data_1snl_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 1snl _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 . . . . . 0 N--CA 1.493 1.704 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -63.82 -18.69 65.0 Favored 'Trans proline' 0 C--N 1.319 -1.02 0 C-N-CA 121.519 1.479 . . . . 0.0 110.004 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -56.21 -39.61 72.75 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.331 -0.855 . . . . 0.0 111.176 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 71.9 m -70.91 -38.91 72.99 Favored 'General case' 0 C--N 1.308 -1.217 0 O-C-N 120.619 -1.301 . . . . 0.0 110.668 -178.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.426 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.04 -34.33 65.78 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 179.94 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.428 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 22.9 t80 -68.79 -35.17 76.7 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.396 -0.815 . . . . 0.0 109.665 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.405 ' O ' ' N ' ' A' ' 26' ' ' ASP . 97.9 mt -69.91 -60.4 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 O-C-N 120.796 -1.19 . . . . 0.0 108.974 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.7 tp -45.86 -38.6 7.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.286 -0.884 . . . . 0.0 110.709 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 25.4 m170 -78.9 -11.86 60.01 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.298 -1.501 . . . . 0.0 109.974 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.428 ' OD1' ' O ' ' A' ' 22' ' ' PHE . 55.1 m-20 -81.65 92.79 6.63 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.872 -1.142 . . . . 0.0 108.965 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 26.1 mt -75.74 -51.57 20.26 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.371 0 O-C-N 121.331 -0.856 . . . . 0.0 110.877 -178.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.528 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -87.94 12.88 12.1 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 120.876 -1.14 . . . . 0.0 110.105 -179.663 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.417 ' OG ' ' O ' ' A' ' 29' ' ' SER . 5.0 t 43.27 55.68 4.58 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.255 -0.903 . . . . 0.0 110.533 179.03 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.416 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 13.8 p30 -97.92 -6.23 32.7 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.117 -0.99 . . . . 0.0 108.511 179.318 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.85 -3.74 63.61 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 109.664 -1.375 . . . . 0.0 109.664 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -140.93 163.16 22.03 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 O-C-N 121.263 -1.14 . . . . 0.0 108.486 178.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 72.3 mt -120.47 121.53 38.68 Favored 'General case' 0 N--CA 1.515 2.819 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 178.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -103.89 179.51 4.25 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.108 -0.995 . . . . 0.0 110.18 -179.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.1 tm-20 -55.71 -14.55 2.31 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.61 -0.681 . . . . 0.0 111.232 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.538 ' NE2' ' O ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -82.68 -28.06 30.86 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.283 -1.511 . . . . 0.0 109.679 179.663 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.7 mm-40 -81.39 -37.32 28.37 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.743 -1.223 . . . . 0.0 109.411 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.536 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 2.3 mt -73.58 -32.01 63.9 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 120.992 -1.067 . . . . 0.0 108.539 178.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -59.94 -47.87 84.03 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 120.909 -1.119 . . . . 0.0 108.874 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.31 -28.92 62.35 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.267 -0.895 . . . . 0.0 110.897 -179.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.22 -25.77 61.77 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 120.923 -1.111 . . . . 0.0 110.227 -178.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.536 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 38.1 m-85 -81.5 -51.38 8.34 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.538 -1.351 . . . . 0.0 109.275 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 64.3 m . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.147 -0.97 . . . . 0.0 110.32 -179.782 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 36.1 mtm180 . . . . . 0 N--CA 1.492 1.675 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 24.6 mt -67.29 -28.21 67.82 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.124 -0.985 . . . . 0.0 109.691 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.478 ' CG ' HH11 ' A' ' 68' ' ' ARG . 0.0 OUTLIER -63.23 -37.69 88.22 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.189 -0.944 . . . . 0.0 109.552 -179.649 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 7.2 mtt -84.67 -49.72 8.27 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.194 -0.941 . . . . 0.0 109.569 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -52.35 -32.19 37.13 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.857 -1.152 . . . . 0.0 110.427 -179.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -84.13 -52.35 6.35 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.086 -1.008 . . . . 0.0 111.004 -178.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 16.3 t60 -55.33 -41.77 72.9 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.003 -1.061 . . . . 0.0 110.179 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 71.3 t -70.53 -50.48 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 120.69 -1.256 . . . . 0.0 109.203 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.435 ' O ' ' OD1' ' A' ' 78' ' ' ASP . 6.3 mmt -63.63 -19.87 65.23 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.21 -0.931 . . . . 0.0 110.23 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -99.33 -38.65 8.76 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 120.791 -1.193 . . . . 0.0 111.004 -178.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . 0.672 ' N ' HD21 ' A' ' 76' ' ' ASN . 0.7 OUTLIER -93.47 -11.75 31.33 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 120.784 -1.198 . . . . 0.0 111.985 -178.264 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 98.1 t -114.64 -33.18 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.495 0 CA-C-N 120.3 1.409 . . . . 0.0 110.313 179.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.435 ' OD1' ' O ' ' A' ' 74' ' ' MET . 10.4 p-10 -51.33 109.65 0.36 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.598 -1.313 . . . . 0.0 108.821 179.058 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.78 -61.93 1.61 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 120.842 -1.161 . . . . 0.0 110.032 -178.13 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.719 ' H ' HD21 ' A' ' 80' ' ' ASN . 0.1 OUTLIER -102.96 18.19 22.22 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.289 -0.882 . . . . 0.0 109.786 -179.703 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.434 ' OE1' ' OD2' ' A' ' 78' ' ' ASP . 0.2 OUTLIER 42.58 75.4 0.09 Allowed 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.485 -0.759 . . . . 0.0 111.112 178.091 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.582 ' C ' ' H ' ' A' ' 84' ' ' LEU . 28.3 t70 -131.24 16.38 5.03 Favored 'General case' 0 N--CA 1.499 1.978 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.368 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 35.1 mtm180 60.82 -3.67 0.15 Allowed 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 -178.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.582 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.0 mp -124.59 134.57 52.9 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 78.4 t -111.58 125.87 68.93 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.985 0 O-C-N 121.654 -0.654 . . . . 0.0 109.666 -178.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 62.2 p -96.88 163.35 13.01 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.188 -0.945 . . . . 0.0 108.98 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.0 tp -66.3 -36.68 83.57 Favored 'General case' 0 N--CA 1.492 1.665 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 74.8 mt-10 -60.27 -68.69 0.27 Allowed 'General case' 0 C--N 1.295 -1.779 0 O-C-N 121.62 -0.675 . . . . 0.0 110.915 -178.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -59.74 -30.24 68.7 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.236 -0.915 . . . . 0.0 110.547 -178.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -64.82 -50.93 64.78 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.936 -1.103 . . . . 0.0 109.663 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 68.1 mt -49.97 -43.32 50.2 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.156 -0.965 . . . . 0.0 108.998 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -51.78 -60.95 2.59 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.222 -0.923 . . . . 0.0 110.033 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 98.8 p -45.12 -26.32 0.45 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.193 -0.942 . . . . 0.0 110.089 -179.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 23.3 p . . . . . 0 N--CA 1.499 1.997 0 O-C-N 121.328 -0.858 . . . . 0.0 109.468 179.634 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.9 m120 . . . . . 0 N--CA 1.498 1.93 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -57.7 -14.73 18.31 Favored 'Trans proline' 0 C--N 1.323 -0.806 0 C-N-CA 121.034 1.156 . . . . 0.0 110.266 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -55.9 -33.61 64.8 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.373 -0.829 . . . . 0.0 110.493 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 53.0 m -74.4 -41.81 60.28 Favored 'General case' 0 C--N 1.307 -1.268 0 O-C-N 120.89 -1.131 . . . . 0.0 110.385 -178.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.617 ' CE2' ' NE2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -55.86 -34.45 65.48 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -69.61 -36.05 75.83 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.392 -0.818 . . . . 0.0 109.791 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.471 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.7 mt -70.7 -60.48 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.232 0 O-C-N 120.711 -1.243 . . . . 0.0 109.056 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.9 tp -45.37 -36.67 4.37 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.245 -0.91 . . . . 0.0 110.692 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.617 ' NE2' ' CE2' ' A' ' 21' ' ' PHE . 0.4 OUTLIER -77.33 -15.67 59.29 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.4 -1.437 . . . . 0.0 109.451 179.787 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.471 ' N ' ' O ' ' A' ' 23' ' ' ILE . 68.6 m-20 -78.8 87.58 4.67 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.119 -0.988 . . . . 0.0 108.92 179.243 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 19.9 mt -71.4 -52.43 26.59 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 O-C-N 121.277 -0.89 . . . . 0.0 110.806 -178.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.667 HD21 ' N ' ' A' ' 28' ' ' ASN . 0.9 OUTLIER -86.38 11.6 12.0 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.826 -1.171 . . . . 0.0 109.84 -179.787 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 27.6 p 44.42 56.31 5.09 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.201 -0.937 . . . . 0.0 110.245 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.407 ' OD1' ' O ' ' A' ' 32' ' ' VAL . 41.8 p-10 -98.07 -5.94 32.78 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.236 -0.915 . . . . 0.0 108.603 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 79.97 -1.7 78.27 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.914 -1.274 . . . . 0.0 109.914 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.407 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 0.9 OUTLIER -143.59 163.55 15.71 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 121.072 -1.252 . . . . 0.0 108.545 178.412 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 39.7 mt -113.22 125.63 54.53 Favored 'General case' 0 N--CA 1.514 2.734 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 178.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.426 ' OD1' ' OE2' ' A' ' 37' ' ' GLU . 42.6 p-10 -103.69 173.85 6.12 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.316 -0.865 . . . . 0.0 109.73 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 61.2 mt-10 -55.8 -8.86 0.46 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.547 -0.72 . . . . 0.0 110.157 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.403 ' H ' ' C ' ' A' ' 34' ' ' ASP . 2.3 mm100 -83.35 -43.24 16.16 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.86 -1.15 . . . . 0.0 108.786 179.033 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.53 ' OE1' ' N ' ' A' ' 37' ' ' GLU . 0.3 OUTLIER -70.54 -29.26 65.68 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 179.34 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.407 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 10.2 mp -83.1 -39.43 21.13 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.234 -0.916 . . . . 0.0 108.936 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -64.07 -49.58 71.76 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.788 -1.195 . . . . 0.0 108.728 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.97 -28.4 67.42 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.418 -0.801 . . . . 0.0 110.559 -179.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 32.5 tp -76.26 -28.52 57.12 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.991 -1.068 . . . . 0.0 110.88 -178.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.407 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 29.6 m-85 -74.46 -49.03 23.9 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 120.058 -1.651 . . . . 0.0 108.442 179.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 59.4 m . . . . . 0 N--CA 1.488 1.446 0 O-C-N 121.288 -0.883 . . . . 0.0 110.246 -179.915 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.505 ' CG ' HH11 ' A' ' 66' ' ' ARG . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.304 0.573 . . . . 0.0 109.711 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.417 ' CD1' ' C ' ' A' ' 67' ' ' LEU . 0.6 OUTLIER -73.58 -27.36 61.27 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.348 -0.845 . . . . 0.0 109.722 -179.525 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? -59.9 -39.88 86.9 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.06 -1.025 . . . . 0.0 109.387 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 10.6 mtt -86.09 -50.1 7.28 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.011 -1.055 . . . . 0.0 109.297 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 62.4 ttt180 -54.65 -46.79 74.05 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.976 -1.078 . . . . 0.0 110.761 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -74.34 -53.0 10.55 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.95 -1.094 . . . . 0.0 111.303 -178.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -54.4 -41.15 68.93 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.954 -1.091 . . . . 0.0 110.248 -179.196 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 71.9 t -73.13 -53.45 18.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 120.765 -1.209 . . . . 0.0 109.581 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.428 ' O ' ' CG ' ' A' ' 78' ' ' ASP . 28.7 mtp -64.35 -17.42 63.7 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.121 -0.987 . . . . 0.0 109.916 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 26.2 ttpt -95.73 -37.31 10.83 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 120.783 -1.198 . . . . 0.0 110.385 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . 0.677 ' N ' HD21 ' A' ' 76' ' ' ASN . 0.7 OUTLIER -98.01 -10.49 24.33 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.018 -1.051 . . . . 0.0 112.065 -178.458 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 95.1 t -114.93 -32.93 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.595 0 O-C-N 120.407 -1.433 . . . . 0.0 110.337 179.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.501 ' C ' ' NE2' ' A' ' 81' ' ' GLN . 19.0 p-10 -49.28 111.99 0.57 Allowed 'General case' 0 N--CA 1.498 1.929 0 O-C-N 120.642 -1.286 . . . . 0.0 108.645 178.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -90.06 -68.77 0.76 Allowed 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.145 -0.972 . . . . 0.0 110.645 -177.53 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.509 ' O ' ' N ' ' A' ' 82' ' ' ASP . 7.0 m120 -97.27 25.61 5.43 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.02 -1.05 . . . . 0.0 108.34 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.799 ' NE2' ' H ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER 35.19 29.12 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.087 178.106 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.513 ' C ' ' H ' ' A' ' 84' ' ' LEU . 59.7 t0 -82.81 14.59 3.13 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 178.196 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.509 HH11 ' CG ' ' A' ' 83' ' ' ARG . 4.1 mtt-85 61.87 3.69 0.97 Allowed 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -178.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.513 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.7 mp -125.2 134.24 52.44 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 71.6 t -111.69 130.5 65.16 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 O-C-N 121.618 -0.676 . . . . 0.0 109.55 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 60.1 p -103.59 165.16 11.2 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.325 -0.859 . . . . 0.0 108.859 179.057 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.8 tp -66.37 -36.05 81.88 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.246 -0.909 . . . . 0.0 108.624 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -58.05 -69.32 0.18 Allowed 'General case' 0 C--N 1.295 -1.787 0 O-C-N 121.292 -0.88 . . . . 0.0 111.123 -178.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -62.73 -30.94 71.8 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.196 -0.94 . . . . 0.0 110.903 -178.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -60.8 -51.04 71.02 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.789 -1.195 . . . . 0.0 109.39 -179.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -51.16 -48.64 61.83 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 179.124 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -44.33 -49.3 9.56 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.441 -0.787 . . . . 0.0 110.465 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 46.6 m -60.43 -29.91 69.3 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.065 -1.022 . . . . 0.0 110.558 -178.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 30.3 p . . . . . 0 N--CA 1.501 2.099 0 O-C-N 121.112 -0.992 . . . . 0.0 110.308 -179.506 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 24.5 m120 . . . . . 0 N--CA 1.492 1.628 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -59.23 -11.67 13.85 Favored 'Trans proline' 0 C--N 1.32 -0.926 0 C-N-CA 121.272 1.314 . . . . 0.0 110.252 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.1 ttpm? -57.3 -40.92 78.87 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.285 -0.885 . . . . 0.0 110.718 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 48.6 m -66.33 -39.71 89.42 Favored 'General case' 0 C--N 1.307 -1.261 0 O-C-N 120.863 -1.148 . . . . 0.0 110.248 -178.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -55.96 -34.7 65.95 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -68.77 -35.34 76.95 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.317 -0.864 . . . . 0.0 109.741 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.403 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.6 mt -72.58 -61.56 1.65 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 O-C-N 120.764 -1.21 . . . . 0.0 108.865 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.7 tp -46.38 -35.83 5.85 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.198 -0.939 . . . . 0.0 110.765 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.521 ' O ' ' ND1' ' A' ' 25' ' ' HIS . 0.9 OUTLIER -78.88 -14.57 59.16 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.46 -1.4 . . . . 0.0 109.691 -179.971 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' A' ' 23' ' ' ILE . 94.5 m-20 -78.97 92.9 5.0 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.98 -1.075 . . . . 0.0 108.875 179.108 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 23.1 mt -75.09 -52.28 19.24 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.322 0 O-C-N 121.235 -0.916 . . . . 0.0 110.724 -178.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.486 HD21 ' N ' ' A' ' 28' ' ' ASN . 2.2 m120 -87.42 12.69 11.54 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 120.848 -1.158 . . . . 0.0 110.086 -179.51 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.4 m 43.94 55.92 4.98 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.204 -0.935 . . . . 0.0 110.611 178.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.418 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 12.0 t70 -98.19 -3.09 38.32 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.106 -0.996 . . . . 0.0 108.66 179.357 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 75.65 0.62 63.9 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -179.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -143.41 164.53 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.235 -1.156 . . . . 0.0 108.683 178.555 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 66.0 mt -114.63 128.98 56.61 Favored 'General case' 0 N--CA 1.516 2.866 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 178.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.414 ' C ' ' H ' ' A' ' 36' ' ' GLN . 40.4 p-10 -107.96 163.88 12.75 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.297 -0.877 . . . . 0.0 109.843 -179.423 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.417 ' OE2' ' O ' ' A' ' 35' ' ' GLU . 0.4 OUTLIER -51.67 -11.36 0.14 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.51 -0.744 . . . . 0.0 110.379 -179.612 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.414 ' H ' ' C ' ' A' ' 34' ' ' ASP . 2.2 mm100 -82.57 -36.59 26.09 Favored 'General case' 0 C--N 1.297 -1.704 0 O-C-N 120.801 -1.187 . . . . 0.0 109.559 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -72.86 -33.6 66.21 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.086 -1.009 . . . . 0.0 109.234 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.4 mt -82.22 -36.27 27.39 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.16 -0.962 . . . . 0.0 109.249 178.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -60.83 -41.86 96.61 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 120.758 -1.213 . . . . 0.0 108.944 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.81 -29.56 62.23 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.248 -0.908 . . . . 0.0 110.515 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -76.66 -24.96 53.27 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.026 -1.046 . . . . 0.0 110.18 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -78.91 -49.88 12.1 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.592 -1.318 . . . . 0.0 108.934 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 34.5 m . . . . . 0 N--CA 1.49 1.528 0 O-C-N 121.217 -0.927 . . . . 0.0 110.371 -179.845 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 8.2 mtm180 . . . . . 0 N--CA 1.493 1.724 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 54.2 mt -67.33 -28.13 67.72 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.229 -0.92 . . . . 0.0 110.148 -179.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 6.3 mmm180 -64.3 -42.64 96.27 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.905 -1.122 . . . . 0.0 109.758 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 4.6 mtt -84.29 -50.1 8.15 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.015 -1.053 . . . . 0.0 109.698 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -55.37 -38.06 68.36 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.064 -1.023 . . . . 0.0 110.846 -179.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -82.16 -51.84 7.57 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 120.75 -1.219 . . . . 0.0 110.764 -179.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.414 ' O ' ' ND2' ' A' ' 76' ' ' ASN . 43.8 t-80 -53.86 -37.28 63.51 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.021 -1.049 . . . . 0.0 110.099 -179.473 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 79.4 t -75.07 -54.0 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 120.703 -1.248 . . . . 0.0 109.677 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.44 ' O ' ' CG ' ' A' ' 78' ' ' ASP . 18.9 mtp -65.92 -13.66 60.11 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.221 -0.924 . . . . 0.0 110.302 -179.44 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -89.37 -38.93 13.77 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.357 -1.464 . . . . 0.0 110.713 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . 0.697 HD21 ' H ' ' A' ' 77' ' ' VAL . 0.0 OUTLIER -102.66 -22.53 13.95 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.106 -0.996 . . . . 0.0 112.285 -178.187 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.697 ' H ' HD21 ' A' ' 76' ' ' ASN . 42.1 t -94.69 -34.65 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 O-C-N 120.308 -1.495 . . . . 0.0 109.485 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.44 ' CG ' ' O ' ' A' ' 74' ' ' MET . 17.9 p-10 -48.64 101.7 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.864 -1.148 . . . . 0.0 109.158 178.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -76.19 -65.47 0.92 Allowed 'General case' 0 C--N 1.295 -1.781 0 O-C-N 120.975 -1.078 . . . . 0.0 110.703 -178.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.465 ' O ' ' N ' ' A' ' 82' ' ' ASP . 7.5 t-20 -105.51 25.73 10.36 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 121.185 -0.947 . . . . 0.0 109.357 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.425 ' C ' ' H ' ' A' ' 83' ' ' ARG . 0.1 OUTLIER 37.88 29.01 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 121.17 0.51 . . . . 0.0 111.092 178.929 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.559 ' C ' ' H ' ' A' ' 84' ' ' LEU . 17.3 p-10 -84.02 12.91 5.57 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 178.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.425 ' H ' ' C ' ' A' ' 81' ' ' GLN . 15.6 mmt180 65.09 -3.22 0.63 Allowed 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 -178.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.559 ' H ' ' C ' ' A' ' 82' ' ' ASP . 6.5 mp -122.03 134.59 54.79 Favored 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 107.289 -1.374 . . . . 0.0 107.289 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 74.5 t -113.69 131.67 64.85 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.109 0 O-C-N 121.643 -0.661 . . . . 0.0 109.691 -178.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 64.6 p -99.61 166.12 11.29 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.043 -1.035 . . . . 0.0 109.543 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.9 tp -67.3 -36.78 82.21 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 179.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.498 ' H ' ' CD ' ' A' ' 88' ' ' GLU . 13.7 mp0 -56.64 -67.62 0.29 Allowed 'General case' 0 C--N 1.294 -1.835 0 O-C-N 121.434 -0.791 . . . . 0.0 110.642 -178.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -62.84 -38.0 89.06 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.268 -0.895 . . . . 0.0 111.347 -178.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -57.06 -50.94 71.2 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.476 -1.39 . . . . 0.0 109.572 -178.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 80.4 mt -50.11 -47.74 53.78 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.102 -0.999 . . . . 0.0 109.008 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -51.06 -59.61 3.99 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.394 -0.817 . . . . 0.0 109.945 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 46.3 t -45.35 -25.93 0.46 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.138 -0.976 . . . . 0.0 110.428 -179.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 43.6 p . . . . . 0 N--CA 1.5 2.072 0 O-C-N 121.133 -0.979 . . . . 0.0 109.866 -179.794 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.644 ' N ' HD21 ' A' ' 17' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -59.37 -16.77 36.69 Favored 'Trans proline' 0 C--N 1.32 -0.937 0 C-N-CA 121.436 1.424 . . . . 0.0 111.228 -178.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 51.4 tttm -66.81 -36.53 82.6 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.906 -1.121 . . . . 0.0 111.077 -179.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.3 m -74.12 -41.6 61.34 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.617 -1.302 . . . . 0.0 110.367 -178.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.417 ' CD2' ' NE2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -55.28 -34.26 63.93 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 179.97 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -68.98 -35.96 77.32 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.347 -0.845 . . . . 0.0 109.686 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.41 ' O ' ' N ' ' A' ' 26' ' ' ASP . 97.2 mt -71.34 -61.07 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.225 0 O-C-N 120.827 -1.171 . . . . 0.0 109.007 179.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.9 tp -46.63 -38.02 9.06 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.31 -0.869 . . . . 0.0 110.751 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.515 ' N ' ' HD1' ' A' ' 25' ' ' HIS . 0.4 OUTLIER -74.99 -16.24 60.63 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.327 -1.483 . . . . 0.0 109.712 179.871 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.41 ' N ' ' O ' ' A' ' 23' ' ' ILE . 8.5 t0 -78.71 91.0 4.63 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.981 -1.074 . . . . 0.0 108.527 179.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 87.5 mt -75.75 -43.04 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.35 0 O-C-N 121.421 -0.799 . . . . 0.0 110.869 -178.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.513 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -95.24 12.66 28.14 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.015 -1.053 . . . . 0.0 110.083 -179.687 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 49.9 p 43.92 53.05 6.47 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.198 -0.939 . . . . 0.0 110.519 178.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -97.19 -3.78 40.27 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.09 -1.006 . . . . 0.0 108.886 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 76.94 -1.36 63.34 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.1 156.33 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 O-C-N 121.287 -1.125 . . . . 0.0 108.298 178.174 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 31.1 mt -114.42 128.86 56.55 Favored 'General case' 0 N--CA 1.512 2.664 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 178.426 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.434 ' OD1' ' OE2' ' A' ' 37' ' ' GLU . 45.0 p-10 -106.21 174.27 5.96 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.31 -0.869 . . . . 0.0 110.436 -179.029 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -52.08 -11.63 0.18 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.808 -0.557 . . . . 0.0 110.12 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.416 ' H ' ' C ' ' A' ' 34' ' ' ASP . 4.0 mm100 -83.13 -43.0 16.7 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.884 -1.135 . . . . 0.0 109.048 179.413 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.527 ' OE1' ' N ' ' A' ' 37' ' ' GLU . 0.3 OUTLIER -73.48 -29.93 62.83 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.312 -0.867 . . . . 0.0 108.789 179.377 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.5 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 10.2 mp -82.13 -40.03 22.45 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.545 -0.722 . . . . 0.0 109.435 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -70.23 -37.34 74.97 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 120.831 -1.168 . . . . 0.0 109.725 -179.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.62 -28.5 61.83 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.256 -0.903 . . . . 0.0 111.028 -179.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 mp -76.13 -27.9 57.23 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.85 -1.156 . . . . 0.0 110.525 -178.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.5 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 8.0 m-85 -80.91 -45.38 16.84 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 120.655 -1.278 . . . . 0.0 109.545 -179.281 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 51.4 m . . . . . 0 N--CA 1.491 1.589 0 O-C-N 121.129 -0.982 . . . . 0.0 111.098 -178.983 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.1 ttm180 . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.421 ' O ' ' OE1' ' A' ' 71' ' ' GLU . 0.7 OUTLIER -81.7 -28.36 33.49 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.114 -0.991 . . . . 0.0 109.873 -179.629 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.8 tmm_? -60.59 -36.74 79.29 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.127 -0.983 . . . . 0.0 109.648 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 36.6 mtt -85.73 -37.47 19.33 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.063 -1.023 . . . . 0.0 109.737 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -61.75 -41.51 97.76 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.012 -1.055 . . . . 0.0 111.115 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.465 ' N ' ' CD ' ' A' ' 71' ' ' GLU . 1.3 mp0 -84.02 -52.46 6.29 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 120.965 -1.084 . . . . 0.0 111.147 -178.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 28.0 m170 -53.86 -39.81 65.97 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.894 -1.129 . . . . 0.0 110.121 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 72.9 t -75.12 -51.2 22.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 120.756 -1.215 . . . . 0.0 109.932 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 19.6 mtp -67.82 -14.74 63.2 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.934 -1.103 . . . . 0.0 110.094 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 23.6 ttpp -85.24 -32.55 22.54 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.373 -1.454 . . . . 0.0 110.506 -179.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . 0.674 HD21 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -111.96 -23.31 10.6 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.18 -0.95 . . . . 0.0 112.647 -177.92 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.674 ' H ' HD21 ' A' ' 76' ' ' ASN . 32.5 t -95.13 -38.25 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.49 0 O-C-N 120.458 -1.401 . . . . 0.0 110.61 -178.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.23 102.57 0.86 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.443 -1.411 . . . . 0.0 107.433 178.713 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -81.33 -52.8 6.91 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.356 -0.84 . . . . 0.0 111.777 -177.475 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.447 ' O ' ' N ' ' A' ' 82' ' ' ASP . 