . . . . 0.0 109.425 179.934 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -50.56 -33.89 23.57 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.445 -1.032 . . . . 0.0 111.041 -179.708 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 31.9 mtt -86.69 -41.31 14.29 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.536 -0.728 . . . . 0.0 110.495 -179.793 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 72.3 t-105 -55.55 -21.21 16.05 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.502 -0.749 . . . . 0.0 111.136 -179.421 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 7.6 t -93.01 -33.46 14.12 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.324 -0.86 . . . . 0.0 110.239 -179.979 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -63.27 -36.32 83.28 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.637 -0.665 . . . . 0.0 110.067 179.891 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -62.56 150.68 39.82 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.587 -0.696 . . . . 0.0 110.201 179.949 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 83.9 p -98.22 -152.08 0.39 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.611 -0.681 . . . . 0.0 109.588 179.677 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -82.58 56.57 3.38 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.305 -0.872 . . . . 0.0 110.053 179.794 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -134.98 -46.03 0.72 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.444 -0.785 . . . . 0.0 110.198 179.932 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -63.72 -31.14 72.22 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.545 -0.722 . . . . 0.0 110.457 -179.708 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.401 ' O ' ' HB3' ' A' ' 59' ' ' GLU . 19.8 ttpt -99.09 22.75 9.92 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.46 -0.775 . . . . 0.0 110.824 -179.73 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.453 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 4.9 mt-30 -93.44 -59.79 0.2 Allowed Pre-proline 0 N--CA 1.495 1.807 0 O-C-N 121.146 -0.971 . . . . 0.0 110.787 -179.659 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.453 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.5 Cg_endo -79.28 -27.3 4.44 Favored 'Trans proline' 0 N--CA 1.486 1.071 0 O-C-N 122.953 0.975 . . . . 0.0 111.468 -179.58 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.432 ' CE2' ' HB3' ' A' ' 18' ' ' LEU . 0.1 OUTLIER -84.48 -21.12 30.74 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.354 -0.841 . . . . 0.0 111.914 -178.163 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.593 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.2 OUTLIER -69.61 -27.08 64.77 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.245 -0.909 . . . . 0.0 111.033 -179.287 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -78.14 -20.03 52.87 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.42 -0.8 . . . . 0.0 110.508 179.923 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 58.1 tttt -64.05 -46.38 84.63 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.462 -0.773 . . . . 0.0 109.803 179.717 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.743 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -77.5 -13.14 59.99 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.555 -0.715 . . . . 0.0 110.532 179.578 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -78.21 -3.0 40.49 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.325 -0.86 . . . . 0.0 110.081 178.832 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 26.2 mmtm -105.25 -25.31 12.49 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.108 -0.995 . . . . 0.0 110.068 179.507 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.2 mp -88.8 -16.21 32.66 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.749 -0.595 . . . . 0.0 109.926 178.704 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.5 tptt -74.7 -35.89 62.72 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.46 -0.775 . . . . 0.0 109.482 179.397 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -67.2 -57.48 6.65 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.686 -0.634 . . . . 0.0 109.829 179.776 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -58.28 -26.72 63.32 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.601 -0.687 . . . . 0.0 110.593 -179.955 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.631 ' HE1' HD13 ' A' ' 73' ' ' ILE . 37.0 t80 -73.63 -68.25 0.52 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.473 -0.767 . . . . 0.0 109.445 179.503 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -55.34 -21.15 13.95 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.798 -0.564 . . . . 0.0 111.211 -179.772 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -95.46 -19.1 20.14 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.423 -0.798 . . . . 0.0 111.316 -179.485 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -109.73 -31.93 7.27 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.242 -0.911 . . . . 0.0 110.907 -179.537 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.631 HD13 ' HE1' ' A' ' 69' ' ' TYR . 2.5 tp -67.05 -33.13 61.3 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 C-N-CA 119.822 -0.751 . . . . 0.0 110.024 -179.733 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.19 -35.68 74.01 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.615 -0.678 . . . . 0.0 109.907 179.702 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -91.62 -20.0 22.1 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.659 -0.651 . . . . 0.0 110.241 179.469 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -73.14 -41.13 64.3 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.409 -0.807 . . . . 0.0 110.198 179.813 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 36.1 mtt180 -94.04 6.02 49.86 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.511 -0.743 . . . . 0.0 111.081 179.982 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 56.32 68.14 0.9 Allowed 'General case' 0 N--CA 1.502 2.126 0 O-C-N 120.982 -1.074 . . . . 0.0 110.419 -179.738 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.2 ptmm? . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.365 179.81 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.1 tpt . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.051 0.453 . . . . 0.0 110.199 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -104.56 175.36 5.52 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.543 -0.723 . . . . 0.0 110.26 179.904 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 66.7 tttt -169.94 34.43 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.601 -0.687 . . . . 0.0 110.23 179.857 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.7 mttt 53.89 -161.42 0.13 Allowed 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.469 -0.769 . . . . 0.0 110.677 179.837 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -133.36 177.23 2.35 Favored Pre-proline 0 N--CA 1.494 1.729 0 O-C-N 121.583 -0.698 . . . . 0.0 110.125 -179.765 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.19 -28.27 18.91 Favored 'Trans proline' 0 N--CA 1.487 1.091 0 O-C-N 123.415 1.219 . . . . 0.0 110.376 -179.856 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 -78.67 -23.28 45.79 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.61 -0.682 . . . . 0.0 110.399 -179.389 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.453 ' HB2' ' CZ ' ' A' ' 76' ' ' TYR . . . -99.1 133.69 21.95 Favored Pre-proline 0 N--CA 1.492 1.675 0 O-C-N 121.384 -0.823 . . . . 0.0 109.395 179.15 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -71.65 111.64 3.18 Favored 'Trans proline' 0 C--N 1.318 -1.043 0 O-C-N 123.138 1.072 . . . . 0.0 110.517 -179.517 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.7 pttt -67.97 -160.17 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.541 -0.725 . . . . 