56.8 t-20 -100.0 23.46 9.82 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.199 -0.938 . . . . 0.0 109.641 -179.485 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.427 ' C ' ' O ' ' A' ' 80' ' ' ASN . 1.3 mm100 32.68 35.73 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 CA-C-O 121.079 0.466 . . . . 0.0 112.088 178.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.552 ' C ' ' H ' ' A' ' 84' ' ' LEU . 48.9 t0 -85.45 12.3 8.69 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 178.473 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.504 HH11 ' CG ' ' A' ' 83' ' ' ARG . 4.3 mtt-85 64.9 -4.29 0.49 Allowed 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 -178.427 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.552 ' H ' ' C ' ' A' ' 82' ' ' ASP . 14.7 mt -120.64 134.85 55.25 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 178.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 71.6 t -112.04 129.62 67.18 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.561 -0.712 . . . . 0.0 109.831 -178.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 32.5 p -105.63 159.15 16.19 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 178.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.2 tp -59.33 -35.6 74.14 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.41 -0.807 . . . . 0.0 109.397 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.485 ' H ' ' CD ' ' A' ' 88' ' ' GLU . 6.2 mp0 -60.7 -68.34 0.31 Allowed 'General case' 0 C--N 1.296 -1.757 0 O-C-N 121.24 -0.912 . . . . 0.0 111.828 -177.303 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -63.03 -32.0 73.27 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.033 -1.042 . . . . 0.0 110.563 -177.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -61.37 -51.89 66.93 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.892 -1.13 . . . . 0.0 109.753 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 68.2 mt -50.48 -48.57 56.68 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.25 -0.906 . . . . 0.0 109.256 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -46.66 -49.43 19.27 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.304 -0.873 . . . . 0.0 109.963 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 48.3 t -56.76 -27.55 59.67 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.199 -0.938 . . . . 0.0 109.882 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 29.4 p . . . . . 0 N--CA 1.5 2.06 0 O-C-N 121.229 -0.919 . . . . 0.0 109.778 179.994 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -58.76 -15.82 28.21 Favored 'Trans proline' 0 C--N 1.319 -0.994 0 C-N-CA 121.532 1.488 . . . . 0.0 110.33 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 69.0 tttt -57.38 -36.01 70.7 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.36 -0.838 . . . . 0.0 110.824 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 38.9 m -70.27 -39.79 74.74 Favored 'General case' 0 N--CA 1.483 1.2 0 O-C-N 120.58 -1.325 . . . . 0.0 110.083 -178.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.524 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.08 -50.38 71.18 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.083 -1.081 . . . . 0.0 108.083 179.767 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.524 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 41.7 t80 -54.11 -35.16 61.85 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.539 -0.725 . . . . 0.0 110.406 -179.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.531 ' O ' ' N ' ' A' ' 25' ' ' HIS . 97.2 mt -73.9 -61.99 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.204 0 O-C-N 120.694 -1.254 . . . . 0.0 108.974 -179.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.2 tp -46.22 -12.87 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.021 -1.049 . . . . 0.0 110.898 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.531 ' N ' ' O ' ' A' ' 23' ' ' ILE . 0.7 OUTLIER -102.24 -15.77 16.52 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 120.535 -1.353 . . . . 0.0 110.205 179.952 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.492 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 58.5 p30 -75.36 70.03 2.22 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.81 -1.181 . . . . 0.0 109.362 179.48 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 63.7 mt -50.2 -52.34 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 O-C-N 121.297 -0.877 . . . . 0.0 110.897 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.496 ' N ' HD21 ' A' ' 28' ' ' ASN . 2.1 m120 -87.89 14.35 9.0 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 120.726 -1.234 . . . . 0.0 110.376 -179.297 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.449 ' O ' ' OG ' ' A' ' 29' ' ' SER . 8.5 t 41.37 48.27 3.23 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.217 -0.927 . . . . 0.0 110.616 178.53 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -92.9 0.69 57.46 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.948 -1.095 . . . . 0.0 108.855 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 74.82 -0.26 57.77 Favored Glycine 0 N--CA 1.487 2.046 0 N-CA-C 109.343 -1.503 . . . . 0.0 109.343 -179.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -135.97 166.11 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 O-C-N 121.429 -1.042 . . . . 0.0 108.784 178.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -106.13 117.04 33.0 Favored 'General case' 0 N--CA 1.509 2.515 0 N-CA-C 107.44 -1.319 . . . . 0.0 107.44 177.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.413 ' OD1' ' N ' ' A' ' 34' ' ' ASP . 0.3 OUTLIER -90.55 165.18 13.91 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.535 -0.728 . . . . 0.0 110.361 -178.397 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -74.99 -39.84 61.03 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.541 -0.725 . . . . 0.0 110.786 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.501 ' NE2' ' C ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -63.01 -24.44 67.92 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 120.676 -1.265 . . . . 0.0 108.653 -179.779 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -84.82 -33.0 23.01 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 178.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.8 tp -75.84 -32.13 59.65 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 178.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 48.9 tt0 -67.43 -41.47 84.75 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 120.961 -1.087 . . . . 0.0 109.068 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.57 -45.42 53.44 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.271 -0.893 . . . . 0.0 110.769 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 39.7 tp -57.86 -23.26 52.14 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.175 -0.953 . . . . 0.0 109.619 -179.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -80.05 -51.22 9.29 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 120.967 -1.083 . . . . 0.0 109.057 -179.378 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 29.5 m . . . . . 0 N--CA 1.49 1.571 0 O-C-N 121.122 -0.986 . . . . 0.0 109.994 -179.658 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 57.9 mtt180 . . . . . 0 N--CA 1.491 1.605 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.401 ' O ' ' OE1' ' A' ' 71' ' ' GLU . 42.1 mt -74.33 -29.86 61.78 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.109 -0.994 . . . . 0.0 110.128 -178.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.7 tpp180 -74.43 -38.29 63.06 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.194 -0.941 . . . . 0.0 110.233 -178.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 30.6 mtt -86.36 -46.82 9.92 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 120.956 -1.09 . . . . 0.0 110.096 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 45.1 ttm180 -60.17 -36.98 78.81 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.858 -1.151 . . . . 0.0 110.386 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.401 ' OE1' ' O ' ' A' ' 67' ' ' LEU . 64.2 mt-10 -74.97 -47.78 27.6 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.758 -1.214 . . . . 0.0 110.32 -179.489 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.513 ' CE1' ' OD1' ' A' ' 76' ' ' ASN . 52.0 t-80 -58.04 -38.81 76.95 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.025 -1.047 . . . . 0.0 110.278 -179.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 77.9 t -71.86 -55.27 14.06 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 120.785 -1.197 . . . . 0.0 109.815 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 10.4 mtp -64.08 -21.97 66.74 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.054 -1.029 . . . . 0.0 110.107 -179.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.722 ' HZ1' HD22 ' A' ' 76' ' ' ASN . 0.8 OUTLIER -91.03 -32.96 15.71 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.497 -1.377 . . . . 0.0 110.252 -179.349 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . 0.722 HD22 ' HZ1' ' A' ' 75' ' ' LYS . 25.3 m120 -100.78 -9.48 21.69 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.008 -1.057 . . . . 0.0 111.691 -178.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 99.4 t -118.62 -33.59 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.515 0 O-C-N 120.667 -1.271 . . . . 0.0 110.698 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -48.94 113.78 0.86 Allowed 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.719 -1.238 . . . . 0.0 108.502 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -91.23 -65.54 1.0 Allowed 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.286 -0.884 . . . . 0.0 112.422 -176.11 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -107.16 25.03 11.9 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 120.886 -1.134 . . . . 0.0 110.655 -178.415 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 45.34 78.89 0.06 Allowed 'General case' 0 C--N 1.298 -1.657 0 O-C-N 121.514 -0.741 . . . . 0.0 111.679 177.52 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.583 ' C ' ' H ' ' A' ' 84' ' ' LEU . 26.3 t0 -144.81 19.17 1.64 Allowed 'General case' 0 C--N 1.296 -1.754 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.27 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 47.0 mtm180 58.15 -0.34 0.11 Allowed 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -179.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.583 ' H ' ' C ' ' A' ' 82' ' ' ASP . 1.8 mp -125.16 135.57 52.75 Favored 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 107.478 -1.304 . . . . 0.0 107.478 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 60.8 t -113.85 130.45 67.96 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.104 0 O-C-N 121.676 -0.64 . . . . 0.0 109.339 -179.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 66.9 p -94.64 163.22 13.47 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.034 -1.041 . . . . 0.0 109.386 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.473 ' C ' ' CD1' ' A' ' 87' ' ' LEU . 1.2 tm? -68.6 -38.58 80.73 Favored 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 108.002 -1.111 . . . . 0.0 108.002 179.723 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -60.19 -69.49 0.22 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.58 -0.7 . . . . 0.0 111.218 -179.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -56.46 -30.56 63.04 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.032 -1.042 . . . . 0.0 110.354 -178.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -62.03 -51.21 68.93 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.852 -1.155 . . . . 0.0 110.106 -179.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.402 ' O ' ' OG1' ' A' ' 94' ' ' THR . 89.1 mt -52.22 -38.97 59.57 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.963 -1.085 . . . . 0.0 108.963 178.585 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.445 ' O ' ' N ' ' A' ' 94' ' ' THR . . . -57.05 -62.75 1.53 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.266 -0.896 . . . . 0.0 109.937 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 45.9 t -44.09 -22.46 0.06 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.383 -0.823 . . . . 0.0 110.14 -179.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.445 ' N ' ' O ' ' A' ' 92' ' ' ALA . 44.4 p . . . . . 0 N--CA 1.498 1.936 0 O-C-N 121.349 -0.844 . . . . 0.0 109.785 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.518 ' C ' HD21 ' A' ' 17' ' ' ASN . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.54 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -65.29 -17.93 59.41 Favored 'Trans proline' 0 C--N 1.317 -1.081 0 C-N-CA 121.497 1.465 . . . . 0.0 110.09 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.6 tttp -57.3 -34.73 69.01 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.361 -0.837 . . . . 0.0 110.981 -179.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 47.9 m -72.17 -41.23 67.29 Favored 'General case' 0 N--CA 1.485 1.282 0 O-C-N 120.695 -1.253 . . . . 0.0 110.226 -178.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.562 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -55.86 -43.88 77.54 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.03 -1.044 . . . . 0.0 108.463 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.562 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 45.3 t80 -61.25 -35.61 77.72 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.45 -0.781 . . . . 0.0 110.355 -179.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.42 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.6 mt -73.38 -61.0 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.194 0 O-C-N 120.746 -1.221 . . . . 0.0 109.162 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 22.1 tp -46.33 -34.69 4.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.178 -0.952 . . . . 0.0 110.708 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.581 ' N ' ' HD1' ' A' ' 25' ' ' HIS . 0.3 OUTLIER -79.73 -16.05 56.37 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.314 -1.491 . . . . 0.0 109.705 179.859 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.42 ' N ' ' O ' ' A' ' 23' ' ' ILE . 10.1 t0 -78.42 92.27 4.58 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.036 -1.04 . . . . 0.0 108.798 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 6.4 mt -73.37 -49.66 35.75 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 O-C-N 121.527 -0.733 . . . . 0.0 111.123 -178.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.583 HD21 ' N ' ' A' ' 28' ' ' ASN . 1.5 m120 -88.13 8.1 28.49 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.78 -1.2 . . . . 0.0 110.344 -179.445 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.4 p 45.48 60.31 3.14 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.061 -1.024 . . . . 0.0 110.537 179.144 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -101.55 -1.78 32.11 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.286 -0.884 . . . . 0.0 108.891 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 77.59 -1.95 64.88 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.959 -1.256 . . . . 0.0 109.959 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.21 165.41 29.25 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.213 0 O-C-N 121.41 -1.053 . . . . 0.0 108.302 178.303 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.7 tp -116.93 123.17 46.32 Favored 'General case' 0 N--CA 1.513 2.708 0 N-CA-C 107.853 -1.165 . . . . 0.0 107.853 178.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.418 ' OD1' ' OE2' ' A' ' 37' ' ' GLU . 36.2 p-10 -107.77 172.87 6.59 Favored 'General case' 0 N--CA 1.509 2.493 0 CA-C-O 122.179 0.99 . . . . 0.0 111.493 -178.288 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -58.8 -10.59 2.48 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.368 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -83.03 -48.95 10.07 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.728 -1.232 . . . . 0.0 108.814 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.512 ' OE1' ' N ' ' A' ' 37' ' ' GLU . 0.3 OUTLIER -67.55 -30.26 69.85 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 179.04 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.8 tp -82.09 -33.15 29.91 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.56 -0.712 . . . . 0.0 109.375 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -72.75 -44.21 61.91 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 120.857 -1.152 . . . . 0.0 109.199 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.27 -30.26 62.04 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.266 -0.896 . . . . 0.0 111.011 -178.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 40.4 mt -75.56 -21.94 57.45 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 120.836 -1.165 . . . . 0.0 109.464 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -77.48 -50.26 13.02 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.068 -1.02 . . . . 0.0 108.742 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.5 m . . . . . 0 N--CA 1.49 1.532 0 O-C-N 121.427 -0.796 . . . . 0.0 110.575 -179.266 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 29.5 mtm180 . . . . . 0 N--CA 1.491 1.622 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 33.2 mt -81.61 -28.51 33.7 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.312 -0.867 . . . . 0.0 109.636 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -72.58 -37.2 68.26 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.243 -0.91 . . . . 0.0 110.02 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 12.6 mtt -85.63 -35.39 20.99 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 120.99 -1.069 . . . . 0.0 109.567 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 64.4 ttt180 -72.0 -33.55 68.17 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.761 -1.212 . . . . 0.0 109.801 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -78.48 -46.56 19.37 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.884 -1.135 . . . . 0.0 109.923 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 42.2 t-80 -60.28 -34.3 73.56 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.153 -0.967 . . . . 0.0 110.154 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 68.9 t -75.0 -55.91 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 O-C-N 120.614 -1.304 . . . . 0.0 109.894 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 5.7 mtt -64.0 -17.45 63.33 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.953 -1.092 . . . . 0.0 110.542 -179.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.5 tptm -82.72 -39.05 22.47 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.2 -1.562 . . . . 0.0 110.436 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . 0.667 HD21 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -103.87 -21.89 13.58 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.101 -1.0 . . . . 0.0 112.483 -177.949 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.667 ' H ' HD21 ' A' ' 76' ' ' ASN . 40.5 t -94.99 -35.48 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.414 0 O-C-N 120.404 -1.435 . . . . 0.0 109.507 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -47.57 106.58 0.09 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.043 -1.035 . . . . 0.0 108.889 178.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.56 -72.52 0.33 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.267 -0.895 . . . . 0.0 113.123 -176.791 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.753 ' H ' HD21 ' A' ' 80' ' ' ASN . 0.0 OUTLIER -106.81 26.88 9.49 Favored 'General case' 0 N--CA 1.513 2.69 0 O-C-N 120.661 -1.274 . . . . 0.0 110.802 -177.288 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.402 ' CA ' HE21 ' A' ' 81' ' ' GLN . 0.5 OUTLIER 44.7 71.08 0.28 Allowed 'General case' 0 C--N 1.293 -1.869 0 O-C-N 121.433 -0.792 . . . . 0.0 111.185 178.37 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.565 ' C ' ' H ' ' A' ' 84' ' ' LEU . 1.1 m-20 -136.14 18.86 3.2 Favored 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 106.665 -1.606 . . . . 0.0 106.665 177.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 74.0 mtt180 60.69 -2.37 0.18 Allowed 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -178.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.565 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.9 mt -119.96 133.89 55.41 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 53.2 t -109.23 131.66 59.44 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 58.8 p -97.77 157.53 16.02 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 120.926 -1.109 . . . . 0.0 109.732 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.473 ' C ' ' CD1' ' A' ' 87' ' ' LEU . 0.9 OUTLIER -63.13 -36.62 84.2 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 179.425 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.476 ' H ' ' CD ' ' A' ' 88' ' ' GLU . 20.5 mp0 -58.32 -71.84 0.1 Allowed 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.612 -0.68 . . . . 0.0 112.39 -179.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -61.3 -32.49 72.34 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.882 -1.136 . . . . 0.0 110.233 -177.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -57.27 -48.71 78.18 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 120.934 -1.104 . . . . 0.0 109.258 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . 0.454 ' O ' ' N ' ' A' ' 94' ' ' THR . 54.7 mt -52.05 -47.83 64.91 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.979 -1.076 . . . . 0.0 108.822 178.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.414 ' C ' ' O ' ' A' ' 91' ' ' LEU . . . -41.57 -57.29 2.3 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.62 -0.675 . . . . 0.0 109.923 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 40.8 t -53.08 -33.72 53.37 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.299 -0.875 . . . . 0.0 109.486 179.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.454 ' N ' ' O ' ' A' ' 91' ' ' LEU . 11.6 p . . . . . 0 N--CA 1.495 1.815 0 O-C-N 121.441 -0.787 . . . . 0.0 109.296 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.7 p-10 . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -63.55 -20.67 69.97 Favored 'Trans proline' 0 C--N 1.318 -1.031 0 C-N-CA 121.449 1.432 . . . . 0.0 110.006 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -55.28 -33.64 63.4 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.179 -0.95 . . . . 0.0 110.773 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.1 m -74.17 -41.64 61.16 Favored 'General case' 0 N--CA 1.484 1.259 0 O-C-N 120.741 -1.225 . . . . 0.0 110.429 -178.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -55.89 -34.65 65.72 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.906 -1.121 . . . . 0.0 108.301 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -70.32 -34.86 73.18 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.402 -0.811 . . . . 0.0 110.089 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.419 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.7 mt -72.4 -60.84 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 O-C-N 120.827 -1.171 . . . . 0.0 109.261 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.2 tp -45.6 -33.55 2.9 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.196 -0.94 . . . . 0.0 110.932 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 26.9 m170 -83.75 -14.41 51.59 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 120.261 -1.525 . . . . 0.0 109.66 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 23' ' ' ILE . 91.7 m-20 -75.52 94.79 3.2 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.068 -1.02 . . . . 0.0 108.916 179.143 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 28.4 mt -76.81 -49.93 22.45 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.308 0 O-C-N 121.406 -0.809 . . . . 0.0 110.955 -178.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.524 ' O ' ' ND2' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -89.55 7.12 37.9 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 120.706 -1.246 . . . . 0.0 110.106 -179.698 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 24.6 p 44.35 51.28 7.7 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.097 -1.002 . . . . 0.0 110.624 178.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -93.19 5.37 51.76 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.081 -1.012 . . . . 0.0 108.423 179.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 73.61 2.7 61.0 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.669 -1.372 . . . . 0.0 109.669 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -141.94 166.34 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 O-C-N 121.261 -1.141 . . . . 0.0 108.665 178.59 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.1 tp -113.93 112.36 23.2 Favored 'General case' 0 N--CA 1.512 2.631 0 N-CA-C 107.478 -1.305 . . . . 0.0 107.478 178.074 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.58 178.41 6.79 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.503 -0.748 . . . . 0.0 110.645 -178.129 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -73.53 -42.98 61.04 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.467 -0.77 . . . . 0.0 111.25 -178.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.497 ' NE2' ' C ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -60.41 -24.46 65.18 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 120.513 -1.367 . . . . 0.0 108.591 -179.732 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -85.35 -33.28 22.08 Favored 'General case' 0 N--CA 1.498 1.954 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 178.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.1 tp -71.48 -35.49 70.84 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.55 -0.719 . . . . 0.0 109.336 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -74.3 -51.58 14.8 Favored 'General case' 0 C--N 1.306 -1.32 0 O-C-N 121.163 -0.96 . . . . 0.0 110.825 -179.143 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.8 -33.66 76.38 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.879 -1.138 . . . . 0.0 110.876 -178.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 40.1 tp -73.17 -27.83 61.87 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.956 -1.09 . . . . 0.0 110.089 -179.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -82.18 -47.9 11.93 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 120.716 -1.24 . . . . 0.0 110.156 -179.347 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 18.4 m . . . . . 0 C--N 1.3 -1.583 0 O-C-N 120.942 -1.099 . . . . 0.0 110.392 -179.216 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? . . . . . 0 N--CA 1.493 1.687 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 38.2 mt -83.37 -27.27 29.79 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.629 -0.669 . . . . 0.0 109.533 179.066 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -68.42 -36.89 79.73 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.928 -1.108 . . . . 0.0 109.682 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.4 mmt -84.57 -50.76 7.41 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.033 -1.042 . . . . 0.0 109.64 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 41.4 ttp180 -54.69 -38.29 66.83 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.878 -1.139 . . . . 0.0 110.309 -179.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -78.35 -53.09 7.67 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.978 -1.077 . . . . 0.0 110.508 -179.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 43.1 t60 -56.42 -33.23 65.63 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.019 -1.05 . . . . 0.0 109.506 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 58.4 t -75.04 -54.69 13.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 120.734 -1.228 . . . . 0.0 109.499 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 32.0 mtp -63.58 -16.3 60.47 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.309 -0.869 . . . . 0.0 110.269 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.462 ' C ' HD21 ' A' ' 76' ' ' ASN . 42.0 tttp -95.56 -38.24 10.5 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.644 -1.285 . . . . 0.0 110.132 -179.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . 0.637 HD21 ' N ' ' A' ' 76' ' ' ASN . 0.8 OUTLIER -98.21 -11.12 23.04 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 120.975 -1.078 . . . . 0.0 112.145 -178.015 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 74.0 t -110.32 -34.87 2.53 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.45 0 O-C-N 120.467 -1.396 . . . . 0.0 109.638 179.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -59.29 104.13 0.23 Allowed 'General case' 0 N--CA 1.494 1.764 0 O-C-N 120.562 -1.336 . . . . 0.0 107.778 177.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -83.16 -53.63 5.64 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.17 -0.956 . . . . 0.0 111.32 -178.22 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -101.87 24.68 9.6 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.24 -0.913 . . . . 0.0 109.666 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 33.08 37.95 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 178.579 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.574 ' C ' ' H ' ' A' ' 84' ' ' LEU . 16.5 p-10 -91.03 14.61 13.5 Favored 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 178.286 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 37.5 mtm180 64.02 -3.88 0.43 Allowed 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.574 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.4 mp -120.52 134.55 55.26 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 179.41 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 82.7 t -112.23 130.12 66.51 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.945 0 O-C-N 121.606 -0.684 . . . . 0.0 109.815 -178.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 26.4 p -103.43 162.35 13.1 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.246 -0.909 . . . . 0.0 108.667 178.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.8 tp -63.35 -35.54 80.73 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.264 -0.898 . . . . 0.0 109.063 179.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -60.73 -68.37 0.31 Allowed 'General case' 0 C--N 1.294 -1.824 0 O-C-N 121.128 -0.982 . . . . 0.0 111.623 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -61.46 -30.73 70.77 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.1 -1.0 . . . . 0.0 110.537 -178.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -64.58 -51.64 61.69 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.932 -1.105 . . . . 0.0 109.523 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 52.0 mt -48.39 -42.53 32.12 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.297 -0.877 . . . . 0.0 109.421 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -55.19 -57.77 10.43 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.064 -1.022 . . . . 0.0 110.373 -179.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 84.8 p -48.08 -61.87 1.76 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.165 -0.959 . . . . 0.0 110.951 -179.119 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.756 0 O-C-N 121.105 -0.997 . . . . 0.0 110.302 -178.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.653 ' ND2' ' H ' ' A' ' 20' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.738 -0.468 . . . . 0.0 109.738 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -65.34 -23.05 59.32 Favored 'Trans proline' 0 C--N 1.317 -1.13 0 C-N-CA 121.371 1.381 . . . . 0.0 109.761 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 55.7 tttp -56.77 -41.49 77.73 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.401 -0.812 . . . . 0.0 110.803 -179.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.653 ' H ' ' ND2' ' A' ' 17' ' ' ASN . 29.3 m -64.82 -40.18 94.78 Favored 'General case' 0 N--CA 1.485 1.321 0 O-C-N 120.76 -1.213 . . . . 0.0 110.355 -178.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -55.33 -41.82 72.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.942 -1.099 . . . . 0.0 108.263 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -62.54 -33.13 74.29 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.395 -0.816 . . . . 0.0 110.149 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.411 ' O ' ' N ' ' A' ' 25' ' ' HIS . 96.6 mt -75.84 -62.61 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 O-C-N 120.725 -1.235 . . . . 0.0 109.129 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.9 tp -47.51 -16.2 0.06 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.068 -1.02 . . . . 0.0 111.257 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.54 ' O ' ' ND1' ' A' ' 25' ' ' HIS . 0.7 OUTLIER -100.77 -15.74 17.55 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.479 -1.388 . . . . 0.0 109.833 179.896 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -76.32 89.55 3.17 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.863 -1.148 . . . . 0.0 108.462 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 10.9 mt -71.85 -52.19 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 O-C-N 121.448 -0.782 . . . . 0.0 111.134 -178.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.546 HD21 ' N ' ' A' ' 28' ' ' ASN . 1.7 m120 -86.32 4.48 38.95 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.856 -1.153 . . . . 0.0 110.029 -179.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 18.8 p 46.22 57.65 5.13 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.082 -1.011 . . . . 0.0 110.319 179.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -99.8 -0.07 40.55 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.274 -0.891 . . . . 0.0 108.737 179.4 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.85 3.76 87.84 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 110.101 -1.2 . . . . 0.0 110.101 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.12 165.35 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.121 0 O-C-N 121.16 -1.2 . . . . 0.0 108.328 178.037 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 tp -120.43 115.43 23.47 Favored 'General case' 0 N--CA 1.513 2.703 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 178.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.442 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 27.6 p-10 -98.29 -174.21 2.78 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.244 -0.91 . . . . 0.0 111.567 -178.1 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -72.16 -21.23 61.48 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -178.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.496 ' NE2' ' C ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -77.06 -25.86 52.89 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 120.008 -1.683 . . . . 0.0 109.349 -179.682 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -87.82 -31.84 19.36 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.946 -1.096 . . . . 0.0 108.415 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.2 tp -77.73 -33.58 52.92 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.598 -0.689 . . . . 0.0 109.17 179.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -71.85 -44.97 62.94 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.033 -1.042 . . . . 0.0 109.557 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.13 -43.45 64.66 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.043 -1.035 . . . . 0.0 111.3 -178.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.405 ' CD2' ' CD2' ' A' ' 25' ' ' HIS . 35.7 tp -62.39 -24.94 67.66 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.747 -1.221 . . . . 0.0 109.243 -179.404 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.53 -36.34 63.17 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 120.982 -1.074 . . . . 0.0 108.822 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 17.6 m . . . . . 0 C--N 1.302 -1.489 0 O-C-N 121.468 -0.77 . . . . 0.0 111.747 -178.436 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 6.4 mmm180 . . . . . 0 N--CA 1.494 1.744 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 27.3 mt -79.28 -26.88 42.28 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.276 -0.89 . . . . 0.0 110.211 -179.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.11 -39.67 82.74 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.025 -1.047 . . . . 0.0 110.368 -178.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 9.8 mtt -86.08 -48.7 8.39 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 120.906 -1.121 . . . . 0.0 110.099 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.459 ' CG ' ' NH1' ' A' ' 70' ' ' ARG . 2.7 ttt-85 -55.0 -36.22 65.19 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.771 -1.206 . . . . 0.0 109.767 179.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -71.91 -50.7 26.91 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 120.847 -1.158 . . . . 0.0 110.276 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 45.0 t-80 -56.23 -35.18 67.08 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.045 -1.034 . . . . 0.0 110.529 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 70.2 t -71.54 -55.12 14.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 120.613 -1.304 . . . . 0.0 109.776 -179.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.6 mmt -61.53 -22.13 64.87 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.228 -0.92 . . . . 0.0 110.069 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -84.34 -37.04 22.08 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.505 -1.372 . . . . 0.0 111.162 -179.141 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . 0.672 HD21 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -102.01 -24.99 13.91 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 120.961 -1.087 . . . . 0.0 112.611 -177.933 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.672 ' H ' HD21 ' A' ' 76' ' ' ASN . 32.6 t -92.86 -33.22 5.27 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.5 0 O-C-N 120.29 -1.506 . . . . 0.0 110.038 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -65.72 99.12 0.43 Allowed 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 178.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -82.68 -56.86 3.6 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.077 -1.014 . . . . 0.0 112.324 -177.099 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.541 ' O ' ' N ' ' A' ' 82' ' ' ASP . 4.9 m120 -98.28 23.83 7.91 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.063 -1.023 . . . . 0.0 109.591 -178.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.491 ' C ' ' H ' ' A' ' 83' ' ' ARG . 0.2 OUTLIER 35.65 25.83 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.58 0 CA-C-N 116.31 -0.404 . . . . 0.0 112.015 178.662 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.541 ' N ' ' O ' ' A' ' 80' ' ' ASN . 81.6 m-20 -81.54 11.07 4.93 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 106.696 -1.594 . . . . 0.0 106.696 178.11 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.491 ' H ' ' C ' ' A' ' 81' ' ' GLN . 70.0 mtt180 65.72 -5.74 0.48 Allowed 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 115.131 -0.941 . . . . 0.0 108.737 -178.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.53 ' H ' ' C ' ' A' ' 82' ' ' ASP . 10.9 mt -114.35 134.04 55.25 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 107.481 -1.303 . . . . 0.0 107.481 178.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 70.4 t -112.15 129.8 66.98 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.875 0 O-C-N 121.51 -0.744 . . . . 0.0 109.391 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 17.5 p -106.17 173.88 6.12 Favored 'General case' 0 N--CA 1.5 2.07 0 N-CA-C 108.166 -1.049 . . . . 0.0 108.166 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.6 tp -69.94 -35.22 74.36 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.213 -0.929 . . . . 0.0 109.422 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -61.04 -67.9 0.36 Allowed 'General case' 0 C--N 1.291 -1.952 0 O-C-N 120.897 -1.127 . . . . 0.0 111.578 -177.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -63.12 -30.88 71.94 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.183 -0.948 . . . . 0.0 110.713 -178.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -59.72 -52.36 65.82 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.887 -1.133 . . . . 0.0 109.551 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 87.2 mt -50.79 -48.0 59.64 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.234 -0.916 . . . . 0.0 108.963 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.89 -55.12 10.6 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.39 -0.819 . . . . 0.0 110.173 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 51.1 m -57.32 -28.53 63.16 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.978 -1.076 . . . . 0.0 110.633 -178.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 29.4 p . . . . . 0 N--CA 1.501 2.118 0 O-C-N 120.993 -1.067 . . . . 0.0 109.881 -179.723 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 45.1 t-20 . . . . . 0 N--CA 1.491 1.61 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -60.03 -15.04 31.17 Favored 'Trans proline' 0 C--N 1.318 -1.055 0 C-N-CA 121.352 1.368 . . . . 0.0 110.115 -179.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 58.5 tttp -55.7 -42.2 74.9 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.496 -0.752 . . . . 0.0 111.171 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 58.5 m -69.19 -40.65 77.95 Favored 'General case' 0 N--CA 1.484 1.27 0 O-C-N 120.619 -1.301 . . . . 0.0 110.619 -178.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.615 ' CE2' ' NE2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -54.68 -33.86 61.46 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 179.883 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -69.68 -34.89 74.58 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.493 -0.755 . . . . 0.0 109.977 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.498 ' O ' ' N ' ' A' ' 26' ' ' ASP . 97.8 mt -69.36 -59.92 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 O-C-N 120.866 -1.146 . . . . 0.0 109.1 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.7 tp -44.75 -36.47 3.2 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.468 -0.77 . . . . 0.0 110.577 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.615 ' NE2' ' CE2' ' A' ' 21' ' ' PHE . 56.1 m-70 -81.25 -11.88 59.26 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.273 -1.517 . . . . 0.0 109.609 179.631 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.498 ' N ' ' O ' ' A' ' 23' ' ' ILE . 73.3 m-20 -79.91 90.68 5.34 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.02 -1.05 . . . . 0.0 108.812 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 22.2 mt -75.75 -52.61 17.68 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.354 0 O-C-N 121.283 -0.885 . . . . 0.0 110.878 -178.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.51 HD21 ' N ' ' A' ' 28' ' ' ASN . 1.9 m120 -86.69 11.22 13.49 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.844 -1.16 . . . . 0.0 109.896 -179.569 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 25.0 p 43.6 52.65 6.11 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.333 -0.855 . . . . 0.0 110.554 179.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -95.0 -2.31 50.62 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.08 -1.012 . . . . 0.0 108.332 179.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 76.79 -1.87 61.23 Favored Glycine 0 N--CA 1.488 2.166 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.67 164.9 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.106 0 O-C-N 121.274 -1.133 . . . . 0.0 108.605 178.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 mp -121.36 125.6 47.38 Favored 'General case' 0 N--CA 1.519 3.006 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 178.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -108.03 -176.82 3.16 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.06 -1.025 . . . . 0.0 110.26 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -59.5 -13.21 8.1 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.676 -0.64 . . . . 0.0 111.042 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.547 ' NE2' ' O ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -81.17 -27.68 35.31 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.53 -1.356 . . . . 0.0 109.25 179.724 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -83.9 -37.46 22.35 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.961 -1.087 . . . . 0.0 109.652 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.537 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 1.5 mt -75.59 -30.7 59.7 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.712 -1.243 . . . . 0.0 108.476 178.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -61.73 -45.64 93.05 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 178.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.93 -28.42 61.51 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.395 -0.816 . . . . 0.0 110.733 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.96 -27.11 60.83 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 120.874 -1.141 . . . . 0.0 110.313 -178.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.537 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 37.9 m-85 -80.98 -49.91 10.35 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.677 -1.265 . . . . 0.0 108.989 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 49.0 m . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.16 -0.963 . . . . 0.0 111.169 -179.302 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.533 ' CG ' HH11 ' A' ' 66' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.525 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 22.8 mt -76.92 -27.4 54.88 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.385 -0.822 . . . . 0.0 109.87 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.51 ' CG ' HH11 ' A' ' 68' ' ' ARG . 0.0 OUTLIER -73.81 -38.1 64.69 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.023 -1.048 . . . . 0.0 109.88 -179.556 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 23.7 mtt -86.47 -41.59 14.27 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 120.673 -1.267 . . . . 0.0 109.182 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -68.3 -39.74 81.96 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.14 -0.975 . . . . 0.0 110.479 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -84.51 -51.52 6.84 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.987 -1.071 . . . . 0.0 111.419 -178.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.479 ' O ' ' ND2' ' A' ' 76' ' ' ASN . 56.9 t60 -53.76 -40.75 66.47 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.875 -1.141 . . . . 0.0 110.292 -178.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 69.2 t -73.94 -47.23 43.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 120.716 -1.24 . . . . 0.0 109.616 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.502 ' SD ' ' OD2' ' A' ' 78' ' ' ASP . 3.4 mmt -69.5 -17.16 63.57 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.126 -0.984 . . . . 0.0 110.275 -179.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.468 ' CB ' ' NZ ' ' A' ' 75' ' ' LYS . 6.4 ttpm? -90.64 -34.64 15.36 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.362 -1.461 . . . . 0.0 111.159 -178.733 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . 0.638 HD21 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -106.37 -26.49 11.46 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 120.95 -1.094 . . . . 0.0 113.079 -177.67 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.638 ' H ' HD21 ' A' ' 76' ' ' ASN . 40.9 t -94.44 -31.03 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.551 0 O-C-N 120.286 -1.509 . . . . 0.0 110.503 -179.018 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.502 ' OD2' ' SD ' ' A' ' 74' ' ' MET . 1.6 m-20 -69.06 103.53 1.89 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 120.447 -1.408 . . . . 0.0 107.652 178.538 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.23 -53.19 5.95 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.217 -0.927 . . . . 0.0 111.45 -177.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.462 ' O ' ' N ' ' A' ' 82' ' ' ASP . 8.7 t-20 -101.16 23.92 10.18 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 121.201 -0.937 . . . . 0.0 109.578 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.411 ' C ' ' O ' ' A' ' 80' ' ' ASN . 1.3 mm100 31.63 35.97 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 178.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.569 ' C ' ' H ' ' A' ' 84' ' ' LEU . 26.2 t0 -85.27 11.9 9.15 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 178.399 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 36.0 mtm180 65.34 -4.77 0.51 Allowed 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 -178.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.569 ' H ' ' C ' ' A' ' 82' ' ' ASP . 4.4 mp -121.08 134.61 55.27 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 179.117 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 76.1 t -113.85 130.17 68.45 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 O-C-N 121.514 -0.741 . . . . 0.0 110.321 -178.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 47.4 p -100.04 173.76 6.49 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 178.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.1 tp -73.6 -36.91 65.56 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.206 -0.934 . . . . 0.0 109.229 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 -63.6 -60.27 3.55 Favored 'General case' 0 C--N 1.29 -2.013 0 O-C-N 120.823 -1.173 . . . . 0.0 111.678 -177.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -63.66 -32.54 74.06 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.644 -1.285 . . . . 0.0 110.139 -178.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -66.01 -52.43 49.41 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.677 -1.265 . . . . 0.0 109.35 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.4 mp -46.85 -45.6 20.35 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.241 -0.912 . . . . 0.0 108.877 179.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -52.42 -57.6 9.35 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.199 -0.938 . . . . 0.0 110.214 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 40.6 m -45.09 -27.83 0.64 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.242 -0.911 . . . . 0.0 109.977 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 29.3 p . . . . . 0 N--CA 1.497 1.912 0 O-C-N 121.35 -0.844 . . . . 0.0 108.723 178.866 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.5 m120 . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -62.84 -18.76 66.28 Favored 'Trans proline' 0 C--N 1.318 -1.071 0 C-N-CA 121.573 1.515 . . . . 0.0 110.013 -179.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -55.17 -36.84 66.29 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.404 -0.81 . . . . 0.0 110.924 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.5 m -72.21 -40.91 67.47 Favored 'General case' 0 N--CA 1.484 1.266 0 O-C-N 120.802 -1.186 . . . . 0.0 110.523 -178.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -56.24 -34.85 66.74 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.9 -1.125 . . . . 0.0 108.038 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -69.68 -33.6 72.79 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.453 -0.779 . . . . 0.0 109.884 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 98.2 mt -72.85 -60.54 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 O-C-N 120.838 -1.164 . . . . 0.0 109.278 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -45.92 -39.26 8.52 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.297 -0.877 . . . . 0.0 110.798 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -78.78 -15.86 57.88 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.332 -1.48 . . . . 0.0 110.155 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -78.38 96.42 5.33 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.984 -1.073 . . . . 0.0 108.64 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 14.9 mt -75.9 -48.36 29.42 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.363 0 O-C-N 121.501 -0.749 . . . . 0.0 111.032 -178.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.513 ' O ' ' ND2' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -89.31 8.04 32.53 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.853 -1.154 . . . . 0.0 110.003 -179.696 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 46.4 p 44.59 54.75 6.28 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.112 -0.993 . . . . 0.0 110.59 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.466 ' OD1' ' N ' ' A' ' 30' ' ' ASP . 21.0 p-10 -94.77 -3.18 49.59 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.054 -1.029 . . . . 0.0 108.71 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 79.41 -5.69 59.58 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -132.43 165.57 31.76 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 178.507 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.1 tp -116.66 123.5 47.42 Favored 'General case' 0 N--CA 1.515 2.82 0 N-CA-C 107.68 -1.229 . . . . 0.0 107.68 178.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 35.4 p-10 -103.94 179.59 4.23 Favored 'General case' 0 N--CA 1.507 2.379 0 CA-C-O 122.06 0.933 . . . . 0.0 111.038 -178.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -68.19 -8.2 36.72 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.389 -179.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.9 mm100 -85.66 -47.11 10.12 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 120.812 -1.18 . . . . 0.0 109.292 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -73.91 -29.4 62.03 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.333 -0.854 . . . . 0.0 108.814 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.0 tp -79.23 -40.56 30.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.45 -0.781 . . . . 0.0 109.792 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 47.5 mm-40 -74.65 -44.15 51.8 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.598 -1.314 . . . . 0.0 109.59 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.83 -32.57 71.05 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 120.971 -1.081 . . . . 0.0 110.632 -179.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 55.6 tp -76.59 -27.67 55.9 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.906 -1.121 . . . . 0.0 110.481 -178.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -81.73 -50.25 9.49 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 120.686 -1.259 . . . . 0.0 109.27 -179.594 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 20.7 m . . . . . 0 N--CA 1.489 1.496 0 O-C-N 121.34 -0.85 . . . . 0.0 110.758 -178.971 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 38.7 ttt180 . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.414 ' O ' ' OE1' ' A' ' 71' ' ' GLU . 24.6 mt -81.88 -28.3 33.0 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.038 -1.039 . . . . 0.0 110.043 -179.59 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.9 -40.41 87.73 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.036 -1.04 . . . . 0.0 109.788 -179.309 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.4 mtm -84.75 -50.23 7.77 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.058 -1.026 . . . . 0.0 109.895 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.4 ttp180 -54.04 -27.69 33.79 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.795 -1.191 . . . . 0.0 109.982 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.414 ' OE1' ' O ' ' A' ' 67' ' ' LEU . 37.5 mt-10 -80.23 -51.22 9.2 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.853 -1.154 . . . . 0.0 110.103 -179.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -54.59 -34.48 62.03 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.092 -1.005 . . . . 0.0 110.547 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 72.6 t -73.2 -54.02 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 120.665 -1.272 . . . . 0.0 109.938 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.422 ' O ' ' CG ' ' A' ' 78' ' ' ASP . 2.0 mmt -62.41 -17.77 60.01 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.16 -0.962 . . . . 0.0 109.786 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.29 -38.57 10.94 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.633 -1.292 . . . . 0.0 111.014 -178.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . 0.49 HD21 ' N ' ' A' ' 76' ' ' ASN . 1.0 OUTLIER -98.06 -9.16 26.42 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.101 -1.0 . . . . 0.0 112.254 -177.707 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 84.6 t -116.1 -34.1 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.579 0 O-C-N 120.614 -1.304 . . . . 0.0 110.42 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.425 ' OD2' ' OE1' ' A' ' 81' ' ' GLN . 14.5 p-10 -48.93 108.0 0.16 Allowed 'General case' 0 N--CA 1.497 1.925 0 O-C-N 120.684 -1.26 . . . . 0.0 109.099 178.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -83.15 -66.62 0.87 Allowed 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.015 -1.053 . . . . 0.0 110.791 -178.024 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.53 ' O ' ' N ' ' A' ' 82' ' ' ASP . 10.5 m120 -104.62 25.2 10.59 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.109 -0.994 . . . . 0.0 109.351 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.5 ' C ' ' H ' ' A' ' 83' ' ' ARG . 0.2 OUTLIER 37.23 26.28 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.176 0.512 . . . . 0.0 111.135 178.937 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.554 ' C ' ' H ' ' A' ' 84' ' ' LEU . 56.4 t0 -81.32 12.84 3.27 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 178.405 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.5 ' H ' ' C ' ' A' ' 81' ' ' GLN . 72.6 mtt180 65.67 -5.29 0.51 Allowed 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 -178.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.554 ' H ' ' C ' ' A' ' 82' ' ' ASP . 9.9 mt -116.08 133.71 55.73 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 178.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 69.8 t -111.05 130.95 63.57 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.031 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 51.5 p -104.86 159.37 15.85 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.26 -0.9 . . . . 0.0 109.378 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.0 tp -61.3 -36.61 80.57 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -57.02 -68.55 0.21 Allowed 'General case' 0 C--N 1.294 -1.839 0 O-C-N 121.534 -0.728 . . . . 0.0 110.866 -178.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -63.94 -34.91 79.04 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.193 -0.942 . . . . 0.0 110.938 -178.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -58.3 -49.84 75.74 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.589 -1.319 . . . . 0.0 109.102 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 71.1 mt -51.71 -46.13 63.82 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.098 -1.001 . . . . 0.0 108.844 178.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -43.94 -51.36 7.71 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.458 -0.776 . . . . 0.0 110.094 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 93.7 p -58.0 -32.19 67.68 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.313 -0.867 . . . . 0.0 110.734 -179.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 22.2 p . . . . . 0 N--CA 1.502 2.172 0 O-C-N 120.999 -1.063 . . . . 0.0 110.271 -179.333 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 . . . . . 0 N--CA 1.498 1.927 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -58.98 -8.74 6.54 Favored 'Trans proline' 0 C--N 1.318 -1.07 0 C-N-CA 121.192 1.262 . . . . 0.0 109.877 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.0 tttp -60.87 -37.18 81.25 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.455 -0.778 . . . . 0.0 110.533 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 48.3 m -70.53 -39.14 74.22 Favored 'General case' 0 C--N 1.308 -1.228 0 O-C-N 120.854 -1.154 . . . . 0.0 110.261 -178.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.447 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.11 -39.95 72.98 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.972 -1.08 . . . . 0.0 108.264 179.692 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.447 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 35.9 t80 -64.97 -36.76 85.44 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.319 -0.863 . . . . 0.0 110.543 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.442 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.9 mt -71.5 -61.32 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 O-C-N 120.735 -1.228 . . . . 0.0 109.491 -179.226 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -46.72 -37.42 8.42 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.098 -1.001 . . . . 0.0 110.178 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 12.5 m-70 -74.69 -14.74 60.78 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.552 -1.342 . . . . 0.0 109.56 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.442 ' N ' ' O ' ' A' ' 23' ' ' ILE . 65.9 m-20 -76.26 93.22 3.38 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.948 -1.095 . . . . 0.0 108.859 179.052 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 33.0 mt -75.1 -53.18 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 O-C-N 121.135 -0.978 . . . . 0.0 110.731 -178.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.533 HD21 ' N ' ' A' ' 28' ' ' ASN . 1.7 m120 -86.42 13.86 7.61 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 120.844 -1.16 . . . . 0.0 109.955 -179.681 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.406 ' OG ' ' O ' ' A' ' 29' ' ' SER . 6.7 t 42.54 51.43 4.86 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.416 -0.803 . . . . 0.0 110.516 178.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -94.44 -4.07 48.94 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.11 -0.994 . . . . 0.0 108.33 179.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 77.25 -2.11 62.64 Favored Glycine 0 N--CA 1.489 2.167 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -140.5 164.82 21.39 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.04 0 O-C-N 121.41 -1.053 . . . . 0.0 108.601 178.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 mp -118.43 129.77 55.58 Favored 'General case' 0 N--CA 1.52 3.035 0 N-CA-C 107.872 -1.159 . . . . 0.0 107.872 177.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.479 ' C ' ' H ' ' A' ' 36' ' ' GLN . 26.2 p-10 -108.01 168.62 9.16 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.3 -0.875 . . . . 0.0 110.325 -179.076 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -50.8 -8.79 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.552 -0.717 . . . . 0.0 110.458 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.479 ' H ' ' C ' ' A' ' 34' ' ' ASP . 3.1 mm100 -84.09 -38.28 20.98 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 120.973 -1.079 . . . . 0.0 109.026 178.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -77.99 -29.61 49.74 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.211 -0.931 . . . . 0.0 109.012 179.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.543 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 10.4 mp -78.02 -40.53 38.65 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.107 -0.996 . . . . 0.0 108.368 179.369 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -69.03 -44.64 72.31 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.967 -1.083 . . . . 0.0 109.474 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.88 -27.9 65.19 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.323 -0.86 . . . . 0.0 110.59 -179.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 22.4 tp -75.32 -25.77 58.11 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.501 -1.374 . . . . 0.0 110.706 -178.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.543 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 11.4 m-85 -82.88 -39.9 20.94 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 120.296 -1.502 . . . . 0.0 110.287 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 84.8 m . . . . . 0 N--CA 1.492 1.646 0 O-C-N 120.717 -1.239 . . . . 0.0 111.406 -178.442 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 33.5 ttp180 . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 121.397 0.617 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.423 ' C ' ' CD1' ' A' ' 67' ' ' LEU . 0.6 OUTLIER -79.65 -26.73 40.99 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.31 -0.868 . . . . 0.0 109.716 -179.65 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.77 -38.65 85.97 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.886 -1.134 . . . . 0.0 109.664 -179.685 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 25.9 mtt -83.79 -50.41 8.15 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.927 -1.108 . . . . 0.0 109.864 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 52.8 ttt180 -50.43 -26.57 5.19 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 120.6 -1.312 . . . . 0.0 110.496 -179.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 -85.16 -51.78 6.39 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.774 -1.203 . . . . 0.0 110.684 -179.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.528 ' CE1' ' OD1' ' A' ' 76' ' ' ASN . 59.2 t-80 -54.82 -39.87 68.96 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.963 -1.086 . . . . 0.0 110.337 -179.281 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 68.9 t -73.29 -53.57 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 120.704 -1.248 . . . . 0.0 109.865 -179.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.445 ' O ' ' CG ' ' A' ' 78' ' ' ASP . 4.0 mmt -63.99 -22.8 67.08 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.014 -1.053 . . . . 0.0 109.815 -179.304 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.43 ' CB ' ' HZ1' ' A' ' 75' ' ' LYS . 7.3 ttpm? -89.42 -35.9 15.76 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.641 -1.287 . . . . 0.0 110.727 -178.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . 0.528 ' OD1' ' CE1' ' A' ' 72' ' ' HIS . 5.5 m120 -100.15 -8.95 23.05 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.027 -1.046 . . . . 0.0 112.339 -178.263 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 90.1 t -118.4 -31.56 1.74 Allowed 'Isoleucine or valine' 0 N--CA 1.513 2.684 0 O-C-N 120.497 -1.377 . . . . 0.0 111.063 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.445 ' CG ' ' O ' ' A' ' 74' ' ' MET . 17.1 p-10 -48.9 103.42 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.928 0 O-C-N 120.499 -1.375 . . . . 0.0 109.158 179.396 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -78.58 -63.55 1.38 Allowed 'General case' 0 C--N 1.298 -1.647 0 O-C-N 120.754 -1.216 . . . . 0.0 110.259 -178.518 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.445 ' ND2' ' O ' ' A' ' 80' ' ' ASN . 1.0 OUTLIER -107.98 26.91 9.79 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.142 -0.974 . . . . 0.0 109.745 179.836 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.433 ' OE1' ' OD2' ' A' ' 78' ' ' ASP . 0.2 OUTLIER 36.64 31.32 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.864 0 CA-C-O 121.203 0.525 . . . . 0.0 111.333 178.817 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.572 ' C ' ' H ' ' A' ' 84' ' ' LEU . 89.9 m-20 -87.34 15.66 6.19 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 178.681 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.469 ' CG ' ' NH1' ' A' ' 83' ' ' ARG . 6.5 mtt-85 63.17 -2.94 0.39 Allowed 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 -178.574 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.572 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.8 mp -122.73 134.12 54.46 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 179.309 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 75.6 t -112.61 129.52 68.04 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.111 0 O-C-N 121.634 -0.666 . . . . 0.0 109.407 -179.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 64.5 p -94.57 167.22 11.62 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 120.967 -1.083 . . . . 0.0 109.121 179.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.476 ' C ' ' CD1' ' A' ' 87' ' ' LEU . 1.0 OUTLIER -70.14 -38.36 75.48 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.685 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -58.94 -69.37 0.2 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.415 -0.803 . . . . 0.0 111.431 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.406 ' N ' ' CD ' ' A' ' 89' ' ' GLU . 4.9 mp0 -56.49 -32.28 64.86 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.008 -1.058 . . . . 0.0 110.497 -178.417 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -61.79 -48.93 78.42 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 120.799 -1.188 . . . . 0.0 110.135 -179.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 87.4 mt -51.32 -48.39 62.38 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.809 -1.182 . . . . 0.0 108.899 179.172 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -46.22 -59.88 2.64 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.4 -0.812 . . . . 0.0 110.295 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 44.1 t -48.88 -28.05 3.5 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.156 -0.965 . . . . 0.0 110.511 -179.03 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 43.9 p . . . . . 0 N--CA 1.499 2.018 0 O-C-N 121.093 -1.004 . . . . 0.0 108.987 179.645 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.424 ' C ' HD21 ' A' ' 17' ' ' ASN . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.587 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -64.65 -23.53 63.51 Favored 'Trans proline' 0 C--N 1.318 -1.045 0 C-N-CA 121.468 1.445 . . . . 0.0 109.751 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 61.1 tttp -59.21 -40.06 84.62 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.365 -0.834 . . . . 0.0 110.937 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 52.5 m -68.3 -41.5 80.8 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 120.767 -1.208 . . . . 0.0 110.525 -178.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -55.54 -36.86 67.24 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.026 -1.046 . . . . 0.0 108.371 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -66.87 -35.61 80.42 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.46 -0.775 . . . . 0.0 110.149 -179.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 97.5 mt -71.36 -60.99 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 O-C-N 120.702 -1.249 . . . . 0.0 108.985 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 tp -46.21 -37.51 7.23 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.334 -0.854 . . . . 0.0 110.795 -179.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.524 ' O ' ' ND1' ' A' ' 25' ' ' HIS . 0.9 OUTLIER -76.28 -16.22 59.83 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.517 -1.364 . . . . 0.0 109.548 -179.943 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -79.54 94.82 5.69 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.17 -0.956 . . . . 0.0 108.891 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 18.5 mt -75.93 -52.21 18.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 O-C-N 121.322 -0.861 . . . . 0.0 110.819 -178.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.614 ' H ' ' ND2' ' A' ' 28' ' ' ASN . 0.1 OUTLIER -84.57 -2.52 57.51 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.969 -1.082 . . . . 0.0 110.032 -179.615 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.465 ' N ' HD21 ' A' ' 28' ' ' ASN . 1.4 m 57.2 53.16 8.04 Favored 'General case' 0 C--N 1.294 -1.828 0 O-C-N 121.19 -0.944 . . . . 0.0 110.345 178.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -96.21 -1.07 48.99 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.163 -0.961 . . . . 0.0 108.468 179.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 76.45 -0.09 65.45 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.46 160.35 16.94 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 O-C-N 121.262 -1.14 . . . . 0.0 108.578 178.064 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 80.3 mt -107.85 128.6 54.75 Favored 'General case' 0 N--CA 1.511 2.616 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 178.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.455 ' C ' ' H ' ' A' ' 36' ' ' GLN . 39.2 p-10 -106.58 165.02 11.59 Favored 'General case' 0 N--CA 1.501 2.086 0 CA-C-O 121.757 0.789 . . . . 0.0 110.175 -179.279 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.414 ' O ' ' OE2' ' A' ' 39' ' ' GLU . 62.6 mt-10 -52.76 -8.56 0.09 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.771 -0.581 . . . . 0.0 110.325 -179.614 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.455 ' H ' ' C ' ' A' ' 34' ' ' ASP . 3.0 mm100 -86.33 -48.88 8.1 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.812 -1.18 . . . . 