0.0 109.751 179.815 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -60.44 141.03 91.86 Favored Pre-proline 0 N--CA 1.497 1.898 0 O-C-N 121.359 -0.838 . . . . 0.0 109.88 179.769 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.411 ' HD3' ' CZ ' ' A' ' 69' ' ' TYR . 46.8 Cg_endo -73.77 129.87 14.0 Favored 'Trans proline' 0 C--N 1.317 -1.094 0 O-C-N 123.248 1.131 . . . . 0.0 110.193 -179.897 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.612 ' HB2' HD21 ' A' ' 18' ' ' LEU . 49.1 Cg_endo -81.26 -179.59 5.13 Favored 'Trans proline' 0 C--N 1.318 -1.051 0 O-C-N 123.271 1.143 . . . . 0.0 110.08 -179.94 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.557 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 32.2 t -170.01 62.51 0.05 OUTLIER 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.505 -0.747 . . . . 0.0 110.828 -179.928 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.557 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 70.88 -75.98 0.07 Allowed 'General case' 0 N--CA 1.505 2.308 0 O-C-N 121.043 -1.035 . . . . 0.0 110.504 -179.601 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -50.78 -45.83 59.31 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.23 -0.919 . . . . 0.0 110.952 -179.823 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -61.45 -34.35 75.27 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 120.183 -0.607 . . . . 0.0 109.71 179.622 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.612 HD21 ' HB2' ' A' ' 13' ' ' PRO . 29.8 mt -76.44 -40.16 51.38 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.486 -0.759 . . . . 0.0 110.404 -179.539 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.494 ' CE2' ' CZ ' ' A' ' 23' ' ' TYR . 32.0 t80 -66.45 -51.18 59.61 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.554 -0.716 . . . . 0.0 110.586 -179.43 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 2.2 t -65.7 -28.94 69.44 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.453 -0.78 . . . . 0.0 110.051 179.707 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.9 m -70.06 -15.87 63.06 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.647 -0.658 . . . . 0.0 111.54 -179.273 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -125.65 -25.72 3.64 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.068 -1.02 . . . . 0.0 112.133 -179.116 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.494 ' CZ ' ' CE2' ' A' ' 19' ' ' PHE . 10.6 m-85 -76.95 -38.47 53.25 Favored 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.165 -0.959 . . . . 0.0 110.798 -179.448 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.491 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 2.1 mtt180 -48.08 -53.33 33.86 Favored Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 121.359 -0.838 . . . . 0.0 112.415 -179.527 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.534 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.2 Cg_endo -59.61 -27.66 85.49 Favored 'Trans proline' 0 N--CA 1.494 1.517 0 O-C-N 123.221 1.116 . . . . 0.0 110.185 -179.624 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.0 tmtm? -70.46 -46.78 63.16 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 177.542 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.655 HG13 HD21 ' A' ' 43' ' ' LEU . 46.1 mm -57.71 -21.68 16.74 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.632 179.724 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.535 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 4.9 mmmm -81.06 -26.96 35.91 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.141 -0.974 . . . . 0.0 110.426 -177.573 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.8 t -86.28 -3.23 58.94 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.482 -0.761 . . . . 0.0 111.119 179.627 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -132.51 -2.01 3.45 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.062 -1.024 . . . . 0.0 112.018 -179.464 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.59 ' CB ' HD13 ' A' ' 34' ' ' LEU . 54.4 m80 -126.33 95.65 38.15 Favored Pre-proline 0 N--CA 1.499 2.015 0 O-C-N 120.915 -1.116 . . . . 0.0 109.779 179.924 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -78.34 -75.41 0.01 OUTLIER 'Trans proline' 0 N--CA 1.485 0.979 0 O-C-N 123.43 1.226 . . . . 0.0 111.708 -179.301 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -51.35 -28.71 20.91 Favored Glycine 0 N--CA 1.503 3.113 0 N-CA-C 110.343 -1.103 . . . . 0.0 110.343 -179.483 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.746 HD23 ' O ' ' A' ' 34' ' ' LEU . 7.8 tt -46.59 96.04 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.792 -0.828 . . . . 0.0 111.455 179.844 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 44.8 m -66.52 178.3 1.3 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.675 -0.64 . . . . 0.0 109.863 -179.77 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.403 ' HA ' HD13 ' A' ' 36' ' ' ILE . 13.8 mm -58.72 -61.44 1.4 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.053 0 O-C-N 121.46 -0.775 . . . . 0.0 110.201 179.908 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.457 ' O ' ' HE2' ' A' ' 41' ' ' LYS . . . -46.9 -38.34 10.18 Favored Glycine 0 N--CA 1.498 2.777 0 N-CA-C 110.617 -0.993 . . . . 0.0 110.617 -178.806 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.462 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 1.6 m-20 -68.57 -33.44 74.09 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.585 -0.95 . . . . 0.0 110.055 178.917 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.536 HG23 HD21 ' A' ' 34' ' ' LEU . 0.2 OUTLIER -67.34 -38.63 85.14 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.333 -0.854 . . . . 0.0 110.776 179.69 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.2 -38.36 78.58 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.65 -0.656 . . . . 0.0 110.121 -179.226 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.457 ' HE2' ' O ' ' A' ' 37' ' ' GLY . 1.2 ptpm? -89.72 -13.8 36.06 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 119.988 -0.685 . . . . 0.0 111.167 -179.69 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 3.4 tptt -87.66 -9.33 54.5 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.006 -1.058 . . . . 0.0 110.556 179.015 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.655 HD21 HG13 ' A' ' 27' ' ' ILE . 22.4 mt -95.11 -32.82 12.91 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.39 -0.819 . . . . 0.0 109.287 179.362 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.91 -35.42 72.36 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 108.605 -1.798 . . . . 0.0 108.605 179.178 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -57.13 -39.26 74.8 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.633 -0.922 . . . . 0.0 110.363 179.881 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 30.5 mtt -77.69 -48.69 16.12 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.54 -0.725 . . . . 0.0 110.355 179.991 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 68.8 t-105 -58.3 -25.46 61.87 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.539 -0.726 . . . . 0.0 110.659 -179.712 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 62.5 p -85.9 -37.26 19.3 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.394 -0.816 . . . . 0.0 110.054 179.963 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -63.92 -31.95 73.31 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.523 -0.736 . . . . 0.0 109.967 179.873 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 89.4 mm-40 -62.28 148.73 44.06 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.58 -0.7 . . . . 0.0 110.134 179.889 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.8 m -101.41 -153.01 0.44 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.58 -0.7 . . . . 0.0 109.621 179.724 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -82.52 56.34 3.27 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.344 -0.847 . . . . 