0.0 109.707 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 59.3 mt-10 -71.12 -29.19 64.94 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.277 -0.889 . . . . 0.0 109.18 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.4 tp -77.83 -39.04 44.92 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.506 -0.746 . . . . 0.0 109.885 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.53 ' OE1' ' N ' ' A' ' 39' ' ' GLU . 0.2 OUTLIER -74.68 -40.37 61.43 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.847 -1.158 . . . . 0.0 109.916 179.993 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.65 -39.31 73.71 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.075 -1.016 . . . . 0.0 111.686 -178.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 41.3 tp -73.07 -25.53 60.94 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 120.833 -1.167 . . . . 0.0 110.214 -178.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 1.4 m-30 -84.82 -49.65 8.24 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 120.853 -1.154 . . . . 0.0 109.388 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 16.2 m . . . . . 0 N--CA 1.49 1.56 0 O-C-N 120.994 -1.066 . . . . 0.0 110.054 -179.498 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 43.5 mtm180 . . . . . 0 N--CA 1.493 1.706 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 72.3 mt -57.85 -41.78 83.08 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.097 -1.002 . . . . 0.0 110.124 -178.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -70.21 -37.24 75.01 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.286 -0.884 . . . . 0.0 109.867 -179.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -82.52 -32.29 28.77 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.144 -0.972 . . . . 0.0 108.87 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 40.7 ttp180 -73.85 -49.74 23.63 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.02 -1.05 . . . . 0.0 109.915 179.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -60.58 -49.43 77.58 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.925 -1.11 . . . . 0.0 110.182 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 8.0 t60 -54.58 -36.41 64.37 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.169 -0.957 . . . . 0.0 110.259 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 69.5 t -75.5 -54.94 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 120.611 -1.306 . . . . 0.0 109.916 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.414 ' O ' ' CG ' ' A' ' 78' ' ' ASP . 4.1 mmt -63.32 -19.03 64.26 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.032 -1.043 . . . . 0.0 110.188 -179.163 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 72.7 tttt -93.43 -39.72 10.75 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.903 -1.123 . . . . 0.0 111.215 -178.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . 0.572 ' N ' HD21 ' A' ' 76' ' ' ASN . 1.0 OUTLIER -101.46 -9.47 21.05 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 121.081 -1.012 . . . . 0.0 112.33 -177.706 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 87.1 t -110.62 -35.38 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.471 0 O-C-N 120.475 -1.391 . . . . 0.0 109.692 179.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.424 ' OD2' ' OE1' ' A' ' 81' ' ' GLN . 11.9 p-10 -49.1 109.12 0.23 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.763 -1.211 . . . . 0.0 108.649 178.577 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.413 ' OG1' ' N ' ' A' ' 80' ' ' ASN . 0.1 OUTLIER -85.3 -62.54 1.51 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 120.914 -1.116 . . . . 0.0 110.397 -177.661 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.498 ' ND2' ' O ' ' A' ' 80' ' ' ASN . 0.7 OUTLIER -104.46 17.43 24.14 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.238 -0.914 . . . . 0.0 109.805 -179.557 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.424 ' OE1' ' OD2' ' A' ' 78' ' ' ASP . 0.3 OUTLIER 43.79 75.01 0.1 Allowed 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.414 -0.804 . . . . 0.0 111.013 177.967 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.582 ' C ' ' H ' ' A' ' 84' ' ' LEU . 45.8 t0 -132.33 19.44 4.4 Favored 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 107.899 -1.149 . . . . 0.0 107.899 178.525 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.513 HH11 ' CG ' ' A' ' 83' ' ' ARG . 5.1 mtt-85 59.62 -3.51 0.11 Allowed 'General case' 0 N--CA 1.491 1.621 0 CA-C-O 121.478 0.656 . . . . 0.0 109.236 -178.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.582 ' H ' ' C ' ' A' ' 82' ' ' ASP . 11.2 mt -123.39 134.96 53.93 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 179.569 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 74.4 t -110.4 128.43 66.68 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.036 0 O-C-N 121.493 -0.754 . . . . 0.0 109.124 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 60.9 p -102.37 156.54 17.52 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.264 -0.898 . . . . 0.0 109.346 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.1 tp -59.06 -39.27 81.55 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.484 -0.76 . . . . 0.0 108.955 179.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -58.8 -68.57 0.25 Allowed 'General case' 0 C--N 1.295 -1.803 0 O-C-N 121.607 -0.683 . . . . 0.0 110.993 -177.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -61.52 -30.28 70.53 Favored 'General case' 0 C--N 1.299 -1.618 0 O-C-N 121.233 -0.917 . . . . 0.0 110.717 -178.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -63.13 -51.68 65.53 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.902 -1.124 . . . . 0.0 109.68 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 78.7 mt -50.33 -45.07 54.58 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.263 -0.898 . . . . 0.0 109.376 179.466 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -51.52 -57.79 8.08 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.236 -0.915 . . . . 0.0 110.162 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 37.7 t -46.34 -34.34 4.5 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.24 -0.913 . . . . 0.0 110.518 -179.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 44.0 p . . . . . 0 N--CA 1.495 1.797 0 O-C-N 121.003 -1.06 . . . . 0.0 109.063 179.845 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.8 m120 . . . . . 0 N--CA 1.489 1.5 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -59.48 -11.76 14.95 Favored 'Trans proline' 0 C--N 1.319 -1.006 0 C-N-CA 121.445 1.43 . . . . 0.0 110.274 -179.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 48.4 tttm -56.05 -48.22 76.43 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.337 -0.852 . . . . 0.0 110.495 179.685 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 46.2 m -59.66 -37.98 80.19 Favored 'General case' 0 C--N 1.306 -1.296 0 O-C-N 120.963 -1.086 . . . . 0.0 110.444 -178.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.401 ' CD2' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.35 -47.71 78.27 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.915 -1.116 . . . . 0.0 108.126 179.717 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.401 ' N ' ' CD2' ' A' ' 21' ' ' PHE . 20.7 t80 -54.51 -32.7 58.56 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.527 -0.733 . . . . 0.0 109.896 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.48 ' O ' ' N ' ' A' ' 25' ' ' HIS . 96.5 mt -75.04 -61.94 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.223 0 O-C-N 120.814 -1.179 . . . . 0.0 109.676 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 20.5 mt -47.74 -13.23 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.785 -1.197 . . . . 0.0 110.742 -179.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.503 ' O ' ' ND1' ' A' ' 25' ' ' HIS . 1.0 OUTLIER -104.62 -14.02 15.76 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.526 -1.359 . . . . 0.0 110.582 -179.417 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.472 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 20.6 p-10 -79.59 70.33 6.05 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 120.827 -1.17 . . . . 0.0 109.238 179.662 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 8.1 mt -50.1 -53.18 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 O-C-N 121.041 -1.037 . . . . 0.0 111.127 -179.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.671 ' H ' ' ND2' ' A' ' 28' ' ' ASN . 0.0 OUTLIER -85.85 -1.85 57.67 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.891 -1.131 . . . . 0.0 110.095 -179.412 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.415 ' OG ' ' O ' ' A' ' 28' ' ' ASN . 19.9 p 53.34 50.82 16.69 Favored 'General case' 0 C--N 1.292 -1.895 0 O-C-N 121.289 -0.882 . . . . 0.0 110.49 178.69 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -95.11 3.41 54.79 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 74.47 1.13 60.31 Favored Glycine 0 N--CA 1.489 2.213 0 N-CA-C 109.776 -1.329 . . . . 0.0 109.776 -179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.67 163.39 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.093 0 O-C-N 121.131 -1.217 . . . . 0.0 108.931 178.371 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 68.4 mt -113.7 124.83 53.24 Favored 'General case' 0 N--CA 1.513 2.709 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 178.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -105.61 163.0 13.01 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.614 -0.679 . . . . 0.0 109.931 -179.3 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -49.23 -32.29 10.34 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.418 -0.801 . . . . 0.0 111.625 -178.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -64.61 -33.06 75.05 Favored 'General case' 0 C--N 1.293 -1.877 0 O-C-N 120.558 -1.339 . . . . 0.0 109.244 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -74.34 -38.14 63.34 Favored 'General case' 0 N--CA 1.496 1.852 0 C-N-CA 119.269 -0.972 . . . . 0.0 108.831 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.9 mt -81.58 -39.18 24.96 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.141 -0.975 . . . . 0.0 109.264 178.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -59.97 -39.93 87.33 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 120.628 -1.295 . . . . 0.0 108.775 179.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.21 -29.39 62.77 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.295 -0.878 . . . . 0.0 110.369 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -76.45 -24.3 53.89 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.195 -0.941 . . . . 0.0 110.289 -179.173 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -82.7 -50.5 8.65 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.672 -1.267 . . . . 0.0 109.646 -179.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 31.3 m . . . . . 0 N--CA 1.491 1.606 0 O-C-N 121.368 -0.833 . . . . 0.0 111.233 -179.036 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 5.9 mtm180 . . . . . 0 N--CA 1.493 1.681 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 64.8 mt -75.05 -28.81 60.55 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.163 -0.961 . . . . 0.0 109.422 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.473 ' HG2' HH11 ' A' ' 68' ' ' ARG . 0.0 OUTLIER -64.67 -40.69 95.85 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.112 -0.992 . . . . 0.0 109.498 -179.683 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 9.1 mtm -86.07 -50.3 7.14 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 120.988 -1.07 . . . . 0.0 109.367 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 24.8 ttt-85 -58.51 -41.71 86.05 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.915 -1.116 . . . . 0.0 110.576 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -74.9 -52.18 11.93 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 120.808 -1.183 . . . . 0.0 110.671 -179.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 17.6 t60 -54.32 -41.13 68.65 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.942 -1.099 . . . . 0.0 110.294 -179.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . 0.405 ' HA ' HD22 ' A' ' 76' ' ' ASN . 75.3 t -71.34 -49.07 50.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 120.689 -1.257 . . . . 0.0 109.522 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 16.9 mtp -67.81 -19.85 65.12 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.201 -0.937 . . . . 0.0 110.877 -179.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 35.1 pttt -88.11 -32.2 18.81 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 120.302 -1.499 . . . . 0.0 110.721 -179.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . 0.626 HD21 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -104.91 -27.07 11.93 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.104 -0.997 . . . . 0.0 112.587 -178.09 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.626 ' H ' HD21 ' A' ' 76' ' ' ASN . 40.2 t -92.61 -33.7 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 O-C-N 120.253 -1.53 . . . . 0.0 110.236 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -66.04 105.24 1.3 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.467 -1.396 . . . . 0.0 108.001 178.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.48 -54.16 5.17 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.298 -0.876 . . . . 0.0 111.417 -178.176 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.427 ' O ' ' C ' ' A' ' 81' ' ' GLN . 6.1 m120 -100.12 24.84 8.12 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.287 -0.883 . . . . 0.0 109.642 -179.438 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.427 ' C ' ' O ' ' A' ' 80' ' ' ASN . 0.9 OUTLIER 32.45 37.05 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 178.857 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.584 ' C ' ' H ' ' A' ' 84' ' ' LEU . 26.0 t0 -88.69 13.73 11.66 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 178.414 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 40.8 mtp180 61.93 -2.52 0.29 Allowed 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 -178.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.584 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.5 mp -122.92 134.53 54.36 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 106.695 -1.594 . . . . 0.0 106.695 178.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 69.0 t -112.84 129.98 67.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.049 0 O-C-N 121.687 -0.633 . . . . 0.0 110.21 -178.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 30.1 p -101.78 173.9 6.2 Favored 'General case' 0 N--CA 1.499 1.999 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.9 tp -73.14 -34.76 66.27 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.164 -0.96 . . . . 0.0 109.236 179.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -61.32 -68.24 0.33 Allowed 'General case' 0 C--N 1.293 -1.852 0 O-C-N 121.034 -1.041 . . . . 0.0 111.379 -177.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -60.01 -31.36 69.86 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.242 -0.911 . . . . 0.0 110.719 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -64.26 -52.37 59.0 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.912 -1.118 . . . . 0.0 110.136 -179.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 77.5 mt -49.97 -42.49 48.91 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.124 -0.985 . . . . 0.0 109.301 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -53.39 -57.64 9.92 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.297 -0.877 . . . . 0.0 110.304 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 42.9 t -48.31 -28.9 3.4 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.122 -0.986 . . . . 0.0 109.992 -179.158 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 33.2 p . . . . . 0 N--CA 1.5 2.026 0 O-C-N 121.242 -0.911 . . . . 0.0 108.993 179.677 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.661 ' N ' HD21 ' A' ' 17' ' ' ASN . 0.6 OUTLIER . . . . . 0 N--CA 1.493 1.68 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -68.3 -20.33 42.88 Favored 'Trans proline' 0 C--N 1.318 -1.066 0 C-N-CA 121.585 1.523 . . . . 0.0 110.54 -179.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -68.32 -49.42 60.48 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.176 -0.953 . . . . 0.0 111.362 -178.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.1 m -63.89 -41.34 97.74 Favored 'General case' 0 N--CA 1.485 1.283 0 O-C-N 120.723 -1.236 . . . . 0.0 110.53 -178.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.47 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.05 -39.56 72.21 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.948 -1.095 . . . . 0.0 108.357 -179.803 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.47 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 53.1 t80 -63.35 -34.0 76.76 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.188 -0.945 . . . . 0.0 110.074 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.47 ' O ' ' N ' ' A' ' 26' ' ' ASP . 97.0 mt -69.92 -59.83 3.11 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 O-C-N 120.714 -1.241 . . . . 0.0 109.099 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.7 tp -45.15 -38.91 5.6 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.325 -0.859 . . . . 0.0 110.377 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -75.15 -17.01 60.49 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 120.428 -1.42 . . . . 0.0 109.402 179.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.47 ' N ' ' O ' ' A' ' 23' ' ' ILE . 75.7 m-20 -80.02 92.25 5.57 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.094 -1.004 . . . . 0.0 109.066 179.624 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.1 mt -76.3 -45.17 35.36 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.429 0 O-C-N 121.318 -0.863 . . . . 0.0 110.635 -178.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.512 ' O ' ' ND2' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -94.04 8.21 42.28 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.788 -1.195 . . . . 0.0 110.12 -179.626 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 54.3 p 44.67 64.16 1.45 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.152 -0.967 . . . . 0.0 110.749 178.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -104.39 4.93 33.93 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.257 -0.902 . . . . 0.0 108.914 179.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 70.93 -0.05 31.53 Favored Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -139.2 165.32 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.033 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 177.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.2 tp -106.76 110.16 22.26 Favored 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 178.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -80.55 147.87 30.61 Favored 'General case' 0 N--CA 1.498 1.93 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.305 -178.477 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -52.32 -38.52 58.78 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.45 -0.781 . . . . 0.0 110.406 -179.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.9 mm100 -64.02 -34.21 77.49 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 120.927 -1.108 . . . . 0.0 108.605 179.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -73.46 -33.86 65.08 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 179.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.2 tp -76.5 -37.22 57.12 Favored 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -72.63 -49.7 30.16 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.957 -1.089 . . . . 0.0 110.119 -179.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.17 -50.46 61.04 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.895 -1.128 . . . . 0.0 110.902 -178.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 40.2 tp -56.16 -26.03 48.92 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.075 -1.015 . . . . 0.0 110.035 -178.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -83.13 -49.3 9.64 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 120.896 -1.127 . . . . 0.0 109.379 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 30.1 m . . . . . 0 C--N 1.301 -1.537 0 O-C-N 120.943 -1.098 . . . . 0.0 110.22 -179.303 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 24.9 ttp180 . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 121.272 0.558 . . . . 0.0 109.649 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.427 ' CD1' ' C ' ' A' ' 67' ' ' LEU . 0.5 OUTLIER -78.83 -26.85 44.22 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.19 -0.944 . . . . 0.0 109.948 -179.622 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.473 HH11 ' HG2' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -65.55 -38.76 90.54 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 120.959 -1.088 . . . . 0.0 109.889 -179.452 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 9.0 mtt -85.05 -29.56 24.83 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.121 -0.987 . . . . 0.0 109.857 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -72.95 -40.86 65.03 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.861 -1.149 . . . . 0.0 110.29 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -73.02 -47.28 46.34 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 120.793 -1.192 . . . . 0.0 110.501 -179.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 35.4 t-80 -55.75 -40.87 73.13 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.147 -0.971 . . . . 0.0 110.863 -179.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 66.0 t -72.6 -54.18 16.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 120.551 -1.343 . . . . 0.0 110.126 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.7 mmt -61.11 -19.72 61.81 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.141 -0.975 . . . . 0.0 110.018 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 43.4 tttp -82.64 -40.05 21.27 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.662 -1.273 . . . . 0.0 111.399 -178.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . 0.676 HD21 ' H ' ' A' ' 77' ' ' VAL . 0.0 OUTLIER -102.91 -20.77 14.14 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 120.983 -1.073 . . . . 0.0 112.35 -177.842 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.676 ' H ' HD21 ' A' ' 76' ' ' ASN . 31.3 t -97.83 -32.02 3.91 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.391 0 O-C-N 120.455 -1.403 . . . . 0.0 110.025 -179.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -53.28 107.76 0.27 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.724 -1.235 . . . . 0.0 109.302 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -81.18 -69.11 0.63 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.339 -0.85 . . . . 0.0 112.815 -177.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.466 ' O ' ' N ' ' A' ' 82' ' ' ASP . 9.5 m120 -107.88 27.8 8.86 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 120.879 -1.138 . . . . 0.0 110.748 -177.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.503 ' C ' ' H ' ' A' ' 83' ' ' ARG . 0.3 OUTLIER 42.13 23.24 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.751 0 O-C-N 121.58 -0.7 . . . . 0.0 111.245 178.794 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.522 ' C ' ' H ' ' A' ' 84' ' ' LEU . 37.3 t0 -82.78 13.97 3.51 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 177.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.503 ' H ' ' C ' ' A' ' 81' ' ' GLN . 44.0 mtm180 64.05 -2.25 0.59 Allowed 'General case' 0 N--CA 1.486 1.363 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.797 -179.036 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.522 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.3 mt -115.46 133.57 55.9 Favored 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 179.013 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 78.1 t -109.58 130.98 61.7 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 53.8 p -107.03 153.27 22.85 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.138 -0.976 . . . . 0.0 109.81 -179.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.4 tp -55.36 -34.62 64.43 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 179.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -57.09 -69.42 0.16 Allowed 'General case' 0 C--N 1.296 -1.743 0 O-C-N 121.43 -0.794 . . . . 0.0 111.862 -178.095 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -68.97 -33.24 73.37 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.862 -1.149 . . . . 0.0 110.895 -177.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -56.38 -50.93 70.13 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 120.765 -1.21 . . . . 0.0 108.777 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 52.9 mt -51.65 -49.72 61.77 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.187 -0.945 . . . . 0.0 109.337 179.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -44.48 -46.07 9.53 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.415 -0.803 . . . . 0.0 109.85 -179.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 53.5 p -57.27 -34.97 69.19 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.363 -0.836 . . . . 0.0 109.712 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 22.2 p . . . . . 0 N--CA 1.497 1.915 0 O-C-N 121.199 -0.938 . . . . 0.0 109.222 179.68 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.403 ' OD1' ' OG1' ' A' ' 20' ' ' THR . 5.8 t-20 . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -63.9 -21.97 68.81 Favored 'Trans proline' 0 C--N 1.318 -1.051 0 C-N-CA 121.402 1.401 . . . . 0.0 109.895 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -58.26 -37.38 74.83 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.165 -0.959 . . . . 0.0 110.801 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.403 ' OG1' ' OD1' ' A' ' 17' ' ' ASN . 52.7 m -71.52 -40.98 69.75 Favored 'General case' 0 C--N 1.307 -1.263 0 O-C-N 120.742 -1.224 . . . . 0.0 110.565 -178.568 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -55.85 -35.16 66.12 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.88 -1.137 . . . . 0.0 107.969 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -68.2 -33.3 74.18 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.423 -0.798 . . . . 0.0 109.268 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.505 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 96.7 mt -73.13 -61.51 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.217 0 O-C-N 120.882 -1.136 . . . . 0.0 108.992 179.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -44.37 -27.69 0.46 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.889 -1.132 . . . . 0.0 110.725 -179.644 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.665 ' N ' ' HD1' ' A' ' 25' ' ' HIS . 0.2 OUTLIER -90.21 -13.73 34.91 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.142 -1.599 . . . . 0.0 110.31 179.887 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.505 ' OD1' ' O ' ' A' ' 23' ' ' ILE . 20.3 p-10 -74.45 62.37 0.99 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.779 -1.2 . . . . 0.0 109.553 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 64.4 mt -48.83 -52.06 10.48 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 O-C-N 120.929 -1.107 . . . . 0.0 110.977 -179.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.523 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -90.1 12.47 17.71 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.818 -1.176 . . . . 0.0 110.056 -179.459 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.402 ' C ' ' O ' ' A' ' 28' ' ' ASN . 26.5 p 42.23 50.91 4.55 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.261 -0.9 . . . . 0.0 110.699 178.683 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.408 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 10.9 t70 -95.04 -3.89 47.45 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.03 -1.044 . . . . 0.0 108.53 179.365 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.61 4.51 87.72 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 -179.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.78 164.19 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 O-C-N 121.177 -1.19 . . . . 0.0 108.876 178.521 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.0 mp -115.43 121.06 41.61 Favored 'General case' 0 N--CA 1.518 2.934 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 177.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.544 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 0.2 OUTLIER -105.68 172.91 6.55 Favored 'General case' 0 N--CA 1.505 2.286 0 CA-C-O 121.766 0.794 . . . . 0.0 111.108 -177.82 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -53.92 -40.6 66.84 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.493 -0.755 . . . . 0.0 112.156 -178.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.493 ' NE2' ' C ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -61.88 -24.45 66.94 Favored 'General case' 0 C--N 1.295 -1.764 0 O-C-N 120.161 -1.587 . . . . 0.0 108.717 -179.799 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -81.09 -40.89 23.41 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.12 -0.987 . . . . 0.0 109.653 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.49 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 6.4 mt -75.81 -30.41 59.02 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.885 -1.134 . . . . 0.0 108.716 178.544 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -60.72 -46.2 91.32 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 120.887 -1.133 . . . . 0.0 108.699 178.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.44 -29.58 62.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.455 -0.778 . . . . 0.0 110.706 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -72.67 -25.76 61.38 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.057 -1.027 . . . . 0.0 110.248 -178.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.49 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 38.1 m-85 -80.67 -49.27 11.45 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 120.862 -1.149 . . . . 0.0 109.732 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 28.2 m . . . . . 0 N--CA 1.49 1.573 0 O-C-N 121.142 -0.974 . . . . 0.0 111.266 -178.963 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 37.4 mtm180 . . . . . 0 N--CA 1.492 1.636 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 30.1 mt -68.92 -27.67 65.97 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.203 -0.936 . . . . 0.0 109.586 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.3 -41.04 94.5 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.289 -0.882 . . . . 0.0 109.526 -179.62 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.9 mtt -85.8 -50.11 7.4 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.944 -1.098 . . . . 0.0 109.382 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.531 ' CG ' HH11 ' A' ' 70' ' ' ARG . 0.9 OUTLIER -56.1 -45.16 79.55 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.027 -1.045 . . . . 0.0 110.669 -179.703 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -75.55 -52.36 10.8 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.0 -1.063 . . . . 0.0 111.146 -178.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.515 ' O ' ' ND2' ' A' ' 76' ' ' ASN . 13.8 t60 -55.49 -39.77 70.86 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.062 -1.024 . . . . 0.0 110.455 -179.249 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 72.1 t -71.87 -53.79 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 120.654 -1.279 . . . . 0.0 109.782 -179.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.439 ' O ' ' OD1' ' A' ' 78' ' ' ASP . 3.0 mmt -64.67 -15.5 61.41 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.242 -0.911 . . . . 0.0 110.335 -179.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -93.86 -38.78 11.05 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.719 -1.238 . . . . 0.0 111.084 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . 0.636 HD21 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -100.61 -26.24 13.89 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 120.947 -1.096 . . . . 0.0 112.039 -178.178 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.636 ' H ' HD21 ' A' ' 76' ' ' ASN . 40.3 t -90.63 -36.14 7.97 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.279 0 O-C-N 120.268 -1.52 . . . . 0.0 109.197 179.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.439 ' OD1' ' O ' ' A' ' 74' ' ' MET . 10.0 p-10 -49.27 109.49 0.27 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.808 -1.182 . . . . 0.0 108.659 178.534 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.427 ' OG1' ' N ' ' A' ' 80' ' ' ASN . 0.1 OUTLIER -86.94 -64.18 1.19 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.994 -1.066 . . . . 0.0 110.318 -177.567 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.72 ' H ' HD21 ' A' ' 80' ' ' ASN . 0.1 OUTLIER -102.41 16.28 26.73 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.244 -0.91 . . . . 0.0 109.574 -179.651 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.43 ' OE1' ' OD2' ' A' ' 78' ' ' ASP . 0.4 OUTLIER 42.96 74.0 0.13 Allowed 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.495 -0.753 . . . . 0.0 111.09 178.127 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.583 ' C ' ' H ' ' A' ' 84' ' ' LEU . 38.9 t0 -129.45 18.36 5.84 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 178.313 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 78.2 mtt180 61.88 -4.71 0.18 Allowed 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 -178.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.583 ' H ' ' C ' ' A' ' 82' ' ' ASP . 9.8 mt -124.26 134.45 53.23 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 75.0 t -109.91 129.42 64.87 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.529 -0.732 . . . . 0.0 109.083 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 65.4 p -101.79 162.15 13.13 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.195 -0.941 . . . . 0.0 109.187 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.8 tp -63.8 -37.64 88.12 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -58.33 -68.72 0.23 Allowed 'General case' 0 C--N 1.293 -1.872 0 O-C-N 121.468 -0.77 . . . . 0.0 110.894 -178.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -61.95 -30.55 70.99 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.324 -0.86 . . . . 0.0 110.863 -178.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -64.26 -51.6 62.8 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.763 -1.21 . . . . 0.0 109.539 -179.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 67.4 mt -49.12 -44.31 42.26 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.224 -0.923 . . . . 0.0 109.224 179.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -51.16 -58.81 5.15 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.326 -0.859 . . . . 0.0 110.054 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 43.2 t -45.61 -29.99 1.38 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.135 -0.978 . . . . 0.0 109.968 -179.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 29.9 p . . . . . 0 N--CA 1.497 1.914 0 O-C-N 121.241 -0.912 . . . . 0.0 108.856 179.323 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.488 ' N ' ' ND2' ' A' ' 17' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -64.82 -17.19 58.74 Favored 'Trans proline' 0 C--N 1.318 -1.066 0 C-N-CA 121.535 1.49 . . . . 0.0 110.299 -179.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 43.4 tttm -57.48 -36.84 71.98 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.247 -0.908 . . . . 0.0 110.767 -179.269 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.4 m -69.13 -39.37 78.92 Favored 'General case' 0 C--N 1.306 -1.291 0 O-C-N 120.804 -1.185 . . . . 0.0 110.091 -179.125 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.419 ' CE2' ' CD2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -56.72 -40.5 75.78 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.091 -1.006 . . . . 0.0 108.508 -179.951 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -64.11 -36.28 83.51 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.358 -0.839 . . . . 0.0 110.583 -179.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.415 ' O ' ' N ' ' A' ' 26' ' ' ASP . 84.0 mt -73.96 -61.33 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.247 0 O-C-N 120.71 -1.244 . . . . 0.0 109.323 -179.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 34.9 tp -46.31 -30.78 2.2 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.098 -1.001 . . . . 0.0 110.743 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.515 ' N ' ' HD1' ' A' ' 25' ' ' HIS . 1.1 m80 -84.75 -14.73 47.38 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.27 -1.519 . . . . 0.0 109.424 179.537 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.415 ' N ' ' O ' ' A' ' 23' ' ' ILE . 95.0 m-20 -74.81 94.18 2.73 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.151 -0.968 . . . . 0.0 108.895 179.131 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 25.7 mt -76.64 -51.6 18.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.346 0 O-C-N 121.414 -0.804 . . . . 0.0 110.964 -178.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.52 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.9 OUTLIER -87.65 7.91 27.81 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 120.753 -1.217 . . . . 0.0 110.03 -179.494 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 24.8 p 44.03 48.88 7.41 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.165 -0.959 . . . . 0.0 110.528 178.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.511 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 19.6 p-10 -91.98 0.01 57.48 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.128 -0.982 . . . . 0.0 108.489 179.1 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 79.28 -2.77 69.51 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 109.791 -1.324 . . . . 0.0 109.791 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -138.61 164.16 26.83 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 O-C-N 121.286 -1.126 . . . . 0.0 108.673 178.374 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.7 tp -113.92 110.04 19.46 Favored 'General case' 0 N--CA 1.511 2.576 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 177.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.72 -176.09 5.13 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.472 -0.768 . . . . 0.0 110.751 -177.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -73.46 -44.49 57.96 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.523 -0.736 . . . . 0.0 111.372 -178.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.51 ' NE2' ' C ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -59.29 -25.0 63.75 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 120.455 -1.403 . . . . 0.0 108.323 -179.768 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -85.02 -33.68 22.47 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 179.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.4 tp -74.65 -32.27 62.22 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.42 -0.8 . . . . 0.0 109.283 179.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.24 -46.51 60.9 Favored 'General case' 0 C--N 1.305 -1.342 0 O-C-N 121.28 -0.888 . . . . 0.0 109.733 -179.524 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.53 -35.51 73.2 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.103 -0.998 . . . . 0.0 110.514 -179.305 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.6 mt -69.3 -25.76 64.39 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.938 -1.101 . . . . 0.0 109.325 -179.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.412 ' CZ ' ' SD ' ' A' ' 69' ' ' MET . 0.1 OUTLIER -81.58 -51.81 7.86 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 120.881 -1.137 . . . . 0.0 109.781 -179.13 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 68.6 m . . . . . 0 C--N 1.301 -1.538 0 O-C-N 121.218 -0.926 . . . . 0.0 111.345 -178.392 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . 0.411 ' CG ' HH11 ' A' ' 66' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 121.21 0.529 . . . . 0.0 109.915 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.423 ' C ' ' CD1' ' A' ' 67' ' ' LEU . 0.6 OUTLIER -79.68 -27.34 40.78 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.228 -0.92 . . . . 0.0 110.037 -179.149 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -62.05 -39.27 91.8 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.98 -1.075 . . . . 0.0 109.883 -179.347 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' MET . . . . . 0.412 ' SD ' ' CZ ' ' A' ' 42' ' ' PHE . 17.8 ttm -86.11 -33.02 21.02 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.05 -1.031 . . . . 0.0 109.859 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 66.4 ttt180 -65.07 -30.33 71.28 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.593 -1.317 . . . . 0.0 109.363 179.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 67.0 mt-10 -77.81 -48.18 17.14 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.205 -0.934 . . . . 0.0 109.975 -179.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.519 ' CD2' ' OD1' ' A' ' 76' ' ' ASN . 29.4 t60 -59.63 -35.15 73.81 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.16 -0.962 . . . . 0.0 110.007 -179.488 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 69.6 t -74.47 -54.17 15.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 120.708 -1.245 . . . . 0.0 109.381 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.486 ' SD ' ' OD2' ' A' ' 78' ' ' ASP . 2.7 mmt -58.78 -22.41 58.15 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.087 -1.008 . . . . 0.0 109.298 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.8 ttpt -94.4 -27.66 15.93 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.801 -1.187 . . . . 0.0 110.759 -179.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . 0.519 ' OD1' ' CD2' ' A' ' 72' ' ' HIS . 12.9 m120 -105.95 -12.1 15.94 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.159 -0.963 . . . . 0.0 112.643 -177.897 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 57.3 t -118.13 -34.86 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.533 0 O-C-N 120.372 -1.455 . . . . 0.0 111.397 -178.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.486 ' OD2' ' SD ' ' A' ' 74' ' ' MET . 0.9 OUTLIER -67.15 99.48 0.68 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.241 -1.537 . . . . 0.0 107.574 178.929 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -80.77 -52.25 7.73 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.213 -0.93 . . . . 0.0 111.891 -177.476 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.529 ' O ' ' N ' ' A' ' 82' ' ' ASP . 9.5 t-20 -99.63 24.1 8.69 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.061 -1.024 . . . . 0.0 109.532 -179.406 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.473 ' C ' ' H ' ' A' ' 83' ' ' ARG . 0.9 OUTLIER 32.95 30.51 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.754 0 CA-C-O 120.985 0.421 . . . . 0.0 112.062 178.697 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.552 ' C ' ' H ' ' A' ' 84' ' ' LEU . 87.0 m-20 -81.03 10.6 4.95 Favored 'General case' 0 C--N 1.299 -1.613 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 178.406 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.473 ' H ' ' C ' ' A' ' 81' ' ' GLN . 25.3 mtp180 65.12 -4.03 0.55 Allowed 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 -178.391 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.552 ' H ' ' C ' ' A' ' 82' ' ' ASP . 4.6 mp -118.48 134.47 55.05 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 178.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 88.9 t -112.3 129.39 67.91 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.076 0 O-C-N 121.617 -0.677 . . . . 0.0 109.541 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 22.0 p -103.36 167.22 9.95 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.262 -0.898 . . . . 0.0 108.722 178.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.464 ' C ' ' CD1' ' A' ' 87' ' ' LEU . 1.2 tm? -65.15 -35.47 81.21 Favored 'General case' 0 C--N 1.297 -1.705 0 O-C-N 121.383 -0.823 . . . . 0.0 108.782 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -61.75 -70.06 0.21 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.946 -1.096 . . . . 0.0 112.811 -178.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -59.37 -32.66 70.33 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.773 -1.204 . . . . 0.0 110.914 -177.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -58.83 -50.92 72.16 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.92 -1.113 . . . . 0.0 109.901 -179.366 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 78.7 mt -52.78 -48.94 66.49 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 120.924 -1.11 . . . . 0.0 109.602 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -46.66 -44.69 18.7 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.27 -0.894 . . . . 0.0 110.077 -179.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 46.5 m -62.41 -30.66 71.38 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.279 -0.888 . . . . 0.0 110.266 -179.309 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 44.6 p . . . . . 0 N--CA 1.498 1.956 0 O-C-N 121.018 -1.051 . . . . 0.0 109.081 179.644 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.45 ' C ' HD21 ' A' ' 17' ' ' ASN . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -65.93 -21.92 56.44 Favored 'Trans proline' 0 C--N 1.319 -0.975 0 C-N-CA 121.588 1.525 . . . . 0.0 110.033 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 69.7 tttt -57.3 -35.85 70.35 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.216 -0.928 . . . . 0.0 110.887 -179.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.4 m -71.01 -41.24 71.15 Favored 'General case' 0 C--N 1.306 -1.303 0 O-C-N 120.785 -1.197 . . . . 0.0 110.272 -178.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.482 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.37 -36.91 69.36 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.042 -1.036 . . . . 0.0 108.487 -179.835 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.482 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 36.4 t80 -67.15 -34.81 78.37 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.335 -0.853 . . . . 0.0 110.135 -179.614 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.1 mt -74.54 -61.18 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.241 0 O-C-N 120.731 -1.23 . . . . 0.0 109.39 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.3 tp -46.57 -37.57 8.24 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.066 -1.021 . . . . 0.0 110.811 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.523 ' N ' ' HD1' ' A' ' 25' ' ' HIS . 0.6 OUTLIER -75.99 -18.26 59.37 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.367 -1.458 . . . . 0.0 109.709 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -75.98 90.67 3.01 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.131 -0.981 . . . . 0.0 108.783 179.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 13.9 mt -71.23 -52.26 28.28 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 O-C-N 121.319 -0.863 . . . . 0.0 110.801 -178.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.525 HD21 ' N ' ' A' ' 28' ' ' ASN . 1.8 m120 -84.08 11.6 7.72 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.831 -1.168 . . . . 0.0 109.83 -179.83 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.445 ' OG ' ' O ' ' A' ' 29' ' ' SER . 10.0 t 43.88 43.76 5.41 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.222 -0.924 . . . . 0.0 110.373 178.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -87.35 -3.41 59.03 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.009 -1.057 . . . . 0.0 108.819 179.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.38 -0.34 75.42 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -142.42 161.5 19.2 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 O-C-N 121.196 -1.179 . . . . 0.0 108.783 178.621 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.6 mp -113.12 131.74 55.72 Favored 'General case' 0 N--CA 1.517 2.91 0 N-CA-C 107.764 -1.198 . . . . 0.0 107.764 177.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 39.8 p-10 -106.51 174.2 5.99 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 121.371 -0.831 . . . . 0.0 109.934 -179.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -59.63 -7.69 1.63 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.431 -0.793 . . . . 0.0 110.088 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.9 mm100 -85.29 -40.22 16.83 Favored 'General case' 0 C--N 1.297 -1.706 0 O-C-N 121.052 -1.03 . . . . 0.0 109.845 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -67.79 -33.03 74.01 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.157 -0.964 . . . . 0.0 109.56 -179.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.459 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 1.4 mt -80.45 -38.48 29.95 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.958 -1.089 . . . . 0.0 109.38 179.192 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.49 ' OE1' ' N ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -59.76 -41.81 91.88 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.882 -1.137 . . . . 0.0 108.794 179.481 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.07 -29.21 61.76 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.236 -0.915 . . . . 0.0 111.142 -179.204 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -76.76 -26.63 54.75 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 120.896 -1.127 . . . . 0.0 110.819 -178.654 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.459 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 28.9 m-85 -80.49 -49.19 11.71 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 120.42 -1.425 . . . . 0.0 108.929 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 53.5 m . . . . . 0 N--CA 1.488 1.447 0 O-C-N 121.245 -0.909 . . . . 0.0 110.277 -179.858 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.488 1.455 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 25.0 mt -79.45 -28.72 41.62 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.459 -0.776 . . . . 0.0 109.303 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -65.42 -37.24 86.36 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.211 -0.93 . . . . 0.0 109.677 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 13.7 mtt -85.34 -37.93 19.36 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.922 -1.111 . . . . 0.0 109.677 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.519 ' CG ' HH11 ' A' ' 70' ' ' ARG . 0.0 OUTLIER -66.25 -51.88 53.17 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.022 -1.049 . . . . 0.0 110.393 -179.386 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -69.85 -51.55 32.43 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.152 -0.967 . . . . 0.0 110.934 -178.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.491 ' CE1' ' OD1' ' A' ' 76' ' ' ASN . 62.0 t-80 -55.73 -42.03 74.77 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.921 -1.112 . . . . 0.0 110.516 -178.792 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 77.4 t -73.05 -54.21 16.37 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 120.645 -1.285 . . . . 0.0 109.804 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.462 ' SD ' ' NH1' ' A' ' 70' ' ' ARG . 37.2 mtp -65.36 -19.67 66.05 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.971 -1.081 . . . . 0.0 110.264 -179.098 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.5 ttpp -94.79 -32.66 13.2 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.727 -1.233 . . . . 0.0 110.237 -179.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . 0.491 ' OD1' ' CE1' ' A' ' 72' ' ' HIS . 6.3 m120 -100.57 -8.79 22.64 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.203 -0.936 . . . . 0.0 111.792 -178.464 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 85.5 t -117.13 -38.04 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.539 0 O-C-N 120.593 -1.317 . . . . 0.0 110.376 179.253 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.401 ' OD2' ' O ' ' A' ' 74' ' ' MET . 83.9 m-20 -49.47 112.38 0.63 Allowed 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.606 -1.309 . . . . 0.0 108.983 178.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.58 -59.24 2.3 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.284 -0.885 . . . . 0.0 110.41 -177.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.422 ' ND2' ' O ' ' A' ' 80' ' ' ASN . 1.1 t-20 -103.43 25.53 9.51 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.309 -0.869 . . . . 0.0 109.447 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.403 ' C ' ' O ' ' A' ' 80' ' ' ASN . 1.3 mm100 34.63 48.22 0.29 Allowed 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.054 0.454 . . . . 0.0 112.146 178.363 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.579 ' C ' ' H ' ' A' ' 84' ' ' LEU . 12.8 p-10 -99.72 15.33 27.16 Favored 'General case' 0 N--CA 1.495 1.809 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 178.463 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.437 HH11 ' HG3' ' A' ' 83' ' ' ARG . 10.5 mtm-85 63.06 -2.83 0.38 Allowed 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 -178.345 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.579 ' H ' ' C ' ' A' ' 82' ' ' ASP . 4.8 mp -125.62 135.3 52.03 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 179.524 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 70.2 t -112.81 129.71 67.94 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.083 0 O-C-N 121.552 -0.718 . . . . 0.0 109.615 -178.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 68.8 p -98.1 163.01 12.93 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.225 -0.922 . . . . 0.0 109.13 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.463 ' C ' ' CD1' ' A' ' 87' ' ' LEU . 1.4 tm? -66.04 -38.61 88.81 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 179.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -59.38 -69.71 0.19 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.344 -0.848 . . . . 0.0 111.456 -179.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -57.24 -30.07 64.31 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.101 -0.999 . . . . 0.0 110.36 -178.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -61.5 -51.22 69.56 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.024 -1.048 . . . . 0.0 110.076 -179.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 92.4 mt -52.81 -44.98 67.03 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.984 -1.073 . . . . 0.0 109.354 179.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -46.9 -49.68 20.0 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.185 -0.947 . . . . 0.0 109.911 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 41.9 m -60.5 -26.27 66.7 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.249 -0.907 . . . . 0.0 110.179 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 26.4 p . . . . . 0 N--CA 1.499 1.992 0 O-C-N 121.213 -0.929 . . . . 0.0 110.047 -179.544 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -65.35 -22.44 59.94 Favored 'Trans proline' 0 C--N 1.319 -1.009 0 C-N-CA 121.509 1.473 . . . . 0.0 109.698 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -56.24 -36.07 68.09 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.352 -0.842 . . . . 0.0 110.991 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 69.9 m -73.17 -41.64 63.65 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 120.687 -1.258 . . . . 0.0 110.617 -178.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -56.39 -35.02 67.27 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.919 -1.113 . . . . 0.0 108.184 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -69.25 -34.96 75.6 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.323 -0.861 . . . . 0.0 109.836 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.485 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.9 mt -69.89 -59.69 3.25 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.157 0 O-C-N 120.798 -1.189 . . . . 0.0 109.006 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 tp -44.49 -36.39 2.92 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.353 -0.842 . . . . 0.0 110.735 -179.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.602 ' N ' ' HD1' ' A' ' 25' ' ' HIS . 0.3 OUTLIER -80.57 -14.19 58.42 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.391 -1.443 . . . . 0.0 109.536 179.758 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.485 ' N ' ' O ' ' A' ' 23' ' ' ILE . 82.1 m-20 -78.34 93.29 4.65 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.174 -0.954 . . . . 0.0 109.236 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 75.5 mt -77.3 -51.8 17.78 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.437 0 O-C-N 121.407 -0.808 . . . . 0.0 110.65 -178.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.631 ' H ' ' ND2' ' A' ' 28' ' ' ASN . 0.0 OUTLIER -88.18 -3.12 58.92 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.917 -1.115 . . . . 0.0 110.234 -179.41 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.458 ' N ' HD21 ' A' ' 28' ' ' ASN . 4.5 t 52.86 57.83 5.96 Favored 'General case' 0 C--N 1.295 -1.796 0 O-C-N 121.263 -0.898 . . . . 0.0 110.402 179.111 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -99.9 7.17 45.08 Favored 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 72.88 5.47 64.93 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.876 -1.29 . . . . 0.0 109.876 -179.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -144.18 164.85 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.985 0 O-C-N 121.196 -1.179 . . . . 0.0 108.565 177.658 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 tp -112.81 128.6 56.48 Favored 'General case' 0 N--CA 1.512 2.643 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 178.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 40.0 p-10 -104.91 163.04 12.82 Favored 'General case' 0 N--CA 1.504 2.265 0 CA-C-O 121.896 0.855 . . . . 0.0 110.606 -178.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.527 ' H ' ' CD ' ' A' ' 35' ' ' GLU . 1.7 mp0 -57.73 -8.95 1.03 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.911 -0.493 . . . . 0.0 111.069 -179.216 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -85.12 -36.64 20.98 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.765 -1.209 . . . . 0.0 109.548 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -81.12 -34.9 32.22 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 179.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.4 tp -72.75 -42.02 64.51 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.614 -0.679 . . . . 0.0 110.029 179.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -71.85 -34.03 68.93 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.553 -1.342 . . . . 0.0 108.892 179.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.3 -28.63 62.2 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.256 -0.902 . . . . 0.0 110.285 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.63 -31.2 68.07 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.913 -1.117 . . . . 0.0 109.855 -179.111 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -77.8 -47.98 17.63 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 120.509 -1.37 . . . . 0.0 109.812 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 54.3 m . . . . . 0 N--CA 1.492 1.657 0 O-C-N 121.069 -1.02 . . . . 0.0 111.321 -178.769 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 47.8 mtt180 . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.445 ' CD1' ' C ' ' A' ' 67' ' ' LEU . 0.0 OUTLIER -82.68 -33.09 27.78 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.024 -1.048 . . . . 0.0 109.832 -178.936 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.4 tpp180 -63.8 -38.82 92.53 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.111 -0.993 . . . . 0.0 110.009 -179.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 4.0 mtt -83.65 -51.12 7.55 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.068 -1.02 . . . . 0.0 109.272 179.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 29.1 ttp180 -51.07 -41.05 59.67 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.842 -1.161 . . . . 0.0 109.79 179.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -74.91 -52.52 11.05 Favored 'General case' 0 C--N 1.305 -1.343 0 O-C-N 120.841 -1.162 . . . . 0.0 111.166 -178.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.457 ' CD2' ' OD1' ' A' ' 76' ' ' ASN . 23.5 t60 -55.95 -36.85 68.24 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.92 -1.112 . . . . 0.0 110.059 -179.587 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 78.9 t -75.56 -55.32 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 120.68 -1.263 . . . . 0.0 109.798 -179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 35.7 mtp -62.48 -18.06 61.01 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.304 -0.872 . . . . 0.0 109.889 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 43.3 tttp -94.01 -37.66 11.55 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.656 -1.277 . . . . 0.0 109.929 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . 0.457 ' OD1' ' CD2' ' A' ' 72' ' ' HIS . 11.9 m120 -98.23 -11.05 23.09 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.146 -0.971 . . . . 0.0 112.05 -178.15 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 64.5 t -111.26 -35.76 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.559 0 O-C-N 120.458 -1.401 . . . . 0.0 109.911 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -57.88 109.46 0.73 Allowed 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.477 -1.39 . . . . 0.0 108.123 177.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -85.06 -55.15 4.2 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.173 -0.955 . . . . 0.0 111.102 -178.158 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.527 ' O ' ' N ' ' A' ' 82' ' ' ASP . 23.9 m120 -101.95 25.15 9.02 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.231 -0.918 . . . . 0.0 109.687 -179.442 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.445 ' C ' ' H ' ' A' ' 83' ' ' ARG . 0.6 OUTLIER 33.83 29.37 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 178.609 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.533 ' C ' ' H ' ' A' ' 84' ' ' LEU . 19.8 p-10 -81.36 9.98 6.36 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 178.428 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.445 ' H ' ' C ' ' A' ' 81' ' ' GLN . 8.4 mtm-85 66.86 -5.43 0.66 Allowed 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 -178.731 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.533 ' H ' ' C ' ' A' ' 82' ' ' ASP . 13.6 mt -116.81 134.89 54.23 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 107.583 -1.265 . . . . 0.0 107.583 178.661 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 82.0 t -111.49 129.92 65.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.976 0 O-C-N 121.576 -0.703 . . . . 0.0 109.948 -178.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 31.9 p -105.53 159.87 15.61 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.6 tp -60.92 -36.78 80.18 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.382 -0.824 . . . . 0.0 109.223 179.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -60.18 -69.56 0.21 Allowed 'General case' 0 C--N 1.295 -1.788 0 O-C-N 121.254 -0.904 . . . . 0.0 111.495 -177.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -60.42 -30.31 69.53 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.161 -0.962 . . . . 0.0 110.334 -178.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -64.91 -51.95 59.12 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.874 -1.142 . . . . 0.0 109.893 -179.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 57.3 mt -48.25 -44.87 33.78 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.142 -0.974 . . . . 0.0 109.294 179.651 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -54.69 -60.3 3.54 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.403 -0.811 . . . . 0.0 110.497 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.0 t -42.44 -35.17 0.97 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.445 -0.784 . . . . 0.0 111.349 -178.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 50.7 p . . . . . 0 N--CA 1.496 1.85 0 O-C-N 120.671 -1.268 . . . . 0.0 108.767 179.93 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 . . . . . 0 N--CA 1.492 1.633 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -63.95 -21.37 68.7 Favored 'Trans proline' 0 C--N 1.317 -1.081 0 C-N-CA 121.354 1.37 . . . . 0.0 109.862 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 55.8 tttp -55.41 -38.64 69.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.434 -0.791 . . . . 0.0 111.15 -179.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 49.4 m -70.78 -41.9 71.06 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 120.477 -1.389 . . . . 0.0 110.37 -178.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.514 ' CE2' ' NE2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -54.46 -44.88 72.93 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 179.761 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.421 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 20.9 t80 -57.67 -34.0 68.92 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.468 -0.77 . . . . 0.0 109.548 179.524 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.52 ' O ' ' N ' ' A' ' 25' ' ' HIS . 92.8 mt -72.41 -61.64 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 O-C-N 120.819 -1.175 . . . . 0.0 108.559 179.403 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.43 ' C ' ' HD1' ' A' ' 25' ' ' HIS . 4.6 tp -45.48 -14.32 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.072 -1.018 . . . . 0.0 110.846 179.865 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.605 ' N ' ' HD1' ' A' ' 25' ' ' HIS . 0.6 OUTLIER -104.21 -12.69 16.53 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 120.644 -1.285 . . . . 0.0 110.215 179.909 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.477 ' OD1' ' O ' ' A' ' 23' ' ' ILE . 33.7 p-10 -78.64 67.3 4.36 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.87 -1.144 . . . . 0.0 109.446 179.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 69.1 mt -50.53 -51.91 17.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 O-C-N 121.191 -0.943 . . . . 0.0 110.993 -179.3 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.527 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -89.38 12.44 16.28 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 120.721 -1.237 . . . . 0.0 110.128 -179.454 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.451 ' OG ' ' O ' ' A' ' 29' ' ' SER . 6.9 t 41.71 51.78 4.0 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.355 -0.841 . . . . 0.0 110.774 178.661 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -95.28 1.66 54.56 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.987 -1.071 . . . . 0.0 108.395 179.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 74.22 -0.17 54.69 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 109.453 -1.459 . . . . 0.0 109.453 -179.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -143.84 162.46 15.68 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 O-C-N 121.289 -1.124 . . . . 0.0 108.905 178.666 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 73.0 mt -107.94 110.76 22.58 Favored 'General case' 0 N--CA 1.513 2.715 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 177.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -86.17 -178.33 6.48 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.481 -0.762 . . . . 0.0 110.127 -179.2 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -73.3 -43.06 61.6 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.292 -0.88 . . . . 0.0 111.468 -178.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.503 ' NE2' ' C ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -61.86 -24.57 67.0 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 120.36 -1.463 . . . . 0.0 108.589 -179.885 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 -86.51 -32.42 20.76 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.375 -0.828 . . . . 0.0 109.069 179.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.0 tp -72.38 -34.96 68.33 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.343 -0.848 . . . . 0.0 109.554 179.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -74.71 -51.18 14.97 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.315 -0.866 . . . . 0.0 110.73 -179.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.24 -32.99 74.8 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.924 -1.11 . . . . 0.0 110.713 -178.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 39.0 tp -74.1 -31.01 62.62 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.85 -1.156 . . . . 0.0 109.942 -179.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -84.01 -50.71 7.75 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 120.46 -1.4 . . . . 0.0 109.823 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 43.1 m . . . . . 0 N--CA 1.491 1.594 0 O-C-N 121.066 -1.022 . . . . 0.0 110.447 -179.155 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 25.0 mtm180 . . . . . 0 N--CA 1.494 1.768 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . 0.41 ' C ' ' CD1' ' A' ' 67' ' ' LEU . 0.7 OUTLIER -74.5 -27.62 60.63 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.276 -0.89 . . . . 0.0 110.075 -179.518 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.475 ' O ' ' NE ' ' A' ' 68' ' ' ARG . 8.7 tpm_? -65.71 -37.96 87.87 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.841 -1.162 . . . . 0.0 109.37 -179.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.6 mtt -84.16 -50.69 7.68 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.224 -0.922 . . . . 0.0 109.131 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.471 ' HG2' HH11 ' A' ' 70' ' ' ARG . 7.1 ttt-85 -52.14 -32.75 37.08 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.979 -1.076 . . . . 0.0 110.02 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 -86.42 -53.48 4.97 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 120.921 -1.112 . . . . 0.0 110.814 -178.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 11.2 t-80 -54.88 -34.6 63.17 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.911 -1.118 . . . . 0.0 110.006 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 54.6 t -74.52 -53.88 15.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 120.672 -1.267 . . . . 0.0 109.738 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.452 ' SD ' ' NH1' ' A' ' 70' ' ' ARG . 29.8 mtp -65.41 -15.67 62.84 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.065 -1.022 . . . . 0.0 110.225 -179.702 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 42.4 tttp -85.23 -37.98 19.46 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.453 -1.404 . . . . 0.0 110.526 -179.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . 0.693 HD21 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -105.18 -24.3 12.77 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.123 -0.985 . . . . 0.0 112.558 -178.027 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.693 ' H ' HD21 ' A' ' 76' ' ' ASN . 34.1 t -91.18 -36.75 8.39 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.422 0 O-C-N 120.235 -1.541 . . . . 0.0 110.032 -179.362 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -66.7 105.06 1.45 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.411 -1.431 . . . . 0.0 107.606 178.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -83.5 -53.49 5.65 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.327 -0.858 . . . . 0.0 111.587 -177.733 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.471 ' O ' ' N ' ' A' ' 82' ' ' ASP . 6.2 m120 -98.59 23.91 8.08 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.15 -0.968 . . . . 0.0 109.46 -179.345 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.429 ' C ' ' O ' ' A' ' 80' ' ' ASN . 1.3 mm100 31.37 35.07 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 178.786 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.561 ' C ' ' H ' ' A' ' 84' ' ' LEU . 81.3 m-20 -84.99 12.54 7.38 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 178.532 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.521 HH11 ' CG ' ' A' ' 83' ' ' ARG . 3.9 mtt-85 65.03 -4.13 0.53 Allowed 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 -178.485 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.561 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.6 mp -119.31 133.9 55.49 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 179.157 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 92.9 t -112.85 129.54 68.29 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 O-C-N 121.643 -0.66 . . . . 0.0 110.143 -178.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 25.6 p -102.02 174.8 5.77 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 178.161 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -75.07 -32.8 61.57 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.999 -1.063 . . . . 