0.0 110.119 179.753 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 17.6 tptt -132.25 -49.29 0.93 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.449 -0.782 . . . . 0.0 110.133 -179.994 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -66.8 -35.7 80.68 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.57 -0.706 . . . . 0.0 110.46 -179.948 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.419 ' O ' ' N ' ' A' ' 59' ' ' GLU . 17.6 tttt -71.59 -37.78 70.96 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.552 -0.718 . . . . 0.0 110.864 -179.669 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.402 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 5.0 mm-40 -43.53 -57.19 5.9 Favored Pre-proline 0 N--CA 1.507 2.406 0 O-C-N 121.318 -0.864 . . . . 0.0 112.751 -178.674 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.402 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.0 Cg_endo -77.19 -36.21 1.44 Allowed 'Trans proline' 0 N--CA 1.489 1.255 0 O-C-N 123.071 1.037 . . . . 0.0 111.903 -179.52 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -83.46 -12.28 56.53 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.352 -0.843 . . . . 0.0 112.561 -177.645 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.419 ' N ' ' O ' ' A' ' 55' ' ' LYS . 0.0 OUTLIER -82.72 -27.47 31.13 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.033 -1.042 . . . . 0.0 111.112 -179.165 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -74.01 -20.04 60.45 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.343 -0.848 . . . . 0.0 110.751 -179.987 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 43.5 tttm -65.8 -42.08 91.11 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.286 -0.883 . . . . 0.0 109.962 179.796 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.566 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -81.34 -16.79 51.29 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.599 -0.688 . . . . 0.0 110.224 179.385 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.27 -36.86 78.77 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.343 -0.848 . . . . 0.0 110.306 179.89 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -70.82 -62.34 1.43 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.239 -0.913 . . . . 0.0 110.003 179.858 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.436 ' H ' HD12 ' A' ' 65' ' ' LEU . 4.7 mp -46.88 -24.15 0.55 Allowed 'General case' 0 N--CA 1.505 2.291 0 O-C-N 121.555 -0.716 . . . . 0.0 112.157 -179.453 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.8 tptm -68.23 -48.14 65.95 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.299 -0.876 . . . . 0.0 109.506 179.189 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -65.0 -55.49 18.7 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.735 -0.603 . . . . 0.0 109.953 179.718 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 60.3 mttm -56.67 -26.89 57.56 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.467 -0.771 . . . . 0.0 110.481 179.888 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.449 ' O ' HG22 ' A' ' 73' ' ' ILE . 50.1 t80 -75.91 -67.99 0.62 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.499 -0.751 . . . . 0.0 109.296 179.385 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -51.36 -24.34 4.66 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.662 -0.648 . . . . 0.0 111.478 -179.548 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 46.8 mttp -92.62 -62.53 1.38 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.439 -0.788 . . . . 0.0 110.917 -179.44 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -58.1 -31.04 66.74 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.609 -0.682 . . . . 0.0 111.135 -179.078 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.449 HG22 ' O ' ' A' ' 69' ' ' TYR . 4.6 tp -62.48 -35.84 71.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 O-C-N 121.342 -0.849 . . . . 0.0 110.457 -179.474 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.98 -52.5 65.13 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.571 -0.706 . . . . 0.0 110.095 -179.949 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.89 -25.92 61.25 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.656 -0.653 . . . . 0.0 110.122 179.682 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.453 ' CZ ' ' HB2' ' A' ' 8' ' ' ALA . 75.5 t80 -66.27 -31.52 72.37 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.569 -0.707 . . . . 0.0 110.073 179.92 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 17.7 mtt-85 -84.23 -80.84 0.19 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.65 -0.656 . . . . 0.0 110.082 -179.958 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -168.71 44.8 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.264 -0.897 . . . . 0.0 110.076 -179.932 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 15.2 mtmt . . . . . 0 N--CA 1.494 1.735 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.232 -179.972 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.5 ttt . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.035 0.445 . . . . 0.0 110.26 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -100.89 108.32 20.05 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.667 -0.645 . . . . 0.0 110.197 179.977 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -70.6 68.24 0.38 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.604 -0.685 . . . . 0.0 110.423 -179.782 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.407 ' HB2' ' HD2' ' A' ' 10' ' ' LYS . 5.3 mtpt -66.66 -137.11 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.524 -0.735 . . . . 0.0 109.843 179.99 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -171.01 175.01 1.41 Allowed Pre-proline 0 N--CA 1.496 1.842 0 O-C-N 120.695 -1.253 . . . . 0.0 109.681 179.978 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -69.84 -34.68 13.85 Favored 'Trans proline' 0 N--CA 1.488 1.154 0 O-C-N 123.273 1.144 . . . . 0.0 109.926 179.744 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 21.7 p30 -76.92 5.85 7.22 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.777 -0.577 . . . . 0.0 112.056 -177.591 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -98.4 155.74 36.52 Favored Pre-proline 0 N--CA 1.492 1.665 0 O-C-N 120.927 -1.108 . . . . 0.0 108.304 177.68 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.424 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 53.7 Cg_endo -84.73 43.37 1.3 Allowed 'Trans proline' 0 C--N 1.315 -1.202 0 O-C-N 123.047 1.025 . . . . 0.0 112.123 -179.264 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.407 ' HD2' ' HB2' ' A' ' 4' ' ' LYS . 9.5 mtpt -43.3 139.91 1.78 Allowed 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.396 -0.815 . . . . 0.0 112.872 -179.065 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 4.7 tpt180 49.79 99.82 0.04 OUTLIER Pre-proline 0 N--CA 1.497 1.923 0 O-C-N 121.795 -0.566 . . . . 0.0 112.156 178.911 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.408 ' HB3' ' CD2' ' A' ' 69' ' ' TYR . 47.1 Cg_endo -75.79 132.21 14.17 Favored 'Trans proline' 0 C--N 1.318 -1.028 0 O-C-N 123.248 1.131 . . . . 0.0 109.321 178.581 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.55 ' HG3' HD22 ' A' ' 65' ' ' LEU . 50.1 Cg_endo -80.06 155.88 23.02 Favored 'Trans proline' 0 C--N 1.316 -1.152 0 O-C-N 123.161 1.085 . . . . 0.0 110.196 -179.576 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.573 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 7.6 t -158.73 51.43 0.39 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.515 -0.741 . . . . 0.0 110.961 -179.584 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.573 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 71.58 -73.83 0.09 Allowed 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.348 -0.845 . . . . 0.0 110.403 -179.518 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -46.71 -53.72 11.16 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.327 -0.858 . . . . 0.0 111.442 -179.561 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -55.61 -40.93 72.75 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.518 -0.739 . . . . 