0.0 109.192 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -64.05 -66.51 0.53 Allowed 'General case' 0 C--N 1.294 -1.818 0 O-C-N 120.922 -1.111 . . . . 0.0 111.514 -178.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -59.27 -33.64 71.3 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.909 -1.12 . . . . 0.0 110.435 -177.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -66.29 -50.84 62.31 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 120.736 -1.228 . . . . 0.0 109.404 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.9 mp -46.74 -46.39 20.33 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.308 -0.87 . . . . 0.0 108.853 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -52.93 -58.31 7.37 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.221 -0.925 . . . . 0.0 110.277 -179.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 25.4 m -44.31 -27.47 0.43 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.239 -0.913 . . . . 0.0 109.952 -179.402 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 31.8 p . . . . . 0 N--CA 1.497 1.879 0 O-C-N 121.314 -0.866 . . . . 0.0 108.741 179.096 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 . . . . . 0 N--CA 1.494 1.761 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -62.96 -20.49 71.66 Favored 'Trans proline' 0 C--N 1.319 -1.001 0 C-N-CA 121.545 1.496 . . . . 0.0 110.269 -179.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -55.81 -36.64 67.66 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.312 -0.868 . . . . 0.0 111.135 -179.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 58.4 m -74.04 -43.27 58.46 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 120.679 -1.263 . . . . 0.0 110.562 -178.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.502 ' CE2' ' CD2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -54.85 -33.97 62.37 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 179.909 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -69.76 -34.52 73.9 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.422 -0.799 . . . . 0.0 109.816 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 97.4 mt -71.87 -60.68 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 O-C-N 120.832 -1.167 . . . . 0.0 108.907 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 tp -46.01 -37.93 7.2 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.313 -0.867 . . . . 0.0 111.048 -179.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.625 ' N ' ' HD1' ' A' ' 25' ' ' HIS . 0.3 OUTLIER -79.17 -15.11 58.57 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.433 -1.417 . . . . 0.0 110.082 -179.526 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -79.84 96.27 6.28 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.02 -1.05 . . . . 0.0 108.717 179.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.3 mt -74.55 -51.98 21.06 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 O-C-N 121.455 -0.778 . . . . 0.0 110.736 -178.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.533 HD21 ' N ' ' A' ' 28' ' ' ASN . 1.8 m120 -86.78 8.57 22.16 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.787 -1.195 . . . . 0.0 109.948 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.443 ' OG ' ' O ' ' A' ' 29' ' ' SER . 5.2 t 44.32 57.47 4.31 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.166 -0.959 . . . . 0.0 110.496 178.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -100.31 0.2 39.66 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.079 -1.013 . . . . 0.0 108.654 179.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.67 -2.51 67.71 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -144.31 160.22 15.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.052 -1.263 . . . . 0.0 108.621 178.052 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 17.6 mt -110.89 128.96 55.98 Favored 'General case' 0 N--CA 1.512 2.626 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.487 ' C ' ' H ' ' A' ' 36' ' ' GLN . 24.6 p-10 -105.12 166.83 10.12 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.504 -0.748 . . . . 0.0 109.643 -179.544 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -52.27 -6.34 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.578 -0.701 . . . . 0.0 110.79 -179.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.487 ' H ' ' C ' ' A' ' 34' ' ' ASP . 2.3 mm100 -85.77 -42.66 14.0 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.807 -1.183 . . . . 0.0 109.862 -179.819 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -80.71 -31.18 36.23 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.0 tp -76.37 -36.82 57.95 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.43 -0.794 . . . . 0.0 109.281 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -74.62 -51.35 14.73 Favored 'General case' 0 N--CA 1.484 1.275 0 O-C-N 120.935 -1.103 . . . . 0.0 109.429 179.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.21 -29.53 69.87 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.325 -0.859 . . . . 0.0 110.33 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 41.6 tp -76.71 -27.7 55.57 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.167 -0.958 . . . . 0.0 110.542 -178.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -82.88 -40.06 20.75 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 120.354 -1.466 . . . . 0.0 110.006 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 17.7 m . . . . . 0 N--CA 1.489 1.515 0 O-C-N 120.78 -1.2 . . . . 0.0 109.842 -179.55 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? . . . . . 0 N--CA 1.493 1.678 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 33.4 mt -82.93 -26.54 31.32 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.527 -0.733 . . . . 0.0 109.619 179.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.3 tmm_? -65.9 -39.0 90.21 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.9 -1.125 . . . . 0.0 109.735 -179.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.7 mtt -84.97 -50.37 7.54 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.192 -0.943 . . . . 0.0 109.553 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.509 ' NH1' ' SD ' ' A' ' 74' ' ' MET . 11.0 ttt-85 -54.21 -27.85 37.07 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.759 -1.213 . . . . 0.0 110.21 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -84.27 -51.78 6.74 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 120.801 -1.187 . . . . 0.0 110.75 -179.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -54.28 -38.67 66.12 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.088 -1.007 . . . . 0.0 110.823 -179.472 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 55.3 t -75.09 -54.49 14.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 O-C-N 120.343 -1.473 . . . . 0.0 110.117 -179.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.509 ' SD ' ' NH1' ' A' ' 70' ' ' ARG . 27.5 mtp -62.81 -14.11 41.56 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.227 -0.921 . . . . 0.0 110.291 -179.137 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 42.8 tttm -89.59 -39.45 13.25 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.641 -1.287 . . . . 0.0 110.842 -178.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . 0.66 HD21 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -103.61 -27.58 12.24 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.126 -0.984 . . . . 0.0 112.279 -178.053 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.66 ' H ' HD21 ' A' ' 76' ' ' ASN . 21.6 t -85.21 -29.29 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.233 0 O-C-N 120.144 -1.598 . . . . 0.0 109.118 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . 0.462 ' CG ' ' O ' ' A' ' 74' ' ' MET . 15.2 p-10 -63.28 106.17 0.85 Allowed 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.915 -1.115 . . . . 0.0 108.462 178.52 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' THR . . . . . 0.405 ' C ' HD21 ' A' ' 80' ' ' ASN . 0.0 OUTLIER -86.72 -53.49 4.91 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.107 -1.621 . . . . 0.0 110.73 -178.542 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.499 ' O ' ' N ' ' A' ' 82' ' ' ASP . 2.8 m120 -104.12 24.87 10.75 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.301 -0.874 . . . . 0.0 109.737 -179.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' GLN . . . . . 0.405 ' C ' ' H ' ' A' ' 83' ' ' ARG . 0.1 OUTLIER 34.31 30.14 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.862 0 O-C-N 122.041 -0.412 . . . . 0.0 111.932 178.362 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.566 ' C ' ' H ' ' A' ' 84' ' ' LEU . 18.5 p-10 -82.08 9.95 7.57 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.637 -1.29 . . . . 0.0 107.667 178.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.508 HH11 ' CG ' ' A' ' 83' ' ' ARG . 4.1 mtt-85 64.34 -4.31 0.43 Allowed 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 -178.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.566 ' H ' ' C ' ' A' ' 82' ' ' ASP . 6.6 mp -118.38 134.37 55.11 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 178.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 94.6 t -112.4 130.45 66.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.047 0 O-C-N 121.564 -0.71 . . . . 0.0 110.336 -178.359 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 16.9 p -105.93 166.41 10.5 Favored 'General case' 0 N--CA 1.499 1.999 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 178.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.9 tp -64.54 -36.63 84.84 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.273 -0.892 . . . . 0.0 109.344 179.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.503 ' H ' ' CD ' ' A' ' 88' ' ' GLU . 8.8 mp0 -61.49 -68.16 0.34 Allowed 'General case' 0 C--N 1.293 -1.874 0 O-C-N 120.751 -1.218 . . . . 0.0 111.806 -177.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLU . . . . . 0.416 ' OE1' ' OD1' ' A' ' 80' ' ' ASN . 1.0 OUTLIER -58.71 -33.66 70.44 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 120.738 -1.226 . . . . 0.0 110.479 -177.91 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -64.34 -51.39 63.6 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.865 -1.147 . . . . 0.0 108.821 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 2.7 mp -48.93 -42.71 38.13 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.99 -61.38 2.0 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.257 -0.902 . . . . 0.0 109.701 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 95.1 p -48.04 -33.05 7.42 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.282 -0.886 . . . . 0.0 110.302 -179.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.5 2.04 0 O-C-N 121.212 -0.93 . . . . 0.0 109.483 -179.879 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 14.2 mt . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -95.35 95.61 8.58 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.152 -0.968 . . . . 0.0 109.175 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.436 ' O ' ' O ' ' A' ' 4' ' ' VAL . 54.4 tt0 -62.26 -62.31 1.86 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.251 -0.905 . . . . 0.0 109.689 -179.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.436 ' O ' ' O ' ' A' ' 3' ' ' GLU . 4.2 t 59.78 148.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.513 -0.742 . . . . 0.0 109.585 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 53.6 m95 -74.44 104.88 5.34 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.101 -0.999 . . . . 0.0 109.544 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -61.74 167.39 3.64 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.266 -0.896 . . . . 0.0 109.358 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -164.63 90.57 0.55 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.24 -0.913 . . . . 0.0 109.579 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 17.9 mt -66.17 155.73 36.11 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.215 -0.928 . . . . 0.0 109.3 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.581 ' C ' ' H ' ' A' ' 11' ' ' LEU . 34.9 t70 -140.31 152.23 45.68 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.333 -0.854 . . . . 0.0 108.962 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.406 ' O ' ' CB ' ' A' ' 11' ' ' LEU . . . 64.37 -11.36 0.23 Allowed Glycine 0 N--CA 1.492 2.408 0 O-C-N 120.834 -1.166 . . . . 0.0 110.257 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.581 ' H ' ' C ' ' A' ' 9' ' ' ASP . 5.8 tp 76.66 101.44 0.07 Allowed 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 -178.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.559 ' C ' ' H ' ' A' ' 14' ' ' ASN . 8.7 p30 -46.31 150.13 1.2 Allowed Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.364 -0.835 . . . . 0.0 109.398 -179.139 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -65.01 14.07 0.09 OUTLIER 'Trans proline' 0 C--N 1.323 -0.783 0 C-N-CA 121.242 1.295 . . . . 0.0 110.116 179.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.559 ' H ' ' C ' ' A' ' 12' ' ' ASP . 27.0 t-20 -80.47 63.14 4.82 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.007 -1.058 . . . . 0.0 109.621 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.511 HH11 ' CG ' ' A' ' 15' ' ' ARG . 0.3 OUTLIER -46.96 169.55 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.3 -0.875 . . . . 0.0 109.705 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.412 ' O ' ' O ' ' A' ' 15' ' ' ARG . 35.0 m-85 -53.78 -173.78 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.262 -0.899 . . . . 0.0 109.568 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -156.66 66.97 4.24 Favored Pre-proline 0 N--CA 1.493 1.704 0 O-C-N 121.303 -0.873 . . . . 0.0 109.713 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -63.82 -18.69 65.0 Favored 'Trans proline' 0 C--N 1.319 -1.02 0 C-N-CA 121.519 1.479 . . . . 0.0 110.004 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -56.21 -39.61 72.75 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.331 -0.855 . . . . 0.0 111.176 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 71.9 m -70.91 -38.91 72.99 Favored 'General case' 0 C--N 1.308 -1.217 0 O-C-N 120.619 -1.301 . . . . 0.0 110.668 -178.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.426 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.04 -34.33 65.78 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 179.94 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.428 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 22.9 t80 -68.79 -35.17 76.7 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.396 -0.815 . . . . 0.0 109.665 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.405 ' O ' ' N ' ' A' ' 26' ' ' ASP . 97.9 mt -69.91 -60.4 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 O-C-N 120.796 -1.19 . . . . 0.0 108.974 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.7 tp -45.86 -38.6 7.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.286 -0.884 . . . . 0.0 110.709 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 25.4 m170 -78.9 -11.86 60.01 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.298 -1.501 . . . . 0.0 109.974 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.428 ' OD1' ' O ' ' A' ' 22' ' ' PHE . 55.1 m-20 -81.65 92.79 6.63 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.872 -1.142 . . . . 0.0 108.965 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 26.1 mt -75.74 -51.57 20.26 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.371 0 O-C-N 121.331 -0.856 . . . . 0.0 110.877 -178.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.528 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -87.94 12.88 12.1 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 120.876 -1.14 . . . . 0.0 110.105 -179.663 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.417 ' OG ' ' O ' ' A' ' 29' ' ' SER . 5.0 t 43.27 55.68 4.58 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.255 -0.903 . . . . 0.0 110.533 179.03 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.416 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 13.8 p30 -97.92 -6.23 32.7 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.117 -0.99 . . . . 0.0 108.511 179.318 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.85 -3.74 63.61 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 109.664 -1.375 . . . . 0.0 109.664 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -140.93 163.16 22.03 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 O-C-N 121.263 -1.14 . . . . 0.0 108.486 178.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 72.3 mt -120.47 121.53 38.68 Favored 'General case' 0 N--CA 1.515 2.819 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 178.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -103.89 179.51 4.25 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.108 -0.995 . . . . 0.0 110.18 -179.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.1 tm-20 -55.71 -14.55 2.31 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.61 -0.681 . . . . 0.0 111.232 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.538 ' NE2' ' O ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -82.68 -28.06 30.86 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.283 -1.511 . . . . 0.0 109.679 179.663 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.7 mm-40 -81.39 -37.32 28.37 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.743 -1.223 . . . . 0.0 109.411 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.536 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 2.3 mt -73.58 -32.01 63.9 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 120.992 -1.067 . . . . 0.0 108.539 178.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -59.94 -47.87 84.03 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 120.909 -1.119 . . . . 0.0 108.874 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.31 -28.92 62.35 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.267 -0.895 . . . . 0.0 110.897 -179.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -72.22 -25.77 61.77 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 120.923 -1.111 . . . . 0.0 110.227 -178.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.536 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 38.1 m-85 -81.5 -51.38 8.34 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.538 -1.351 . . . . 0.0 109.275 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 64.3 m -59.8 -33.32 71.57 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.147 -0.97 . . . . 0.0 110.32 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.3 ttmt -73.9 -36.85 64.78 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.236 -0.915 . . . . 0.0 110.592 -179.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -56.15 -34.5 66.21 Favored 'General case' 0 C--N 1.298 -1.658 0 O-C-N 120.487 -1.383 . . . . 0.0 108.023 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 12.6 mt -67.62 -24.11 65.43 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 119.38 -0.928 . . . . 0.0 108.966 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -70.9 -29.96 66.17 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.276 -0.89 . . . . 0.0 109.273 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.8 mttt -91.25 13.78 16.22 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.247 -0.908 . . . . 0.0 110.233 -179.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 38.6 t -147.51 -58.53 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.893 0 O-C-N 120.97 -1.081 . . . . 0.0 109.544 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.404 ' HB3' ' H ' ' A' ' 51' ' ' ASP . 14.6 m-85 -72.57 -151.32 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.21 -0.931 . . . . 0.0 108.571 179.734 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.404 ' H ' ' HB3' ' A' ' 50' ' ' TYR . 9.2 t70 -173.42 72.28 0.38 Allowed Pre-proline 0 N--CA 1.5 2.036 0 O-C-N 120.735 -1.228 . . . . 0.0 108.77 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -65.69 174.34 5.62 Favored 'Trans proline' 0 C--N 1.318 -1.035 0 C-N-CA 121.71 1.607 . . . . 0.0 110.468 -179.004 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.629 ' CG ' ' H ' ' A' ' 54' ' ' ASN . 0.0 OUTLIER -165.85 -90.66 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 179.57 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.654 HD21 ' N ' ' A' ' 54' ' ' ASN . 0.0 OUTLIER -147.87 34.09 0.84 Allowed 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.511 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.476 ' CD ' ' H ' ' A' ' 56' ' ' GLU . 12.8 tp10 -115.35 161.56 18.34 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 -179.617 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.476 ' H ' ' CD ' ' A' ' 55' ' ' GLU . 14.2 mp0 -133.45 87.46 2.39 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.322 -0.861 . . . . 0.0 109.07 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -171.32 -67.71 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.268 -0.895 . . . . 0.0 109.935 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 38.7 m-20 -56.95 -20.66 24.83 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.215 -0.928 . . . . 0.0 110.122 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 78.2 mmm -97.18 44.03 1.06 Allowed 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.274 -0.891 . . . . 0.0 109.403 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -143.2 -55.3 0.4 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.336 -0.853 . . . . 0.0 109.183 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -59.37 -41.12 88.59 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.984 -1.073 . . . . 0.0 109.588 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.557 ' O ' ' N ' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -70.71 -14.18 62.35 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.214 -0.929 . . . . 0.0 110.32 -179.548 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.416 ' C ' ' O ' ' A' ' 62' ' ' MET . 12.9 pt-20 -37.89 -24.75 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.794 -0.566 . . . . 0.0 110.543 -179.28 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.557 ' N ' ' O ' ' A' ' 62' ' ' MET . 25.4 mm-40 -57.78 -24.08 55.43 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.24 -0.913 . . . . 0.0 109.609 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -76.0 -46.1 31.26 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.248 -0.907 . . . . 0.0 110.013 -179.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 36.1 mtm180 -53.74 -47.48 70.59 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.127 -0.983 . . . . 0.0 109.038 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 24.6 mt -67.29 -28.21 67.82 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.124 -0.985 . . . . 0.0 109.691 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.478 ' CG ' HH11 ' A' ' 68' ' ' ARG . 0.0 OUTLIER -63.23 -37.69 88.22 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.189 -0.944 . . . . 0.0 109.552 -179.649 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 7.2 mtt -84.67 -49.72 8.27 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.194 -0.941 . . . . 0.0 109.569 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -52.35 -32.19 37.13 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.857 -1.152 . . . . 0.0 110.427 -179.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -84.13 -52.35 6.35 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.086 -1.008 . . . . 0.0 111.004 -178.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 16.3 t60 -55.33 -41.77 72.9 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.003 -1.061 . . . . 0.0 110.179 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 71.3 t -70.53 -50.48 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 120.69 -1.256 . . . . 0.0 109.203 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.435 ' O ' ' OD1' ' A' ' 78' ' ' ASP . 6.3 mmt -63.63 -19.87 65.23 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.21 -0.931 . . . . 0.0 110.23 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -99.33 -38.65 8.76 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 120.791 -1.193 . . . . 0.0 111.004 -178.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . 0.672 ' N ' HD21 ' A' ' 76' ' ' ASN . 0.7 OUTLIER -93.47 -11.75 31.33 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 120.784 -1.198 . . . . 0.0 111.985 -178.264 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 98.1 t -114.64 -33.18 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.495 0 CA-C-N 120.3 1.409 . . . . 0.0 110.313 179.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.435 ' OD1' ' O ' ' A' ' 74' ' ' MET . 10.4 p-10 -51.33 109.65 0.36 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.598 -1.313 . . . . 0.0 108.821 179.058 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.78 -61.93 1.61 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 120.842 -1.161 . . . . 0.0 110.032 -178.13 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.719 ' H ' HD21 ' A' ' 80' ' ' ASN . 0.1 OUTLIER -102.96 18.19 22.22 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.289 -0.882 . . . . 0.0 109.786 -179.703 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.434 ' OE1' ' OD2' ' A' ' 78' ' ' ASP . 0.2 OUTLIER 42.58 75.4 0.09 Allowed 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.485 -0.759 . . . . 0.0 111.112 178.091 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.582 ' C ' ' H ' ' A' ' 84' ' ' LEU . 28.3 t70 -131.24 16.38 5.03 Favored 'General case' 0 N--CA 1.499 1.978 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.368 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 35.1 mtm180 60.82 -3.67 0.15 Allowed 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 -178.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.582 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.0 mp -124.59 134.57 52.9 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 78.4 t -111.58 125.87 68.93 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.985 0 O-C-N 121.654 -0.654 . . . . 0.0 109.666 -178.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 62.2 p -96.88 163.35 13.01 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.188 -0.945 . . . . 0.0 108.98 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.0 tp -66.3 -36.68 83.57 Favored 'General case' 0 N--CA 1.492 1.665 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 74.8 mt-10 -60.27 -68.69 0.27 Allowed 'General case' 0 C--N 1.295 -1.779 0 O-C-N 121.62 -0.675 . . . . 0.0 110.915 -178.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -59.74 -30.24 68.7 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.236 -0.915 . . . . 0.0 110.547 -178.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -64.82 -50.93 64.78 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.936 -1.103 . . . . 0.0 109.663 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.473 ' O ' ' N ' ' A' ' 95' ' ' GLN . 68.1 mt -49.97 -43.32 50.2 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.156 -0.965 . . . . 0.0 108.998 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -51.78 -60.95 2.59 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.222 -0.923 . . . . 0.0 110.033 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 98.8 p -45.12 -26.32 0.45 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.193 -0.942 . . . . 0.0 110.089 -179.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.438 ' OG1' ' N ' ' A' ' 95' ' ' GLN . 23.3 p -100.64 -63.36 1.14 Allowed 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.328 -0.858 . . . . 0.0 109.468 179.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.478 ' O ' ' N ' ' A' ' 97' ' ' LYS . 25.5 mt-30 -42.39 -50.77 5.08 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.457 -0.777 . . . . 0.0 110.672 -179.625 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 18.6 mmt180 -59.49 85.03 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.878 -1.139 . . . . 0.0 109.439 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.478 ' N ' ' O ' ' A' ' 95' ' ' GLN . 87.3 tttt -48.92 -52.04 26.82 Favored 'General case' 0 C--N 1.305 -1.355 0 O-C-N 121.266 -0.896 . . . . 0.0 109.713 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.489 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 17.2 mp0 -60.65 87.02 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.345 -0.847 . . . . 0.0 109.548 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.403 ' N ' ' O ' ' A' ' 97' ' ' LYS . 79.3 t80 . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 117.963 -1.018 . . . . 0.0 109.37 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 51.6 tp . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.466 ' CD ' ' N ' ' A' ' 2' ' ' LYS . 3.6 mptp? -79.9 172.09 14.24 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.271 -0.893 . . . . 0.0 109.268 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.417 ' O ' ' O ' ' A' ' 2' ' ' LYS . 34.9 tt0 52.88 98.75 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.312 -0.867 . . . . 0.0 109.47 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 12.0 p -73.46 141.45 16.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.328 -0.858 . . . . 0.0 109.385 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 5.2 m0 -63.98 -39.01 93.16 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.22 -0.925 . . . . 0.0 109.691 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -140.2 -75.7 0.34 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.269 -0.894 . . . . 0.0 109.373 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -167.84 -38.57 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.146 -0.971 . . . . 0.0 109.645 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.479 ' C ' ' H ' ' A' ' 10' ' ' GLY . 8.8 mp -117.67 111.48 19.21 Favored 'General case' 0 N--CA 1.506 2.34 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.056 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 63.0 t0 -76.3 31.93 0.12 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.388 -0.82 . . . . 0.0 109.444 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.479 ' H ' ' C ' ' A' ' 8' ' ' LEU . . . 66.5 60.41 6.28 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.469 -1.452 . . . . 0.0 109.469 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 19.7 mt -61.69 -56.94 14.3 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.261 -1.14 . . . . 0.0 109.454 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.488 ' C ' ' H ' ' A' ' 14' ' ' ASN . 21.0 p30 -151.71 68.86 7.74 Favored Pre-proline 0 N--CA 1.494 1.749 0 O-C-N 121.246 -0.909 . . . . 0.0 109.339 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.52 ' O ' ' CE2' ' A' ' 16' ' ' PHE . 3.4 Cg_exo -61.97 0.4 1.25 Allowed 'Trans proline' 0 C--N 1.318 -1.051 0 C-N-CA 121.45 1.433 . . . . 0.0 109.795 -179.61 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.488 ' H ' ' C ' ' A' ' 12' ' ' ASP . 1.9 m-20 -64.69 64.01 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.461 -0.774 . . . . 0.0 109.809 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.517 ' N ' ' O ' ' A' ' 13' ' ' PRO . 67.2 ttt180 -172.5 121.48 0.42 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.336 -0.853 . . . . 0.0 109.047 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.52 ' CE2' ' O ' ' A' ' 13' ' ' PRO . 66.5 m-85 -158.01 -164.4 1.51 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.087 -1.008 . . . . 0.0 109.849 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -115.81 91.61 31.2 Favored Pre-proline 0 N--CA 1.498 1.93 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -57.7 -14.73 18.31 Favored 'Trans proline' 0 C--N 1.323 -0.806 0 C-N-CA 121.034 1.156 . . . . 0.0 110.266 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -55.9 -33.61 64.8 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.373 -0.829 . . . . 0.0 110.493 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 53.0 m -74.4 -41.81 60.28 Favored 'General case' 0 C--N 1.307 -1.268 0 O-C-N 120.89 -1.131 . . . . 0.0 110.385 -178.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.617 ' CE2' ' NE2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -55.86 -34.45 65.48 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -69.61 -36.05 75.83 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.392 -0.818 . . . . 0.0 109.791 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.471 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.7 mt -70.7 -60.48 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.232 0 O-C-N 120.711 -1.243 . . . . 0.0 109.056 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.9 tp -45.37 -36.67 4.37 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.245 -0.91 . . . . 0.0 110.692 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.617 ' NE2' ' CE2' ' A' ' 21' ' ' PHE . 0.4 OUTLIER -77.33 -15.67 59.29 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.4 -1.437 . . . . 0.0 109.451 179.787 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.471 ' N ' ' O ' ' A' ' 23' ' ' ILE . 68.6 m-20 -78.8 87.58 4.67 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.119 -0.988 . . . . 0.0 108.92 179.243 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 19.9 mt -71.4 -52.43 26.59 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 O-C-N 121.277 -0.89 . . . . 0.0 110.806 -178.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.667 HD21 ' N ' ' A' ' 28' ' ' ASN . 0.9 OUTLIER -86.38 11.6 12.0 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.826 -1.171 . . . . 0.0 109.84 -179.787 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 27.6 p 44.42 56.31 5.09 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.201 -0.937 . . . . 0.0 110.245 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.407 ' OD1' ' O ' ' A' ' 32' ' ' VAL . 41.8 p-10 -98.07 -5.94 32.78 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.236 -0.915 . . . . 0.0 108.603 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 79.97 -1.7 78.27 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.914 -1.274 . . . . 0.0 109.914 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.407 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 0.9 OUTLIER -143.59 163.55 15.71 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 121.072 -1.252 . . . . 0.0 108.545 178.412 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 39.7 mt -113.22 125.63 54.53 Favored 'General case' 0 N--CA 1.514 2.734 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 178.292 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.426 ' OD1' ' OE2' ' A' ' 37' ' ' GLU . 42.6 p-10 -103.69 173.85 6.12 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.316 -0.865 . . . . 0.0 109.73 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 61.2 mt-10 -55.8 -8.86 0.46 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.547 -0.72 . . . . 0.0 110.157 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.403 ' H ' ' C ' ' A' ' 34' ' ' ASP . 2.3 mm100 -83.35 -43.24 16.16 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.86 -1.15 . . . . 0.0 108.786 179.033 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.53 ' OE1' ' N ' ' A' ' 37' ' ' GLU . 0.3 OUTLIER -70.54 -29.26 65.68 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 179.34 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.407 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 10.2 mp -83.1 -39.43 21.13 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.234 -0.916 . . . . 0.0 108.936 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -64.07 -49.58 71.76 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.788 -1.195 . . . . 0.0 108.728 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.97 -28.4 67.42 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.418 -0.801 . . . . 0.0 110.559 -179.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 32.5 tp -76.26 -28.52 57.12 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.991 -1.068 . . . . 0.0 110.88 -178.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.407 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 29.6 m-85 -74.46 -49.03 23.9 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 120.058 -1.651 . . . . 0.0 108.442 179.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 59.4 m -58.0 -35.58 71.42 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.288 -0.883 . . . . 0.0 110.246 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 24.9 ttmt -74.98 -45.45 41.98 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.274 -0.891 . . . . 0.0 111.814 -178.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -53.26 -27.79 24.29 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.144 -1.598 . . . . 0.0 108.564 -179.