0.0 109.965 179.512 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.503 HD11 ' HB2' ' A' ' 62' ' ' ALA . 56.4 mt -62.09 -41.41 98.16 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.719 -0.613 . . . . 0.0 109.834 179.819 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 67.7 t80 -75.19 -53.89 8.05 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.592 -0.692 . . . . 0.0 110.232 -179.996 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 3.7 m -55.44 -55.96 25.7 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.435 -0.791 . . . . 0.0 110.434 -179.976 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 62.9 p -53.6 -29.92 39.97 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.467 -0.771 . . . . 0.0 110.521 179.994 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -88.56 -32.51 18.1 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.618 -0.677 . . . . 0.0 110.74 -179.781 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -94.63 13.61 23.7 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.451 -0.781 . . . . 0.0 111.513 -179.446 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.551 ' CG ' HD11 ' A' ' 43' ' ' LEU . 8.5 mtt180 -88.37 -42.92 0.47 Allowed Pre-proline 0 N--CA 1.488 1.434 0 O-C-N 121.192 -0.942 . . . . 0.0 112.367 179.471 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.58 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 38.1 Cg_endo -67.04 -16.95 50.68 Favored 'Trans proline' 0 N--CA 1.491 1.366 0 O-C-N 122.711 0.848 . . . . 0.0 110.427 -179.203 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.41 -50.78 23.91 Favored 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 177.859 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 39.0 mm -52.93 -32.7 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 CA-C-O 121.49 0.662 . . . . 0.0 110.281 179.641 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.58 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 5.6 mmmm -72.37 -37.43 68.77 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 120.261 -0.576 . . . . 0.0 110.252 -177.215 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.0 t -59.91 -24.57 64.43 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.377 -0.827 . . . . 0.0 110.619 -179.699 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -116.37 -21.83 9.08 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.455 -0.778 . . . . 0.0 110.903 -179.609 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.775 ' HB3' HD23 ' A' ' 34' ' ' LEU . 43.7 m80 -121.71 96.32 47.34 Favored Pre-proline 0 N--CA 1.495 1.788 0 O-C-N 121.342 -0.849 . . . . 0.0 109.682 179.93 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -74.98 -33.27 4.74 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.366 1.193 . . . . 0.0 110.361 -179.817 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -79.48 -11.8 84.46 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 110.35 -1.1 . . . . 0.0 110.35 179.805 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.775 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -62.46 81.64 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.287 -1.125 . . . . 0.0 110.753 -179.668 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.1 t -74.89 177.9 5.94 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.425 -0.797 . . . . 0.0 109.721 179.721 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 37.3 mm -51.33 -37.25 18.21 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.207 0 O-C-N 121.234 -0.916 . . . . 0.0 110.586 -179.899 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -55.57 -68.94 1.43 Allowed Glycine 0 N--CA 1.494 2.502 0 N-CA-C 109.328 -1.509 . . . . 0.0 109.328 179.824 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.533 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 1.9 m-20 -66.19 -29.65 69.97 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.786 -0.832 . . . . 0.0 110.724 179.475 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 75.1 m -66.58 -29.26 69.27 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.164 -0.96 . . . . 0.0 110.291 179.648 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.11 -45.05 59.27 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.553 -0.717 . . . . 0.0 109.948 179.848 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -82.92 -17.72 42.66 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.668 -0.645 . . . . 0.0 112.213 -178.897 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.533 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -82.18 3.18 28.25 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 120.762 -1.211 . . . . 0.0 110.818 179.665 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.551 HD11 ' CG ' ' A' ' 24' ' ' ARG . 34.1 mt -105.79 -29.44 10.04 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.268 -0.895 . . . . 0.0 109.632 179.502 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -69.09 -37.8 82.85 Favored Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -179.79 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -50.16 -36.02 28.46 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.428 -1.043 . . . . 0.0 110.906 -179.644 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 64.2 mtm -87.27 -39.24 15.58 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.518 -0.739 . . . . 0.0 109.946 179.614 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 67.3 t-105 -55.56 -31.07 61.85 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.605 -0.684 . . . . 0.0 110.994 -179.643 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 47.2 t -87.35 -32.84 19.4 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.276 -0.89 . . . . 0.0 110.229 -179.802 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -63.66 -37.06 85.92 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.509 -0.744 . . . . 0.0 109.915 179.869 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.0 mm-40 -59.7 149.68 29.99 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.628 -0.67 . . . . 0.0 110.336 179.919 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 85.6 p -92.83 -152.15 0.31 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.688 -0.633 . . . . 0.0 109.613 179.679 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -83.67 55.55 3.27 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.313 -0.867 . . . . 0.0 110.151 179.82 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -135.95 -43.61 0.65 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.453 -0.779 . . . . 0.0 110.255 -179.936 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -62.49 -33.85 75.7 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.457 -0.777 . . . . 0.0 110.336 -179.904 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.9 tmtp? -96.87 22.35 8.41 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.442 -0.786 . . . . 0.0 111.092 -179.556 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.464 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 2.6 mm100 -92.19 -57.46 0.24 Allowed Pre-proline 0 N--CA 1.496 1.852 0 O-C-N 121.072 -1.017 . . . . 0.0 110.278 179.889 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.464 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 57.5 Cg_endo -82.96 -26.35 2.42 Favored 'Trans proline' 0 N--CA 1.484 0.945 0 O-C-N 122.929 0.963 . . . . 0.0 110.748 179.568 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -83.21 -18.54 38.92 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.456 -0.777 . . . . 0.0 111.955 -178.149 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.436 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.3 OUTLIER -77.2 -26.14 52.48 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.175 -0.953 . . . . 0.0 110.944 -179.288 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -79.45 -21.31 45.64 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.501 -0.75 . . . . 0.0 110.648 179.947 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 62.2 tttt -65.9 -44.33 85.57 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.455 -0.778 . . . . 0.0 109.74 179.643 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.503 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -79.99 -15.13 57.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.581 -0.699 . . . . 0.0 110.161 179.174 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.08 -32.97 72.61 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.351 -0.843 . . . . 0.0 109.942 179.592 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -77.59 -63.9 1.27 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.579 -0.701 . . . . 0.0 109.73 179.45 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.55 HD22 ' HG3' ' A' ' 13' ' ' PRO . 5.0 mp -50.1 -25.68 3.72 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.48 -0.762 . . . . 0.0 111.114 -179.807 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -67.19 -49.95 62.74 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.523 -0.736 . . . . 0.0 109.373 179.307 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -61.98 -49.31 76.61 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.68 -0.637 . . . . 0.0 109.351 179.298 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 37.1 mttp -60.33 -27.37 67.3 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.719 -0.613 . . . . 0.0 110.067 179.444 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.598 ' O ' HG22 ' A' ' 73' ' ' ILE . 19.8 t80 -74.2 -65.11 0.89 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.378 -0.826 . . . . 0.0 109.13 179.024 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -58.1 -25.5 61.42 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.784 -0.572 . . . . 0.0 111.115 -179.495 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.2 mmmt -91.83 -14.25 30.06 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.354 -0.841 . . . . 0.0 111.89 -179.102 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -111.84 -30.13 7.41 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.057 -1.027 . . . . 0.0 110.902 -179.624 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.598 HG22 ' O ' ' A' ' 69' ' ' TYR . 2.5 tp -66.99 -36.21 76.57 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.529 -0.732 . . . . 0.0 110.115 -179.787 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.02 -49.83 76.4 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.527 -0.733 . . . . 0.0 110.019 179.809 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -75.49 -17.87 60.0 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.656 -0.653 . . . . 0.0 110.377 179.453 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 62.2 t80 -77.6 -34.95 53.29 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.396 -0.815 . . . . 0.0 110.043 179.809 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 35.0 mtt180 -84.54 6.87 21.99 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.644 -0.66 . . . . 0.0 111.153 -179.98 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 51.12 88.5 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.08 -1.013 . . . . 0.0 110.982 179.844 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.79 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.191 179.897 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.1 ttt . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 121.124 0.488 . . . . 0.0 110.183 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.79 37.58 4.05 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.564 -0.71 . . . . 0.0 110.246 179.981 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 68.6 tttt -169.47 121.95 0.74 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.571 -0.706 . . . . 0.0 109.991 179.885 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 25.0 mtmm -61.25 -83.45 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.67 -0.644 . . . . 0.0 110.624 -179.55 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -138.6 163.86 43.97 Favored Pre-proline 0 N--CA 1.495 1.785 0 O-C-N 121.16 -0.963 . . . . 0.0 111.332 -179.339 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_endo -73.01 -9.49 23.61 Favored 'Trans proline' 0 N--CA 1.49 1.277 0 O-C-N 123.709 1.373 . . . . 0.0 111.729 179.698 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -108.52 -25.3 11.0 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.377 -0.827 . . . . 0.0 109.751 179.264 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -95.25 140.87 22.58 Favored Pre-proline 0 N--CA 1.494 1.743 0 O-C-N 121.628 -0.67 . . . . 0.0 110.046 179.777 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.403 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 46.5 Cg_endo -74.99 124.48 8.66 Favored 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.28 1.147 . . . . 0.0 110.499 -179.816 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.3 pttt -70.82 -154.84 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.529 -0.732 . . . . 0.0 109.73 179.651 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.26 141.65 87.0 Favored Pre-proline 0 N--CA 1.498 1.956 0 O-C-N 121.374 -0.829 . . . . 0.0 109.806 179.661 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -74.1 133.39 17.97 Favored 'Trans proline' 0 C--N 1.318 -1.076 0 O-C-N 123.305 1.16 . . . . 0.0 110.321 -179.811 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.553 ' HB2' HD21 ' A' ' 18' ' ' LEU . 50.8 Cg_endo -80.94 173.7 11.71 Favored 'Trans proline' 0 C--N 1.319 -1.004 0 O-C-N 123.299 1.157 . . . . 0.0 109.903 179.909 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.562 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 37.2 t -170.53 62.9 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.44 -0.787 . . . . 0.0 110.868 -179.899 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.562 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 69.7 -76.31 0.06 Allowed 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.041 -1.037 . . . . 0.0 110.452 -179.62 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -47.67 -50.22 25.36 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.267 -0.896 . . . . 0.0 111.267 -179.463 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -58.73 -35.78 73.25 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.67 -0.643 . . . . 0.0 110.108 179.785 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.662 HD11 ' HB2' ' A' ' 62' ' ' ALA . 24.1 mt -74.4 -35.01 63.43 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.501 -0.749 . . . . 0.0 110.228 -179.581 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . 0.502 ' CE2' ' CZ ' ' A' ' 23' ' ' TYR . 54.9 t80 -74.28 -54.2 8.17 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.599 -0.688 . . . . 0.0 110.626 -179.373 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.458 ' SG ' HD13 ' A' ' 43' ' ' LEU . 1.8 t -59.54 -48.77 80.36 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.583 -0.698 . . . . 0.0 110.489 -179.744 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.7 t -58.63 -26.05 63.32 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.509 -0.744 . . . . 0.0 110.671 -179.694 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -99.13 -22.03 15.87 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.519 -0.738 . . . . 0.0 111.212 -179.316 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.502 ' CZ ' ' CE2' ' A' ' 19' ' ' PHE . 7.1 m-85 -92.68 -36.38 12.98 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.389 -0.819 . . . . 0.0 110.829 -179.466 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.49 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 9.6 mtt180 -47.59 -53.56 29.34 Favored Pre-proline 0 N--CA 1.499 1.986 0 O-C-N 121.38 -0.825 . . . . 0.0 112.215 -179.55 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.529 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 36.8 Cg_endo -60.64 -26.93 83.93 Favored 'Trans proline' 0 N--CA 1.494 1.544 0 O-C-N 123.198 1.104 . . . . 