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.4 mt -83.33 -26.95 30.09 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.211 -0.931 . . . . 0.0 109.879 179.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -53.99 -37.58 64.15 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.087 -1.008 . . . . 0.0 109.698 -179.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.7 pttp -84.55 22.21 1.34 Allowed 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.058 -1.026 . . . . 0.0 110.293 -179.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 20.3 t -133.36 -57.84 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 O-C-N 121.278 -0.889 . . . . 0.0 109.534 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -102.38 -159.86 0.75 Allowed 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.255 -0.903 . . . . 0.0 109.191 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -142.01 70.92 23.67 Favored Pre-proline 0 N--CA 1.497 1.895 0 O-C-N 121.15 -0.969 . . . . 0.0 109.24 -179.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -61.93 174.42 2.42 Favored 'Trans proline' 0 C--N 1.317 -1.121 0 C-N-CA 121.456 1.438 . . . . 0.0 110.065 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 13.0 mmtp -111.21 42.74 1.59 Allowed 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 4.9 m120 55.87 19.25 3.43 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.301 -0.875 . . . . 0.0 109.427 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -147.56 130.78 16.47 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.306 -0.871 . . . . 0.0 109.396 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.491 ' C ' ' H ' ' A' ' 58' ' ' ASP . 64.2 mt-10 -68.2 -19.33 64.75 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.227 -0.92 . . . . 0.0 109.493 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 34.1 p30 -67.36 43.73 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.255 -0.903 . . . . 0.0 109.699 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.491 ' H ' ' C ' ' A' ' 56' ' ' GLU . 16.2 t70 -171.4 -12.14 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.144 -0.972 . . . . 0.0 109.805 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 60.0 mmm -85.0 -7.85 58.97 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.958 -1.089 . . . . 0.0 109.614 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 57.9 mtp180 -60.29 104.52 0.33 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.092 -1.005 . . . . 0.0 109.256 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -174.15 -71.74 0.01 OUTLIER 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.552 ' O ' ' N ' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -93.39 17.79 10.79 Favored 'General case' 0 N--CA 1.492 1.668 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 178.474 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -41.05 -20.36 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.826 0 CA-C-O 121.441 0.639 . . . . 0.0 109.711 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.552 ' N ' ' O ' ' A' ' 62' ' ' MET . 52.7 mt-10 -54.88 -38.64 67.8 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.36 -0.838 . . . . 0.0 109.466 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.52 ' OE2' ' NE ' ' A' ' 68' ' ' ARG . 38.1 tp10 -72.46 -34.92 68.09 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.247 -0.908 . . . . 0.0 109.282 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.505 ' CG ' HH11 ' A' ' 66' ' ' ARG . 0.2 OUTLIER -50.85 -48.64 59.98 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.542 -0.724 . . . . 0.0 109.711 -179.893 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.417 ' CD1' ' C ' ' A' ' 67' ' ' LEU . 0.6 OUTLIER -73.58 -27.36 61.27 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.348 -0.845 . . . . 0.0 109.722 -179.525 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.52 ' NE ' ' OE2' ' A' ' 65' ' ' GLU . 6.8 tmm_? -59.9 -39.88 86.9 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.06 -1.025 . . . . 0.0 109.387 -179.596 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 10.6 mtt -86.09 -50.1 7.28 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.011 -1.055 . . . . 0.0 109.297 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 62.4 ttt180 -54.65 -46.79 74.05 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.976 -1.078 . . . . 0.0 110.761 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -74.34 -53.0 10.55 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.95 -1.094 . . . . 0.0 111.303 -178.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -54.4 -41.15 68.93 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.954 -1.091 . . . . 0.0 110.248 -179.196 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 71.9 t -73.13 -53.45 18.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 120.765 -1.209 . . . . 0.0 109.581 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.428 ' O ' ' CG ' ' A' ' 78' ' ' ASP . 28.7 mtp -64.35 -17.42 63.7 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.121 -0.987 . . . . 0.0 109.916 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 26.2 ttpt -95.73 -37.31 10.83 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 120.783 -1.198 . . . . 0.0 110.385 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . 0.677 ' N ' HD21 ' A' ' 76' ' ' ASN . 0.7 OUTLIER -98.01 -10.49 24.33 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.018 -1.051 . . . . 0.0 112.065 -178.458 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 95.1 t -114.93 -32.93 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.595 0 O-C-N 120.407 -1.433 . . . . 0.0 110.337 179.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.501 ' C ' ' NE2' ' A' ' 81' ' ' GLN . 19.0 p-10 -49.28 111.99 0.57 Allowed 'General case' 0 N--CA 1.498 1.929 0 O-C-N 120.642 -1.286 . . . . 0.0 108.645 178.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -90.06 -68.77 0.76 Allowed 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.145 -0.972 . . . . 0.0 110.645 -177.53 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.509 ' O ' ' N ' ' A' ' 82' ' ' ASP . 7.0 m120 -97.27 25.61 5.43 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.02 -1.05 . . . . 0.0 108.34 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.799 ' NE2' ' H ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER 35.19 29.12 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.087 178.106 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.513 ' C ' ' H ' ' A' ' 84' ' ' LEU . 59.7 t0 -82.81 14.59 3.13 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 178.196 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.509 HH11 ' CG ' ' A' ' 83' ' ' ARG . 4.1 mtt-85 61.87 3.69 0.97 Allowed 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -178.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.513 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.7 mp -125.2 134.24 52.44 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 71.6 t -111.69 130.5 65.16 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 O-C-N 121.618 -0.676 . . . . 0.0 109.55 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 60.1 p -103.59 165.16 11.2 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.325 -0.859 . . . . 0.0 108.859 179.057 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.8 tp -66.37 -36.05 81.88 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.246 -0.909 . . . . 0.0 108.624 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -58.05 -69.32 0.18 Allowed 'General case' 0 C--N 1.295 -1.787 0 O-C-N 121.292 -0.88 . . . . 0.0 111.123 -178.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -62.73 -30.94 71.8 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.196 -0.94 . . . . 0.0 110.903 -178.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -60.8 -51.04 71.02 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.789 -1.195 . . . . 0.0 109.39 -179.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -51.16 -48.64 61.83 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 179.124 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -44.33 -49.3 9.56 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.441 -0.787 . . . . 0.0 110.465 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 46.6 m -60.43 -29.91 69.3 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.065 -1.022 . . . . 0.0 110.558 -178.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.405 ' O ' ' C ' ' A' ' 95' ' ' GLN . 30.3 p -98.68 -3.13 36.67 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.112 -0.992 . . . . 0.0 110.308 -179.506 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.405 ' C ' ' O ' ' A' ' 94' ' ' THR . 2.7 tt0 -42.42 -48.08 5.1 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.181 -0.95 . . . . 0.0 110.749 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.538 ' O ' ' N ' ' A' ' 98' ' ' GLU . 16.2 tpt180 -141.04 -28.92 0.67 Allowed 'General case' 0 N--CA 1.497 1.877 0 O-C-N 120.923 -1.111 . . . . 0.0 109.778 -179.657 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 56.9 tttm -52.41 86.42 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.308 0 O-C-N 121.189 -0.944 . . . . 0.0 110.109 -179.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.538 ' N ' ' O ' ' A' ' 96' ' ' ARG . 1.5 pp20? -167.19 129.27 1.66 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.154 -0.966 . . . . 0.0 109.438 179.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.475 ' OXT' ' CD2' ' A' ' 99' ' ' PHE . 58.2 t80 . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 117.958 -1.02 . . . . 0.0 109.457 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.526 ' CD2' ' N ' ' A' ' 1' ' ' LEU . 3.5 mm? . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -61.63 107.47 0.81 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.22 -0.925 . . . . 0.0 109.508 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -169.67 162.87 9.93 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.265 -0.897 . . . . 0.0 109.43 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.0 m -149.79 135.09 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.251 -0.906 . . . . 0.0 109.444 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.443 ' CZ3' ' O ' ' A' ' 6' ' ' GLU . 5.8 p-90 -80.8 12.2 3.38 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.317 -0.864 . . . . 0.0 109.454 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.443 ' O ' ' CZ3' ' A' ' 5' ' ' TRP . 25.7 tp10 49.52 -102.37 0.1 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.285 -0.885 . . . . 0.0 109.436 179.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -165.43 -31.46 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.022 -1.048 . . . . 0.0 109.595 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.5 pp -165.08 137.04 4.27 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.215 -0.928 . . . . 0.0 109.536 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -99.4 24.99 7.4 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.321 -0.862 . . . . 0.0 109.53 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -83.01 8.75 62.26 Favored Glycine 0 N--CA 1.494 2.516 0 N-CA-C 109.345 -1.502 . . . . 0.0 109.345 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.52 ' CD2' ' N ' ' A' ' 11' ' ' LEU . 3.3 mm? 56.28 32.04 19.66 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.727 -0.866 . . . . 0.0 110.121 -179.293 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.527 ' C ' ' H ' ' A' ' 14' ' ' ASN . 6.3 m-20 43.36 76.94 0.48 Allowed Pre-proline 0 N--CA 1.503 2.224 0 O-C-N 121.112 -0.993 . . . . 0.0 110.601 178.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_endo -70.2 9.57 0.65 Allowed 'Trans proline' 0 C--N 1.319 -0.998 0 C-N-CA 121.528 1.485 . . . . 0.0 108.895 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.527 ' H ' ' C ' ' A' ' 12' ' ' ASP . 17.3 m120 -98.21 93.22 6.12 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.532 ' NE ' ' O ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -44.14 -18.19 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 179.921 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.524 ' N ' ' O ' ' A' ' 14' ' ' ASN . 6.9 t80 78.39 60.43 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.638 -0.664 . . . . 0.0 110.272 179.442 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 24.5 m120 47.53 83.78 0.21 Allowed Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.182 -0.949 . . . . 0.0 110.035 178.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -59.23 -11.67 13.85 Favored 'Trans proline' 0 C--N 1.32 -0.926 0 C-N-CA 121.272 1.314 . . . . 0.0 110.252 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.1 ttpm? -57.3 -40.92 78.87 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.285 -0.885 . . . . 0.0 110.718 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 48.6 m -66.33 -39.71 89.42 Favored 'General case' 0 C--N 1.307 -1.261 0 O-C-N 120.863 -1.148 . . . . 0.0 110.248 -178.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -55.96 -34.7 65.95 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -68.77 -35.34 76.95 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.317 -0.864 . . . . 0.0 109.741 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.403 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.6 mt -72.58 -61.56 1.65 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 O-C-N 120.764 -1.21 . . . . 0.0 108.865 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.7 tp -46.38 -35.83 5.85 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.198 -0.939 . . . . 0.0 110.765 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.521 ' O ' ' ND1' ' A' ' 25' ' ' HIS . 0.9 OUTLIER -78.88 -14.57 59.16 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.46 -1.4 . . . . 0.0 109.691 -179.971 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.403 ' N ' ' O ' ' A' ' 23' ' ' ILE . 94.5 m-20 -78.97 92.9 5.0 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.98 -1.075 . . . . 0.0 108.875 179.108 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 23.1 mt -75.09 -52.28 19.24 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.322 0 O-C-N 121.235 -0.916 . . . . 0.0 110.724 -178.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.486 HD21 ' N ' ' A' ' 28' ' ' ASN . 2.2 m120 -87.42 12.69 11.54 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 120.848 -1.158 . . . . 0.0 110.086 -179.51 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.4 m 43.94 55.92 4.98 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.204 -0.935 . . . . 0.0 110.611 178.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.418 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 12.0 t70 -98.19 -3.09 38.32 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.106 -0.996 . . . . 0.0 108.66 179.357 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 75.65 0.62 63.9 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -179.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -143.41 164.53 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.235 -1.156 . . . . 0.0 108.683 178.555 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 66.0 mt -114.63 128.98 56.61 Favored 'General case' 0 N--CA 1.516 2.866 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 178.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.414 ' C ' ' H ' ' A' ' 36' ' ' GLN . 40.4 p-10 -107.96 163.88 12.75 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.297 -0.877 . . . . 0.0 109.843 -179.423 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.417 ' OE2' ' O ' ' A' ' 35' ' ' GLU . 0.4 OUTLIER -51.67 -11.36 0.14 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.51 -0.744 . . . . 0.0 110.379 -179.612 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.414 ' H ' ' C ' ' A' ' 34' ' ' ASP . 2.2 mm100 -82.57 -36.59 26.09 Favored 'General case' 0 C--N 1.297 -1.704 0 O-C-N 120.801 -1.187 . . . . 0.0 109.559 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -72.86 -33.6 66.21 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.086 -1.009 . . . . 0.0 109.234 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.4 mt -82.22 -36.27 27.39 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.16 -0.962 . . . . 0.0 109.249 178.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -60.83 -41.86 96.61 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 120.758 -1.213 . . . . 0.0 108.944 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.81 -29.56 62.23 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.248 -0.908 . . . . 0.0 110.515 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -76.66 -24.96 53.27 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.026 -1.046 . . . . 0.0 110.18 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -78.91 -49.88 12.1 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.592 -1.318 . . . . 0.0 108.934 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 34.5 m -63.37 -40.73 98.06 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.217 -0.927 . . . . 0.0 110.371 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 27.3 ttpt -73.84 -47.5 38.03 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.175 -0.953 . . . . 0.0 111.213 -178.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -54.24 -27.73 36.73 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.764 -1.21 . . . . 0.0 110.073 -178.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 28.0 mt -77.18 -25.38 51.8 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.981 -1.075 . . . . 0.0 110.702 -179.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.421 ' OE2' ' O ' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -67.52 0.91 2.66 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.688 -1.257 . . . . 0.0 109.866 -179.19 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -108.36 24.01 13.65 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.215 -0.928 . . . . 0.0 109.616 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 41.8 t -148.06 -57.16 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 O-C-N 121.094 -1.004 . . . . 0.0 109.75 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.589 ' CZ ' ' SD ' ' A' ' 62' ' ' MET . 78.6 m-85 -81.12 -163.44 0.6 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.14 -0.975 . . . . 0.0 109.835 -179.594 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -152.16 80.1 6.02 Favored Pre-proline 0 N--CA 1.495 1.779 0 O-C-N 121.285 -0.885 . . . . 0.0 109.35 -179.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -57.22 179.17 0.13 Allowed 'Trans proline' 0 C--N 1.319 -0.978 0 C-N-CA 121.372 1.382 . . . . 0.0 110.112 -179.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 85.6 mttt 55.24 72.62 0.47 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.443 -0.786 . . . . 0.0 109.243 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.657 HD21 ' N ' ' A' ' 54' ' ' ASN . 0.0 OUTLIER -172.88 -36.83 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.461 -0.774 . . . . 0.0 110.124 -179.867 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.537 ' C ' ' H ' ' A' ' 57' ' ' ASP . 69.9 mm-40 -136.02 135.03 39.12 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.487 -0.758 . . . . 0.0 109.772 -179.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -58.72 -4.0 0.38 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.284 -0.885 . . . . 0.0 109.127 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.537 ' H ' ' C ' ' A' ' 55' ' ' GLU . 37.6 t0 -143.07 85.21 1.86 Allowed 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.537 ' C ' ' H ' ' A' ' 60' ' ' ARG . 26.6 t0 -125.51 158.14 35.27 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.599 -0.688 . . . . 0.0 109.734 -179.403 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 37.6 mtp 61.83 -3.02 0.25 Allowed 'General case' 0 N--CA 1.488 1.444 0 CA-C-O 121.18 0.514 . . . . 0.0 109.718 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.537 ' H ' ' C ' ' A' ' 58' ' ' ASP . 66.2 ttt180 -80.85 -60.24 2.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.986 -1.071 . . . . 0.0 109.054 179.415 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -48.38 -9.26 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.215 -0.928 . . . . 0.0 110.418 -179.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.589 ' SD ' ' CZ ' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -124.31 -2.29 8.06 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.255 -0.903 . . . . 0.0 109.87 -179.929 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.404 ' C ' ' O ' ' A' ' 62' ' ' MET . 4.2 mt-10 -40.64 -20.83 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.179 0 CA-C-O 121.368 0.604 . . . . 0.0 109.57 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.564 ' N ' ' O ' ' A' ' 62' ' ' MET . 51.5 mt-10 -65.27 -23.3 67.01 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.224 -0.923 . . . . 0.0 109.775 179.383 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -69.85 -43.05 72.72 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.264 -0.898 . . . . 0.0 109.944 -179.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 8.2 mtm180 -56.38 -46.48 80.08 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.137 -0.977 . . . . 0.0 109.38 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 54.2 mt -67.33 -28.13 67.72 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.229 -0.92 . . . . 0.0 110.148 -179.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 6.3 mmm180 -64.3 -42.64 96.27 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.905 -1.122 . . . . 0.0 109.758 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 4.6 mtt -84.29 -50.1 8.15 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.015 -1.053 . . . . 0.0 109.698 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -55.37 -38.06 68.36 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.064 -1.023 . . . . 0.0 110.846 -179.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -82.16 -51.84 7.57 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 120.75 -1.219 . . . . 0.0 110.764 -179.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.414 ' O ' ' ND2' ' A' ' 76' ' ' ASN . 43.8 t-80 -53.86 -37.28 63.51 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.021 -1.049 . . . . 0.0 110.099 -179.473 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 79.4 t -75.07 -54.0 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 120.703 -1.248 . . . . 0.0 109.677 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.44 ' O ' ' CG ' ' A' ' 78' ' ' ASP . 18.9 mtp -65.92 -13.66 60.11 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.221 -0.924 . . . . 0.0 110.302 -179.44 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -89.37 -38.93 13.77 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.357 -1.464 . . . . 0.0 110.713 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . 0.697 HD21 ' H ' ' A' ' 77' ' ' VAL . 0.0 OUTLIER -102.66 -22.53 13.95 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.106 -0.996 . . . . 0.0 112.285 -178.187 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.697 ' H ' HD21 ' A' ' 76' ' ' ASN . 42.1 t -94.69 -34.65 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 O-C-N 120.308 -1.495 . . . . 0.0 109.485 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.44 ' CG ' ' O ' ' A' ' 74' ' ' MET . 17.9 p-10 -48.64 101.7 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.864 -1.148 . . . . 0.0 109.158 178.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -76.19 -65.47 0.92 Allowed 'General case' 0 C--N 1.295 -1.781 0 O-C-N 120.975 -1.078 . . . . 0.0 110.703 -178.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.465 ' O ' ' N ' ' A' ' 82' ' ' ASP . 7.5 t-20 -105.51 25.73 10.36 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 121.185 -0.947 . . . . 0.0 109.357 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.425 ' C ' ' H ' ' A' ' 83' ' ' ARG . 0.1 OUTLIER 37.88 29.01 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 121.17 0.51 . . . . 0.0 111.092 178.929 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.559 ' C ' ' H ' ' A' ' 84' ' ' LEU . 17.3 p-10 -84.02 12.91 5.57 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 178.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.425 ' H ' ' C ' ' A' ' 81' ' ' GLN . 15.6 mmt180 65.09 -3.22 0.63 Allowed 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 -178.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.559 ' H ' ' C ' ' A' ' 82' ' ' ASP . 6.5 mp -122.03 134.59 54.79 Favored 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 107.289 -1.374 . . . . 0.0 107.289 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 74.5 t -113.69 131.67 64.85 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.109 0 O-C-N 121.643 -0.661 . . . . 0.0 109.691 -178.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 64.6 p -99.61 166.12 11.29 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.043 -1.035 . . . . 0.0 109.543 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.9 tp -67.3 -36.78 82.21 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 179.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.498 ' H ' ' CD ' ' A' ' 88' ' ' GLU . 13.7 mp0 -56.64 -67.62 0.29 Allowed 'General case' 0 C--N 1.294 -1.835 0 O-C-N 121.434 -0.791 . . . . 0.0 110.642 -178.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -62.84 -38.0 89.06 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.268 -0.895 . . . . 0.0 111.347 -178.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -57.06 -50.94 71.2 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.476 -1.39 . . . . 0.0 109.572 -178.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 80.4 mt -50.11 -47.74 53.78 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.102 -0.999 . . . . 0.0 109.008 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -51.06 -59.61 3.99 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.394 -0.817 . . . . 0.0 109.945 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 46.3 t -45.35 -25.93 0.46 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.138 -0.976 . . . . 0.0 110.428 -179.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.431 ' C ' ' H ' ' A' ' 96' ' ' ARG . 43.6 p -97.82 -2.94 39.85 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.133 -0.979 . . . . 0.0 109.866 -179.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -73.64 52.04 0.38 Allowed 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 107.888 -1.152 . . . . 0.0 107.888 178.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.501 ' C ' ' H ' ' A' ' 98' ' ' GLU . 3.9 tpt180 176.55 -35.09 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.965 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 179.129 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 3.0 tppt? -59.93 -1.71 0.32 Allowed 'General case' 0 C--N 1.308 -1.235 0 O-C-N 121.139 -0.975 . . . . 0.0 109.825 -179.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.501 ' H ' ' C ' ' A' ' 96' ' ' ARG . 48.0 mm-40 -61.22 89.41 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.268 -0.895 . . . . 0.0 109.221 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 49.2 t80 . . . . . 0 N--CA 1.493 1.686 0 CA-C-O 117.989 -1.005 . . . . 0.0 109.462 179.992 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.487 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm 44.58 -159.28 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.412 -0.805 . . . . 0.0 109.765 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.542 ' C ' ' H ' ' A' ' 5' ' ' TRP . 39.7 tt0 -71.32 77.13 0.74 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.183 -0.948 . . . . 0.0 109.379 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.419 ' O ' ' O ' ' A' ' 5' ' ' TRP . 3.6 t 58.55 0.59 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.366 -0.834 . . . . 0.0 109.698 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.542 ' H ' ' C ' ' A' ' 3' ' ' GLU . 30.6 t90 50.41 97.76 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.15 -0.969 . . . . 0.0 109.808 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.436 ' O ' ' O ' ' A' ' 7' ' ' GLU . 13.3 pt-20 -155.53 -26.17 0.11 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.17 -0.956 . . . . 0.0 109.51 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.436 ' O ' ' O ' ' A' ' 6' ' ' GLU . 35.4 tt0 60.09 129.02 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.54 -0.725 . . . . 0.0 109.947 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.5 tt -163.53 63.81 0.17 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.156 -0.965 . . . . 0.0 108.954 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -50.09 -45.7 52.82 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.211 -0.931 . . . . 0.0 109.436 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 165.81 55.52 0.03 OUTLIER Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.137 -1.585 . . . . 0.0 109.137 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 62.6 mt -135.9 -167.06 1.97 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.487 -1.008 . . . . 0.0 108.887 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 59.5 t0 45.81 68.79 3.05 Favored Pre-proline 0 N--CA 1.501 2.088 0 O-C-N 121.274 -0.891 . . . . 0.0 109.982 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.439 ' O ' ' O ' ' A' ' 14' ' ' ASN . 1.9 Cg_endo -67.58 -2.34 8.23 Favored 'Trans proline' 0 C--N 1.321 -0.903 0 C-N-CA 121.773 1.649 . . . . 0.0 109.515 178.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.439 ' O ' ' O ' ' A' ' 13' ' ' PRO . 43.1 t-20 42.09 94.93 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.416 -0.802 . . . . 0.0 110.663 179.227 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.58 HH11 ' CG ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -161.64 150.84 16.08 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.918 -1.114 . . . . 0.0 110.229 179.91 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 7.9 t80 57.79 -163.79 0.19 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.551 -0.718 . . . . 0.0 109.794 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.644 ' N ' HD21 ' A' ' 17' ' ' ASN . 0.0 OUTLIER -171.83 78.04 0.49 Allowed Pre-proline 0 N--CA 1.49 1.543 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 -179.528 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -59.37 -16.77 36.69 Favored 'Trans proline' 0 C--N 1.32 -0.937 0 C-N-CA 121.436 1.424 . . . . 0.0 111.228 -178.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 51.4 tttm -66.81 -36.53 82.6 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.906 -1.121 . . . . 0.0 111.077 -179.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.3 m -74.12 -41.6 61.34 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.617 -1.302 . . . . 0.0 110.367 -178.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.417 ' CD2' ' NE2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -55.28 -34.26 63.93 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 179.97 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -68.98 -35.96 77.32 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.347 -0.845 . . . . 0.0 109.686 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.41 ' O ' ' N ' ' A' ' 26' ' ' ASP . 97.2 mt -71.34 -61.07 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.225 0 O-C-N 120.827 -1.171 . . . . 0.0 109.007 179.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.9 tp -46.63 -38.02 9.06 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.31 -0.869 . . . . 0.0 110.751 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.515 ' N ' ' HD1' ' A' ' 25' ' ' HIS . 0.4 OUTLIER -74.99 -16.24 60.63 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.327 -1.483 . . . . 0.0 109.712 179.871 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.41 ' N ' ' O ' ' A' ' 23' ' ' ILE . 8.5 t0 -78.71 91.0 4.63 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.981 -1.074 . . . . 0.0 108.527 179.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 87.5 mt -75.75 -43.04 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.35 0 O-C-N 121.421 -0.799 . . . . 0.0 110.869 -178.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.513 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -95.24 12.66 28.14 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.015 -1.053 . . . . 0.0 110.083 -179.687 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 49.9 p 43.92 53.05 6.47 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.198 -0.939 . . . . 0.0 110.519 178.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -97.19 -3.78 40.27 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.09 -1.006 . . . . 0.0 108.886 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 76.94 -1.36 63.34 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.1 156.33 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 O-C-N 121.287 -1.125 . . . . 0.0 108.298 178.174 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 31.1 mt -114.42 128.86 56.55 Favored 'General case' 0 N--CA 1.512 2.664 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 178.426 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.434 ' OD1' ' OE2' ' A' ' 37' ' ' GLU . 45.0 p-10 -106.21 174.27 5.96 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.31 -0.869 . . . . 0.0 110.436 -179.029 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -52.08 -11.63 0.18 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.808 -0.557 . . . . 0.0 110.12 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.416 ' H ' ' C ' ' A' ' 34' ' ' ASP . 4.0 mm100 -83.13 -43.0 16.7 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.884 -1.135 . . . . 0.0 109.048 179.413 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.527 ' OE1' ' N ' ' A' ' 37' ' ' GLU . 0.3 OUTLIER -73.48 -29.93 62.83 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.312 -0.867 . . . . 0.0 108.789 179.377 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.5 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 10.2 mp -82.13 -40.03 22.45 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.545 -0.722 . . . . 0.0 109.435 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -70.23 -37.34 74.97 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 120.831 -1.168 . . . . 0.0 109.725 -179.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.62 -28.5 61.83 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.256 -0.903 . . . . 0.0 111.028 -179.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 mp -76.13 -27.9 57.23 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.85 -1.156 . . . . 0.0 110.525 -178.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.5 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 8.0 m-85 -80.91 -45.38 16.84 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 120.655 -1.278 . . . . 0.0 109.545 -179.281 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 51.4 m -63.96 -51.36 64.75 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.129 -0.982 . . . . 0.0 111.098 -178.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.439 ' CG ' ' N ' ' A' ' 45' ' ' GLU . 13.7 ptmt -66.96 -47.15 72.51 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.877 -1.139 . . . . 0.0 111.709 -177.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.439 ' N ' ' CG ' ' A' ' 44' ' ' LYS . 28.1 mt-10 -54.31 -27.31 34.67 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 120.309 -1.494 . . . . 0.0 108.444 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 8.1 tp -76.55 -24.14 53.59 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.463 -0.773 . . . . 0.0 109.37 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -63.53 -36.27 83.24 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.435 -0.791 . . . . 0.0 110.206 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.9 pttt -90.33 39.37 0.97 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.832 -1.167 . . . . 0.0 110.541 -179.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 21.7 t -146.97 -58.48 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 120.938 -1.101 . . . . 0.0 110.068 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.568 ' CZ ' ' SD ' ' A' ' 62' ' ' MET . 30.2 m-85 -85.38 -10.19 56.59 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.017 -1.052 . . . . 0.0 109.903 -179.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.571 ' C ' ' H ' ' A' ' 53' ' ' LYS . 7.9 m-20 50.4 88.64 0.11 Allowed Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 120.943 -1.098 . . . . 0.0 109.511 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -63.35 10.65 0.1 OUTLIER 'Trans proline' 0 C--N 1.322 -0.833 0 C-N-CA 121.317 1.345 . . . . 0.0 110.791 -179.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.571 ' H ' ' C ' ' A' ' 51' ' ' ASP . 94.9 mttt -112.2 30.94 6.64 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.465 -0.772 . . . . 0.0 109.68 -179.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.493 ' ND2' ' O ' ' A' ' 54' ' ' ASN . 