0.0 110.021 179.997 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.06 -47.13 63.25 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 177.726 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.463 HG22 ' HG ' ' A' ' 34' ' ' LEU . 46.5 mm -55.97 -22.7 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.328 179.551 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.716 ' NZ ' HD12 ' A' ' 34' ' ' LEU . 16.1 mmmt -82.74 -29.64 29.6 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.327 -0.858 . . . . 0.0 111.34 -176.717 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.9 t -72.91 -34.73 66.81 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.177 -0.952 . . . . 0.0 110.18 -179.627 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -97.67 -4.43 37.36 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.72 -0.612 . . . . 0.0 111.226 -179.258 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.454 ' CB ' ' HB2' ' A' ' 34' ' ' LEU . 27.8 m80 -140.08 96.46 8.14 Favored Pre-proline 0 N--CA 1.493 1.703 0 O-C-N 121.26 -0.9 . . . . 0.0 108.698 179.016 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -75.03 -47.36 0.2 Allowed 'Trans proline' 0 C--N 1.315 -1.205 0 O-C-N 123.481 1.253 . . . . 0.0 110.662 -179.306 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -63.59 -20.59 63.92 Favored Glycine 0 N--CA 1.494 2.513 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 179.03 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.716 HD12 ' NZ ' ' A' ' 28' ' ' LYS . 0.2 OUTLIER -48.01 92.22 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.471 -1.017 . . . . 0.0 111.705 -179.769 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.8 m -66.89 -179.3 0.88 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.497 -0.752 . . . . 0.0 109.461 179.3 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.421 HD13 ' HA ' ' A' ' 36' ' ' ILE . 17.8 mm -60.78 -56.39 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.382 -0.824 . . . . 0.0 109.843 179.946 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.43 ' O ' ' HE2' ' A' ' 41' ' ' LYS . . . -49.89 -43.41 39.48 Favored Glycine 0 N--CA 1.497 2.754 0 N-CA-C 110.394 -1.082 . . . . 0.0 110.394 -179.018 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.637 ' HB2' HD13 ' A' ' 34' ' ' LEU . 40.5 m-20 -61.5 -36.17 79.73 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.636 -0.92 . . . . 0.0 109.993 178.949 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.52 ' O ' HD12 ' A' ' 43' ' ' LEU . 10.9 m -60.08 -36.9 78.4 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.28 -0.887 . . . . 0.0 110.785 179.573 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.54 -54.02 6.91 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.624 -0.673 . . . . 0.0 110.357 -179.695 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.43 ' HE2' ' O ' ' A' ' 37' ' ' GLY . 1.8 ptpm? -67.39 -28.34 67.84 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.63 -0.669 . . . . 0.0 111.458 -179.23 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.486 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -81.5 -2.01 48.18 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.911 -1.118 . . . . 0.0 110.916 179.697 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.52 HD12 ' O ' ' A' ' 39' ' ' THR . 26.2 mt -106.6 -34.12 7.44 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.203 -0.935 . . . . 0.0 110.174 -179.904 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -65.5 -40.93 96.45 Favored Glycine 0 N--CA 1.494 2.504 0 N-CA-C 109.885 -1.286 . . . . 0.0 109.885 -179.653 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -55.88 -34.12 65.22 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.544 -0.974 . . . . 0.0 110.732 -179.628 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 47.1 mmm -80.65 -46.88 14.91 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.542 -0.724 . . . . 0.0 110.358 -179.876 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 74.2 t-105 -56.76 -22.11 33.3 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.53 -0.731 . . . . 0.0 110.989 -179.621 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 16.5 t -91.83 -35.52 14.04 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.269 -0.894 . . . . 0.0 110.231 179.976 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -65.02 -34.66 78.97 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.551 -0.718 . . . . 0.0 110.041 179.89 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 63.2 mm-40 -59.01 150.58 24.27 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.556 -0.715 . . . . 0.0 110.417 179.999 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 10.5 t -89.91 -151.53 0.24 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.637 -0.665 . . . . 0.0 109.545 179.744 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -85.74 53.6 2.83 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.258 -0.901 . . . . 0.0 110.192 179.849 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 67.4 mttt -132.17 -43.16 0.96 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.438 -0.789 . . . . 0.0 110.208 179.97 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -59.61 -31.42 69.47 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.488 -0.757 . . . . 0.0 110.626 -179.673 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 69.8 tttt -101.0 25.54 7.96 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.467 -0.771 . . . . 0.0 110.964 -179.503 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.434 ' CB ' ' HD3' ' A' ' 57' ' ' PRO . 1.7 mm-40 -97.64 -53.43 0.21 Allowed Pre-proline 0 N--CA 1.496 1.842 0 O-C-N 121.213 -0.929 . . . . 0.0 110.786 -179.836 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.434 ' HD3' ' CB ' ' A' ' 56' ' ' GLN . 56.6 Cg_endo -85.11 -31.86 0.35 Allowed 'Trans proline' 0 C--N 1.321 -0.908 0 O-C-N 122.92 0.958 . . . . 0.0 111.33 -179.634 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.34 -11.63 57.46 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.417 -0.802 . . . . 0.0 111.775 -178.579 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.556 ' HA ' ' HB2' ' A' ' 15' ' ' ALA . 0.5 OUTLIER -79.22 -26.71 42.49 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.075 -1.016 . . . . 0.0 110.856 -179.421 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 -76.12 -20.06 57.97 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.487 -0.758 . . . . 0.0 110.871 -179.9 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 36.7 tttt -65.02 -44.23 89.83 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.387 -0.821 . . . . 0.0 110.109 179.977 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.662 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -82.44 -15.51 52.33 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.51 -0.744 . . . . 0.0 110.11 179.283 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.36 -28.17 67.98 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.29 -0.881 . . . . 0.0 109.362 178.923 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -81.5 -64.99 1.07 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.61 -0.681 . . . . 0.0 109.472 179.175 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.511 ' H ' HD12 ' A' ' 65' ' ' LEU . 3.8 mp -50.65 -24.23 3.17 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.573 -0.704 . . . . 0.0 111.318 -179.732 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.3 tttt -63.18 -53.07 59.0 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.443 -0.785 . . . . 0.0 109.663 179.292 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -62.51 -48.78 78.07 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.682 -0.636 . . . . 0.0 110.25 -179.996 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 24.2 mmtp -60.32 -27.18 67.13 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.543 -0.723 . . . . 0.0 110.466 -179.674 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.48 ' O ' HG22 ' A' ' 73' ' ' ILE . 3.7 m-85 -80.72 -64.69 1.13 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.518 -0.739 . . . . 0.0 109.894 179.845 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -50.56 -35.2 28.69 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.5 -0.75 . . . . 0.0 111.163 -179.697 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 41.5 mmtt -76.11 -50.82 13.62 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.546 -0.721 . . . . 0.0 110.778 -179.754 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -74.52 -23.91 58.89 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.45 -0.781 . . . . 0.0 111.302 -179.103 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . 0.48 HG22 ' O ' ' A' ' 69' ' ' TYR . 9.1 tp -80.37 -37.8 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.266 -0.896 . . . . 0.0 109.904 -179.983 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -41.57 -34.53 0.59 Allowed 'General case' 0 N--CA 1.509 2.494 0 CA-C-O 121.164 0.507 . . . . 0.0 111.371 -179.499 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.82 -49.93 64.23 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 178.208 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -70.95 -59.88 2.54 Favored 'General case' 0 N--CA 1.494 1.736 0 CA-C-O 121.437 0.637 . . . . 0.0 109.614 178.901 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.25 -57.49 12.81 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.863 -0.523 . . . . 0.0 110.238 179.917 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 56.19 65.34 1.46 Allowed 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.438 -0.789 . . . . 0.0 110.395 -179.881 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.496 1.859 0 CA-C-O 118.083 -0.96 . . . . 0.0 110.235 179.996 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.2 ttt . . . . . 0 N--CA 1.491 1.625 0 CA-C-O 121.111 0.481 . . . . 0.0 110.224 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -98.43 95.97 7.69 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.563 -0.711 . . . . 0.0 110.186 179.977 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 31.6 ttmt -170.08 71.28 0.06 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.556 -0.715 . . . . 0.0 110.159 179.867 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 50.8 mtpt -60.17 -59.58 5.19 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.453 -0.779 . . . . 0.0 110.319 -179.897 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.714 ' HB2' ' HB2' ' A' ' 8' ' ' ALA . 1.6 m-20 -162.57 163.16 18.42 Favored Pre-proline 0 N--CA 1.493 1.724 0 O-C-N 121.604 -0.685 . . . . 0.0 110.211 -179.908 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -73.01 -47.18 0.33 Allowed 'Trans proline' 0 C--N 1.317 -1.091 0 O-C-N 123.399 1.21 . . . . 0.0 110.468 179.984 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -93.45 25.83 3.26 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.622 -0.674 . . . . 0.0 110.856 -179.705 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.714 ' HB2' ' HB2' ' A' ' 5' ' ' ASP . . . -96.86 131.58 27.63 Favored Pre-proline 0 N--CA 1.493 1.71 0 O-C-N 121.405 -0.81 . . . . 0.0 109.863 179.683 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.426 ' HB2' ' CD2' ' A' ' 69' ' ' TYR . 48.6 Cg_endo -73.13 79.78 1.99 Allowed 'Trans proline' 0 N--CA 1.485 1.001 0 O-C-N 123.145 1.076 . . . . 0.0 110.725 -179.755 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -108.2 26.27 10.62 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.585 -0.697 . . . . 0.0 110.784 179.815 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -163.27 95.62 1.08 Allowed Pre-proline 0 N--CA 1.494 1.767 0 O-C-N 121.702 -0.624 . . . . 0.0 110.16 -179.906 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -75.56 114.77 4.04 Favored 'Trans proline' 0 C--N 1.316 -1.14 0 O-C-N 123.352 1.185 . . . . 0.0 110.66 -179.843 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.579 ' HB2' HD21 ' A' ' 18' ' ' LEU . 47.4 Cg_endo -81.23 157.57 19.93 Favored 'Trans proline' 0 C--N 1.319 -1.013 0 O-C-N 123.303 1.159 . . . . 0.0 110.026 179.779 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.537 ' O ' ' HB3' ' A' ' 15' ' ' ALA . 32.6 t -151.82 55.78 0.84 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.467 -0.771 . . . . 0.0 110.91 -179.625 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.537 ' HB3' ' O ' ' A' ' 14' ' ' SER . . . 67.87 -74.94 0.07 Allowed 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.194 -0.942 . . . . 0.0 110.152 -179.65 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 31.4 t80 -47.77 -51.26 23.06 Favored 'General case' 0 N--CA 1.504 2.23 0 O-C-N 121.416 -0.802 . . . . 0.0 111.402 -179.605 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -57.82 -41.67 82.73 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.455 -0.778 . . . . 0.0 109.743 179.548 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.639 HD11 ' HB2' ' A' ' 62' ' ' ALA . 61.9 mt -59.73 -46.65 88.46 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.576 -0.703 . . . . 0.0 109.947 179.9 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -69.67 -51.33 35.64 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.679 -0.638 . . . . 0.0 110.284 -179.729 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.5 m -56.24 -54.33 46.56 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.54 -0.725 . . . . 0.0 110.787 -179.658 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 34.7 t -57.94 -30.75 66.22 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.358 -0.839 . . . . 0.0 110.539 -179.807 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.6 mm-40 -86.66 -29.42 22.51 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.534 -0.729 . . . . 0.0 110.721 -179.651 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 -99.62 9.76 42.57 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.35 -0.844 . . . . 0.0 111.519 -179.401 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.516 ' N ' ' HD2' ' A' ' 25' ' ' PRO . 3.6 mtt180 -79.75 -50.12 1.27 Allowed Pre-proline 0 N--CA 1.49 1.567 0 O-C-N 121.222 -0.924 . . . . 0.0 111.522 179.453 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.567 ' HA ' ' HG2' ' A' ' 28' ' ' LYS . 37.5 Cg_endo -63.74 -15.61 49.88 Favored 'Trans proline' 0 N--CA 1.491 1.362 0 O-C-N 122.918 0.957 . . . . 0.0 110.609 -179.631 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 9.1 tmtt? -72.69 -49.84 28.79 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 177.93 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.534 ' CG1' HD21 ' A' ' 43' ' ' LEU . 16.2 mm -55.65 -38.11 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 CA-C-O 121.51 0.671 . . . . 0.0 110.204 179.804 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.567 ' HG2' ' HA ' ' A' ' 25' ' ' PRO . 4.2 mmmm -68.15 -40.93 82.27 Favored 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.183 -177.101 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.4 t -58.04 -24.08 56.93 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.398 -0.814 . . . . 0.0 110.88 -179.527 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -114.32 -23.6 9.32 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.478 -0.764 . . . . 0.0 110.686 -179.679 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.771 ' HB3' HD23 ' A' ' 34' ' ' LEU . 53.8 m80 -119.67 96.79 49.79 Favored Pre-proline 0 N--CA 1.494 1.75 0 O-C-N 121.483 -0.761 . . . . 0.0 109.519 -179.783 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -75.08 -27.94 9.45 Favored 'Trans proline' 0 C--N 1.314 -1.28 0 O-C-N 123.525 1.276 . . . . 0.0 110.542 -179.855 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -85.72 -11.34 74.37 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 110.449 -1.06 . . . . 0.0 110.449 179.951 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.771 HD23 ' HB3' ' A' ' 31' ' ' HIS . 0.4 OUTLIER -62.18 81.72 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.282 -1.128 . . . . 0.0 110.747 -179.608 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.5 m -70.98 171.0 11.58 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.407 -0.808 . . . . 0.0 109.904 -179.977 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 38.6 mm -51.76 -29.55 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.175 0 O-C-N 121.262 -0.899 . . . . 0.0 110.315 179.976 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -60.35 -69.06 1.39 Allowed Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.31 -1.516 . . . . 0.0 109.31 179.802 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.651 ' HB3' HD13 ' A' ' 34' ' ' LEU . 13.7 t70 -67.26 -28.5 68.09 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.591 -0.946 . . . . 0.0 110.698 179.723 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 85.3 m -65.26 -27.8 68.9 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.344 -0.848 . . . . 0.0 110.131 179.775 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -77.59 -47.27 19.83 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.44 -0.788 . . . . 0.0 109.948 179.76 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -82.57 -12.37 57.77 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.602 -0.686 . . . . 0.0 111.578 -179.603 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 38' ' ' ASP . 0.1 OUTLIER -78.85 -60.5 2.35 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.985 -1.072 . . . . 0.0 109.641 179.55 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.534 HD21 ' CG1' ' A' ' 27' ' ' ILE . 52.7 mt -50.96 -25.17 4.32 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.428 -0.795 . . . . 0.0 111.07 -179.873 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.47 -40.43 91.18 Favored Glycine 0 N--CA 1.493 2.435 0 N-CA-C 109.173 -1.571 . . . . 0.0 109.173 179.553 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -54.98 -37.34 66.41 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.507 -0.996 . . . . 0.0 110.676 -179.875 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 10.9 mmt -70.4 -53.09 17.94 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.531 -0.73 . . . . 0.0 109.988 179.872 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 47' ' ' TRP . . . . . 0.409 ' CH2' ' HB3' ' A' ' 55' ' ' LYS . 63.9 t-105 -49.47 -54.58 16.95 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.475 -0.765 . . . . 0.0 111.115 -179.677 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 26.6 t -57.44 -36.56 71.54 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.376 -0.828 . . . . 0.0 110.304 179.993 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -63.82 -41.41 97.86 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.544 -0.722 . . . . 0.0 109.743 179.69 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 -60.14 156.76 14.45 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.583 -0.698 . . . . 0.0 110.268 179.814 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 12.0 m -100.52 -151.93 0.41 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.681 -0.637 . . . . 0.0 109.395 179.485 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.42 51.15 2.15 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.329 -0.857 . . . . 0.0 109.993 179.613 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 42.1 mtmt -130.46 -49.92 1.08 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.431 -0.793 . . . . 0.0 110.523 -179.84 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -70.83 -16.37 62.72 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.553 -0.717 . . . . 0.0 111.481 -179.102 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.414 ' HG3' ' N ' ' A' ' 56' ' ' GLN . 32.2 pttt -107.07 -37.31 6.34 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.152 -0.967 . . . . 0.0 111.116 -179.592 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.414 ' N ' ' HG3' ' A' ' 55' ' ' LYS . 5.9 mm100 -42.87 -56.52 6.02 Favored Pre-proline 0 N--CA 1.508 2.444 0 O-C-N 121.402 -0.811 . . . . 0.0 112.438 -178.847 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.403 ' CD ' ' CB ' ' A' ' 56' ' ' GLN . 48.6 Cg_endo -72.52 -34.15 7.74 Favored 'Trans proline' 0 C--N 1.316 -1.172 0 O-C-N 123.061 1.032 . . . . 0.0 109.891 179.624 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -75.66 -8.16 56.11 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.647 -0.658 . . . . 0.0 110.667 179.818 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.422 ' OE1' ' HB2' ' A' ' 15' ' ' ALA . 5.6 mm-40 -77.49 -58.39 3.3 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.18 -0.95 . . . . 0.0 109.96 179.776 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.401 ' HG3' ' N ' ' A' ' 61' ' ' LYS . 11.1 pt20 -47.75 -28.2 2.38 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.697 -0.627 . . . . 0.0 111.535 -179.413 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.401 ' N ' ' HG3' ' A' ' 60' ' ' GLN . 70.1 tttt -60.35 -50.35 73.97 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.319 -0.863 . . . . 0.0 109.886 179.648 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.639 ' HB2' HD11 ' A' ' 18' ' ' LEU . . . -72.64 -8.25 54.35 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.654 -0.654 . . . . 0.0 110.575 179.426 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.58 0.3 52.93 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.175 -0.953 . . . . 0.0 110.215 178.895 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 48.8 mmtt -105.28 -29.34 10.36 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.105 -0.997 . . . . 0.0 109.695 179.398 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.5 mp -88.47 -9.72 51.53 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.78 -0.575 . . . . 0.0 110.157 178.758 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.3 tptm -81.53 -31.17 32.88 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.3 -0.875 . . . . 0.0 109.204 179.154 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -67.89 -61.34 1.92 Allowed 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 120.114 -0.634 . . . . 0.0 109.359 179.411 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.9 mtpp -57.59 -23.9 53.35 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.573 -0.705 . . . . 0.0 110.72 179.887 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.426 ' CD2' ' HB2' ' A' ' 9' ' ' PRO . 23.9 t80 -74.22 -60.28 2.34 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.263 -0.898 . . . . 0.0 109.857 179.662 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -80.2 -17.81 51.32 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.698 -0.627 . . . . 0.0 112.046 -178.723 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 7.0 ttmm -98.93 -23.76 15.2 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.102 -0.999 . . . . 0.0 112.052 -178.621 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -102.25 -31.98 10.28 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.151 -0.968 . . . . 0.0 111.457 -179.149 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 4.9 tp -55.55 -33.86 33.77 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.13 0 O-C-N 121.242 -0.911 . . . . 0.0 110.666 -179.492 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.88 -55.34 34.18 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.476 -0.765 . . . . 0.0 109.148 179.275 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.3 -38.08 89.74 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 178.045 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.415 ' O ' ' N ' ' A' ' 78' ' ' ALA . 2.6 t80 -73.85 -150.2 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 178.43 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.421 ' O ' ' HB3' ' A' ' 78' ' ' ALA . 0.6 OUTLIER 66.91 -61.87 0.32 Allowed 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.307 -0.87 . . . . 0.0 109.807 179.476 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.421 ' HB3' ' O ' ' A' ' 77' ' ' ARG . . . 59.41 47.75 10.78 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.856 -0.528 . . . . 0.0 110.136 -179.592 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 16.7 mttm . . . . . 0 N--CA 1.494 1.725 0 CA-C-O 118.052 -0.975 . . . . 0.0 110.115 179.998 . . . . . . . . 0 0 . 1 stop_ save_