2.0 t-20 -135.51 5.18 3.17 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.398 -0.814 . . . . 0.0 110.101 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -171.11 143.49 1.95 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.895 -1.128 . . . . 0.0 109.68 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.512 ' C ' ' H ' ' A' ' 58' ' ' ASP . 5.8 mp0 -81.87 5.86 17.58 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.214 -0.929 . . . . 0.0 109.408 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.419 ' O ' ' OD1' ' A' ' 57' ' ' ASP . 40.9 t0 -54.64 -5.27 0.08 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.356 -0.84 . . . . 0.0 109.875 -179.5 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.512 ' H ' ' C ' ' A' ' 56' ' ' GLU . 36.9 m-20 51.58 28.24 4.51 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.133 -0.979 . . . . 0.0 109.573 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 61.9 mtp 48.93 14.15 0.07 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.261 -0.899 . . . . 0.0 109.532 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.468 ' H ' ' C ' ' A' ' 58' ' ' ASP . 40.1 ttp180 -69.3 -53.92 17.22 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.245 -0.909 . . . . 0.0 109.762 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -60.19 -41.61 93.3 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.094 -1.004 . . . . 0.0 110.186 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.568 ' SD ' ' CZ ' ' A' ' 50' ' ' TYR . 9.7 tpt -71.35 -9.36 58.02 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.139 -0.976 . . . . 0.0 109.76 -179.305 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.457 ' CG ' ' O ' ' A' ' 60' ' ' ARG . 0.5 OUTLIER -50.14 -7.75 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.954 -1.092 . . . . 0.0 109.967 179.812 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.543 ' H ' ' C ' ' A' ' 62' ' ' MET . 54.9 mt-10 -54.12 -45.56 71.95 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.065 -1.022 . . . . 0.0 110.039 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -67.45 -26.23 66.29 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.999 -1.063 . . . . 0.0 109.288 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.1 ttm180 -57.2 -41.73 79.95 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.224 -0.923 . . . . 0.0 109.519 -179.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.421 ' O ' ' OE1' ' A' ' 71' ' ' GLU . 0.7 OUTLIER -81.7 -28.36 33.49 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.114 -0.991 . . . . 0.0 109.873 -179.629 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.8 tmm_? -60.59 -36.74 79.29 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.127 -0.983 . . . . 0.0 109.648 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 36.6 mtt -85.73 -37.47 19.33 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.063 -1.023 . . . . 0.0 109.737 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -61.75 -41.51 97.76 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.012 -1.055 . . . . 0.0 111.115 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.465 ' N ' ' CD ' ' A' ' 71' ' ' GLU . 1.3 mp0 -84.02 -52.46 6.29 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 120.965 -1.084 . . . . 0.0 111.147 -178.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 28.0 m170 -53.86 -39.81 65.97 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.894 -1.129 . . . . 0.0 110.121 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 72.9 t -75.12 -51.2 22.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 120.756 -1.215 . . . . 0.0 109.932 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 19.6 mtp -67.82 -14.74 63.2 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.934 -1.103 . . . . 0.0 110.094 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 23.6 ttpp -85.24 -32.55 22.54 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.373 -1.454 . . . . 0.0 110.506 -179.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . 0.674 HD21 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -111.96 -23.31 10.6 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.18 -0.95 . . . . 0.0 112.647 -177.92 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.674 ' H ' HD21 ' A' ' 76' ' ' ASN . 32.5 t -95.13 -38.25 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.49 0 O-C-N 120.458 -1.401 . . . . 0.0 110.61 -178.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.23 102.57 0.86 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.443 -1.411 . . . . 0.0 107.433 178.713 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -81.33 -52.8 6.91 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.356 -0.84 . . . . 0.0 111.777 -177.475 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.447 ' O ' ' N ' ' A' ' 82' ' ' ASP . 56.8 t-20 -100.0 23.46 9.82 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.199 -0.938 . . . . 0.0 109.641 -179.485 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.427 ' C ' ' O ' ' A' ' 80' ' ' ASN . 1.3 mm100 32.68 35.73 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 CA-C-O 121.079 0.466 . . . . 0.0 112.088 178.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.552 ' C ' ' H ' ' A' ' 84' ' ' LEU . 48.9 t0 -85.45 12.3 8.69 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 178.473 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.504 HH11 ' CG ' ' A' ' 83' ' ' ARG . 4.3 mtt-85 64.9 -4.29 0.49 Allowed 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 -178.427 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.552 ' H ' ' C ' ' A' ' 82' ' ' ASP . 14.7 mt -120.64 134.85 55.25 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 178.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 71.6 t -112.04 129.62 67.18 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.561 -0.712 . . . . 0.0 109.831 -178.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 32.5 p -105.63 159.15 16.19 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 178.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.2 tp -59.33 -35.6 74.14 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.41 -0.807 . . . . 0.0 109.397 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.485 ' H ' ' CD ' ' A' ' 88' ' ' GLU . 6.2 mp0 -60.7 -68.34 0.31 Allowed 'General case' 0 C--N 1.296 -1.757 0 O-C-N 121.24 -0.912 . . . . 0.0 111.828 -177.303 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -63.03 -32.0 73.27 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.033 -1.042 . . . . 0.0 110.563 -177.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -61.37 -51.89 66.93 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.892 -1.13 . . . . 0.0 109.753 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 68.2 mt -50.48 -48.57 56.68 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.25 -0.906 . . . . 0.0 109.256 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -46.66 -49.43 19.27 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.304 -0.873 . . . . 0.0 109.963 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 48.3 t -56.76 -27.55 59.67 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.199 -0.938 . . . . 0.0 109.882 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 29.4 p -99.24 -7.11 26.93 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.229 -0.919 . . . . 0.0 109.778 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.567 ' C ' ' H ' ' A' ' 97' ' ' LYS . 20.9 mt-30 -65.81 141.41 58.3 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.971 -1.081 . . . . 0.0 108.869 179.447 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.574 ' C ' ' H ' ' A' ' 98' ' ' GLU . 22.1 mmm180 55.65 3.61 0.09 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.434 -0.791 . . . . 0.0 109.545 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.567 ' H ' ' C ' ' A' ' 95' ' ' GLN . 79.0 mttt 66.79 -20.38 0.11 Allowed 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.681 -0.637 . . . . 0.0 110.082 -179.384 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.574 ' H ' ' C ' ' A' ' 96' ' ' ARG . 31.1 tp10 50.62 64.18 1.92 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.042 -1.037 . . . . 0.0 109.758 179.683 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 67.2 t80 . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 117.978 -1.01 . . . . 0.0 109.497 179.973 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.458 ' CD1' ' N ' ' A' ' 1' ' ' LEU . 9.6 mp . . . . . 0 N--CA 1.491 1.586 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 52.3 mttp -148.12 -17.67 0.34 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.238 -0.914 . . . . 0.0 109.264 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 53.59 64.6 1.78 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.326 -0.859 . . . . 0.0 109.571 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 33.6 m -65.13 -147.14 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.213 -0.929 . . . . 0.0 109.369 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 49.5 p90 -153.62 -157.23 0.76 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.125 -0.985 . . . . 0.0 109.383 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.481 ' O ' ' N ' ' A' ' 8' ' ' LEU . 14.0 pt-20 -157.85 -22.18 0.08 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.201 -0.937 . . . . 0.0 109.545 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 65.73 -62.31 0.24 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.446 -0.784 . . . . 0.0 109.568 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.481 ' N ' ' O ' ' A' ' 6' ' ' GLU . 6.3 tp -168.96 39.06 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.218 -0.926 . . . . 0.0 109.487 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.438 ' O ' ' O ' ' A' ' 8' ' ' LEU . 26.3 t0 55.67 165.35 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.476 -0.765 . . . . 0.0 109.702 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -84.59 25.18 5.89 Favored Glycine 0 N--CA 1.492 2.424 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 28.6 tp -58.97 -83.43 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.187 -1.184 . . . . 0.0 108.923 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -171.06 68.23 0.48 Allowed Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.198 -0.939 . . . . 0.0 109.498 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.407 ' O ' ' C ' ' A' ' 14' ' ' ASN . 1.8 Cg_endo -63.1 -45.35 12.71 Favored 'Trans proline' 0 C--N 1.318 -1.032 0 C-N-CA 121.465 1.443 . . . . 0.0 109.864 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.407 ' C ' ' O ' ' A' ' 13' ' ' PRO . 55.5 t-20 41.82 67.95 0.51 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.528 -0.733 . . . . 0.0 110.275 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 58.7 mtp180 -65.18 112.96 3.65 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.319 -0.863 . . . . 0.0 109.459 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -168.15 119.65 0.83 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.323 -0.861 . . . . 0.0 109.243 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -162.93 73.12 2.03 Favored Pre-proline 0 N--CA 1.49 1.535 0 O-C-N 121.212 -0.93 . . . . 0.0 109.828 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -58.76 -15.82 28.21 Favored 'Trans proline' 0 C--N 1.319 -0.994 0 C-N-CA 121.532 1.488 . . . . 0.0 110.33 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 69.0 tttt -57.38 -36.01 70.7 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.36 -0.838 . . . . 0.0 110.824 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 38.9 m -70.27 -39.79 74.74 Favored 'General case' 0 N--CA 1.483 1.2 0 O-C-N 120.58 -1.325 . . . . 0.0 110.083 -178.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.524 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.08 -50.38 71.18 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.083 -1.081 . . . . 0.0 108.083 179.767 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.524 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 41.7 t80 -54.11 -35.16 61.85 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.539 -0.725 . . . . 0.0 110.406 -179.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.531 ' O ' ' N ' ' A' ' 25' ' ' HIS . 97.2 mt -73.9 -61.99 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.204 0 O-C-N 120.694 -1.254 . . . . 0.0 108.974 -179.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.2 tp -46.22 -12.87 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.021 -1.049 . . . . 0.0 110.898 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.531 ' N ' ' O ' ' A' ' 23' ' ' ILE . 0.7 OUTLIER -102.24 -15.77 16.52 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 120.535 -1.353 . . . . 0.0 110.205 179.952 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.492 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 58.5 p30 -75.36 70.03 2.22 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.81 -1.181 . . . . 0.0 109.362 179.48 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 63.7 mt -50.2 -52.34 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 O-C-N 121.297 -0.877 . . . . 0.0 110.897 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.496 ' N ' HD21 ' A' ' 28' ' ' ASN . 2.1 m120 -87.89 14.35 9.0 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 120.726 -1.234 . . . . 0.0 110.376 -179.297 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.449 ' O ' ' OG ' ' A' ' 29' ' ' SER . 8.5 t 41.37 48.27 3.23 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.217 -0.927 . . . . 0.0 110.616 178.53 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -92.9 0.69 57.46 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.948 -1.095 . . . . 0.0 108.855 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 74.82 -0.26 57.77 Favored Glycine 0 N--CA 1.487 2.046 0 N-CA-C 109.343 -1.503 . . . . 0.0 109.343 -179.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -135.97 166.11 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 O-C-N 121.429 -1.042 . . . . 0.0 108.784 178.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -106.13 117.04 33.0 Favored 'General case' 0 N--CA 1.509 2.515 0 N-CA-C 107.44 -1.319 . . . . 0.0 107.44 177.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.413 ' OD1' ' N ' ' A' ' 34' ' ' ASP . 0.3 OUTLIER -90.55 165.18 13.91 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.535 -0.728 . . . . 0.0 110.361 -178.397 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -74.99 -39.84 61.03 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.541 -0.725 . . . . 0.0 110.786 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.501 ' NE2' ' C ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -63.01 -24.44 67.92 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 120.676 -1.265 . . . . 0.0 108.653 -179.779 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -84.82 -33.0 23.01 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 178.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.8 tp -75.84 -32.13 59.65 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 178.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 48.9 tt0 -67.43 -41.47 84.75 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 120.961 -1.087 . . . . 0.0 109.068 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.57 -45.42 53.44 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.271 -0.893 . . . . 0.0 110.769 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 39.7 tp -57.86 -23.26 52.14 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.175 -0.953 . . . . 0.0 109.619 -179.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -80.05 -51.22 9.29 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 120.967 -1.083 . . . . 0.0 109.057 -179.378 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 29.5 m -63.37 -34.38 77.59 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.122 -0.986 . . . . 0.0 109.994 -179.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -73.99 -46.98 40.39 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.113 -0.992 . . . . 0.0 110.51 -179.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -53.78 -27.54 29.63 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 120.751 -1.218 . . . . 0.0 109.377 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.529 ' C ' ' H ' ' A' ' 48' ' ' LYS . 18.9 mt -84.87 -25.76 27.79 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.292 -0.88 . . . . 0.0 110.58 -179.509 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.74 4.5 0.11 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.809 -1.182 . . . . 0.0 110.346 -179.084 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.529 ' H ' ' C ' ' A' ' 46' ' ' LEU . 40.6 pttt -135.37 41.32 2.78 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.143 -0.973 . . . . 0.0 109.819 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 58.5 t -147.27 -57.15 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 121.27 -0.894 . . . . 0.0 109.262 179.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -89.84 -139.57 0.14 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.131 -0.981 . . . . 0.0 109.231 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.57 ' C ' ' H ' ' A' ' 53' ' ' LYS . 17.0 p-10 -166.69 77.14 1.08 Allowed Pre-proline 0 N--CA 1.49 1.542 0 O-C-N 121.015 -1.053 . . . . 0.0 109.393 -179.42 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -63.72 11.02 0.1 Allowed 'Trans proline' 0 C--N 1.319 -0.998 0 C-N-CA 121.542 1.495 . . . . 0.0 110.46 -179.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.57 ' H ' ' C ' ' A' ' 51' ' ' ASP . 45.4 mmtt -82.83 -5.37 58.93 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.181 -0.949 . . . . 0.0 109.36 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.408 ' OD1' ' OD2' ' A' ' 51' ' ' ASP . 12.3 m120 -73.7 -13.34 60.96 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.229 -0.919 . . . . 0.0 109.58 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 46.09 49.62 12.22 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.441 -0.787 . . . . 0.0 109.728 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.401 ' O ' ' OD2' ' A' ' 58' ' ' ASP . 24.5 tt0 -162.54 -52.68 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.34 0 O-C-N 121.243 -0.911 . . . . 0.0 108.663 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.452 ' O ' ' N ' ' A' ' 59' ' ' MET . 28.0 m-20 -56.22 -19.28 13.16 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.367 -0.833 . . . . 0.0 109.634 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.407 ' C ' ' N ' ' A' ' 60' ' ' ARG . 43.8 m-20 48.84 15.44 0.09 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.26 -0.9 . . . . 0.0 109.661 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.452 ' N ' ' O ' ' A' ' 57' ' ' ASP . 63.0 mmm 50.6 16.83 0.33 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.137 -0.977 . . . . 0.0 109.513 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.407 ' N ' ' C ' ' A' ' 58' ' ' ASP . 39.8 ttm180 -82.76 -45.19 14.68 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.187 -0.946 . . . . 0.0 109.578 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -51.47 -51.44 55.02 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.932 -1.105 . . . . 0.0 110.358 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.545 ' O ' ' N ' ' A' ' 64' ' ' GLU . 0.3 OUTLIER -69.76 -9.09 53.21 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.047 -1.033 . . . . 0.0 111.167 -178.622 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.441 ' C ' ' O ' ' A' ' 62' ' ' MET . 12.9 pt-20 -37.92 -26.08 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.523 -0.736 . . . . 0.0 110.699 -179.246 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.545 ' N ' ' O ' ' A' ' 62' ' ' MET . 23.6 mm-40 -54.64 -25.62 27.92 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.226 -0.922 . . . . 0.0 109.54 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.456 ' CD ' ' N ' ' A' ' 65' ' ' GLU . 1.5 mp0 -78.38 -44.59 24.57 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.3 -0.875 . . . . 0.0 109.912 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 57.9 mtt180 -60.43 -43.29 96.95 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.16 -0.963 . . . . 0.0 109.675 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.401 ' O ' ' OE1' ' A' ' 71' ' ' GLU . 42.1 mt -74.33 -29.86 61.78 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.109 -0.994 . . . . 0.0 110.128 -178.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.7 tpp180 -74.43 -38.29 63.06 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.194 -0.941 . . . . 0.0 110.233 -178.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 30.6 mtt -86.36 -46.82 9.92 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 120.956 -1.09 . . . . 0.0 110.096 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 45.1 ttm180 -60.17 -36.98 78.81 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.858 -1.151 . . . . 0.0 110.386 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.401 ' OE1' ' O ' ' A' ' 67' ' ' LEU . 64.2 mt-10 -74.97 -47.78 27.6 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.758 -1.214 . . . . 0.0 110.32 -179.489 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.513 ' CE1' ' OD1' ' A' ' 76' ' ' ASN . 52.0 t-80 -58.04 -38.81 76.95 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.025 -1.047 . . . . 0.0 110.278 -179.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 77.9 t -71.86 -55.27 14.06 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 120.785 -1.197 . . . . 0.0 109.815 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 10.4 mtp -64.08 -21.97 66.74 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.054 -1.029 . . . . 0.0 110.107 -179.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.722 ' HZ1' HD22 ' A' ' 76' ' ' ASN . 0.8 OUTLIER -91.03 -32.96 15.71 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.497 -1.377 . . . . 0.0 110.252 -179.349 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . 0.722 HD22 ' HZ1' ' A' ' 75' ' ' LYS . 25.3 m120 -100.78 -9.48 21.69 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.008 -1.057 . . . . 0.0 111.691 -178.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 99.4 t -118.62 -33.59 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.515 0 O-C-N 120.667 -1.271 . . . . 0.0 110.698 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -48.94 113.78 0.86 Allowed 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.719 -1.238 . . . . 0.0 108.502 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -91.23 -65.54 1.0 Allowed 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.286 -0.884 . . . . 0.0 112.422 -176.11 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -107.16 25.03 11.9 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 120.886 -1.134 . . . . 0.0 110.655 -178.415 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 45.34 78.89 0.06 Allowed 'General case' 0 C--N 1.298 -1.657 0 O-C-N 121.514 -0.741 . . . . 0.0 111.679 177.52 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.583 ' C ' ' H ' ' A' ' 84' ' ' LEU . 26.3 t0 -144.81 19.17 1.64 Allowed 'General case' 0 C--N 1.296 -1.754 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.27 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 47.0 mtm180 58.15 -0.34 0.11 Allowed 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -179.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.583 ' H ' ' C ' ' A' ' 82' ' ' ASP . 1.8 mp -125.16 135.57 52.75 Favored 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 107.478 -1.304 . . . . 0.0 107.478 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 60.8 t -113.85 130.45 67.96 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.104 0 O-C-N 121.676 -0.64 . . . . 0.0 109.339 -179.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 66.9 p -94.64 163.22 13.47 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.034 -1.041 . . . . 0.0 109.386 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.473 ' C ' ' CD1' ' A' ' 87' ' ' LEU . 1.2 tm? -68.6 -38.58 80.73 Favored 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 108.002 -1.111 . . . . 0.0 108.002 179.723 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -60.19 -69.49 0.22 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.58 -0.7 . . . . 0.0 111.218 -179.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -56.46 -30.56 63.04 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.032 -1.042 . . . . 0.0 110.354 -178.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -62.03 -51.21 68.93 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.852 -1.155 . . . . 0.0 110.106 -179.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.402 ' O ' ' OG1' ' A' ' 94' ' ' THR . 89.1 mt -52.22 -38.97 59.57 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.963 -1.085 . . . . 0.0 108.963 178.585 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.445 ' O ' ' N ' ' A' ' 94' ' ' THR . . . -57.05 -62.75 1.53 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.266 -0.896 . . . . 0.0 109.937 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 45.9 t -44.09 -22.46 0.06 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.383 -0.823 . . . . 0.0 110.14 -179.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.445 ' N ' ' O ' ' A' ' 92' ' ' ALA . 44.4 p -98.97 -40.71 7.92 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.349 -0.844 . . . . 0.0 109.785 179.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -148.19 124.71 11.02 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.987 -1.071 . . . . 0.0 108.888 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.444 ' O ' ' CG ' ' A' ' 96' ' ' ARG . 4.3 ttp180 -140.48 22.26 2.36 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.106 -0.996 . . . . 0.0 108.98 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 53.3 mttp 53.25 15.95 0.74 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.334 -0.854 . . . . 0.0 109.595 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -73.11 65.0 0.77 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.235 -0.916 . . . . 0.0 109.51 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 57.7 t80 . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 118.047 -0.977 . . . . 0.0 109.418 -179.994 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.418 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 51.3 tp . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 16.7 mtpp -77.18 -30.71 55.01 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.246 -0.909 . . . . 0.0 109.295 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -78.71 -152.13 0.06 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.268 -0.895 . . . . 0.0 109.349 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 34.4 m -71.9 -156.87 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.298 -0.876 . . . . 0.0 109.418 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 4.5 m-90 -70.21 54.27 0.14 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.215 -0.928 . . . . 0.0 109.553 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.418 ' OE1' ' N ' ' A' ' 1' ' ' LEU . 12.8 mm-40 49.86 48.19 22.08 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.237 -0.914 . . . . 0.0 109.614 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 54.88 -128.02 2.24 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.289 -0.882 . . . . 0.0 109.476 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.1 tp -160.44 122.79 3.25 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.248 -0.907 . . . . 0.0 109.126 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.508 ' OD1' ' N ' ' A' ' 11' ' ' LEU . 9.6 t70 -51.15 151.79 2.6 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.207 -0.933 . . . . 0.0 110.124 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.444 ' N ' ' OD1' ' A' ' 9' ' ' ASP . . . -80.41 -39.45 15.14 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.368 -1.493 . . . . 0.0 109.368 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.508 ' N ' ' OD1' ' A' ' 9' ' ' ASP . 10.0 tp -154.35 63.0 0.69 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.247 -1.149 . . . . 0.0 109.147 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.432 ' O ' ' O ' ' A' ' 11' ' ' LEU . 0.2 OUTLIER 57.91 162.98 0.08 OUTLIER Pre-proline 0 N--CA 1.506 2.346 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 -179.655 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -57.13 -14.61 15.38 Favored 'Trans proline' 0 C--N 1.319 -1.016 0 C-N-CA 121.22 1.28 . . . . 0.0 109.552 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.535 ' O ' ' N ' ' A' ' 16' ' ' PHE . 2.6 m-20 -48.59 -53.34 18.78 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.313 -0.867 . . . . 0.0 109.685 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.557 HH11 ' CG ' ' A' ' 15' ' ' ARG . 3.8 mtt-85 51.35 -88.23 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.356 -0.84 . . . . 0.0 109.578 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.535 ' N ' ' O ' ' A' ' 14' ' ' ASN . 75.0 m-85 -139.84 -147.68 0.23 Allowed 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.369 -0.832 . . . . 0.0 109.191 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.518 ' C ' HD21 ' A' ' 17' ' ' ASN . 0.2 OUTLIER 50.13 67.33 4.5 Favored Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.25 -0.906 . . . . 0.0 109.707 -179.955 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -65.29 -17.93 59.41 Favored 'Trans proline' 0 C--N 1.317 -1.081 0 C-N-CA 121.497 1.465 . . . . 0.0 110.09 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.6 tttp -57.3 -34.73 69.01 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.361 -0.837 . . . . 0.0 110.981 -179.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 47.9 m -72.17 -41.23 67.29 Favored 'General case' 0 N--CA 1.485 1.282 0 O-C-N 120.695 -1.253 . . . . 0.0 110.226 -178.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.562 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -55.86 -43.88 77.54 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.03 -1.044 . . . . 0.0 108.463 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.562 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 45.3 t80 -61.25 -35.61 77.72 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.45 -0.781 . . . . 0.0 110.355 -179.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.42 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.6 mt -73.38 -61.0 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.194 0 O-C-N 120.746 -1.221 . . . . 0.0 109.162 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 22.1 tp -46.33 -34.69 4.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.178 -0.952 . . . . 0.0 110.708 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.581 ' N ' ' HD1' ' A' ' 25' ' ' HIS . 0.3 OUTLIER -79.73 -16.05 56.37 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.314 -1.491 . . . . 0.0 109.705 179.859 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.42 ' N ' ' O ' ' A' ' 23' ' ' ILE . 10.1 t0 -78.42 92.27 4.58 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.036 -1.04 . . . . 0.0 108.798 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 6.4 mt -73.37 -49.66 35.75 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 O-C-N 121.527 -0.733 . . . . 0.0 111.123 -178.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.583 HD21 ' N ' ' A' ' 28' ' ' ASN . 1.5 m120 -88.13 8.1 28.49 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.78 -1.2 . . . . 0.0 110.344 -179.445 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.4 p 45.48 60.31 3.14 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.061 -1.024 . . . . 0.0 110.537 179.144 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -101.55 -1.78 32.11 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.286 -0.884 . . . . 0.0 108.891 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 77.59 -1.95 64.88 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.959 -1.256 . . . . 0.0 109.959 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.21 165.41 29.25 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.213 0 O-C-N 121.41 -1.053 . . . . 0.0 108.302 178.303 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.7 tp -116.93 123.17 46.32 Favored 'General case' 0 N--CA 1.513 2.708 0 N-CA-C 107.853 -1.165 . . . . 0.0 107.853 178.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.418 ' OD1' ' OE2' ' A' ' 37' ' ' GLU . 36.2 p-10 -107.77 172.87 6.59 Favored 'General case' 0 N--CA 1.509 2.493 0 CA-C-O 122.179 0.99 . . . . 0.0 111.493 -178.288 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -58.8 -10.59 2.48 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.368 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -83.03 -48.95 10.07 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.728 -1.232 . . . . 0.0 108.814 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.512 ' OE1' ' N ' ' A' ' 37' ' ' GLU . 0.3 OUTLIER -67.55 -30.26 69.85 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 179.04 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.8 tp -82.09 -33.15 29.91 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.56 -0.712 . . . . 0.0 109.375 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -72.75 -44.21 61.91 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 120.857 -1.152 . . . . 0.0 109.199 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.27 -30.26 62.04 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.266 -0.896 . . . . 0.0 111.011 -178.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 40.4 mt -75.56 -21.94 57.45 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 120.836 -1.165 . . . . 0.0 109.464 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -77.48 -50.26 13.02 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.068 -1.02 . . . . 0.0 108.742 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.5 m -61.5 -39.0 89.4 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.427 -0.796 . . . . 0.0 110.575 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 44.1 mtpt -74.97 -36.59 62.04 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.148 -0.97 . . . . 0.0 111.698 -178.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -62.78 -30.28 71.34 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.208 -1.558 . . . . 0.0 109.32 -179.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 21.9 mt -72.51 -32.38 66.1 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.037 -1.039 . . . . 0.0 109.279 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 63.9 mm-40 -54.53 -12.87 0.8 Allowed 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.389 -0.819 . . . . 0.0 109.596 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 78.6 mttt -117.34 40.45 3.04 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.506 -0.746 . . . . 0.0 109.87 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 60.8 t -149.49 -59.32 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 O-C-N 121.023 -1.048 . . . . 0.0 109.546 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -89.75 -27.03 20.31 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.18 -0.95 . . . . 0.0 109.905 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 16.4 t0 61.96 72.0 0.68 Allowed Pre-proline 0 N--CA 1.502 2.134 0 O-C-N 121.155 -0.965 . . . . 0.0 108.966 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.64 175.36 1.72 Allowed 'Trans proline' 0 C--N 1.316 -1.144 0 C-N-CA 121.268 1.312 . . . . 0.0 109.84 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.4 ptpp? -171.55 -36.66 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.529 -0.732 . . . . 0.0 109.297 -179.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -88.44 -19.62 26.29 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.425 -0.797 . . . . 0.0 109.508 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 64.97 139.69 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -179.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 50.02 47.87 22.74 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.383 -0.823 . . . . 0.0 109.464 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.513 ' C ' ' H ' ' A' ' 59' ' ' MET . 24.4 t0 -144.87 -113.51 0.09 Allowed 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.423 -0.798 . . . . 0.0 109.413 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.418 ' C ' ' H ' ' A' ' 60' ' ' ARG . 18.9 t70 -50.57 -11.34 0.08 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.143 -0.973 . . . . 0.0 109.358 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.513 ' H ' ' C ' ' A' ' 57' ' ' ASP . 96.7 mmm -81.66 21.73 0.79 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.427 -0.796 . . . . 0.0 108.937 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.524 ' O ' ' N ' ' A' ' 62' ' ' MET . 51.4 mtp180 -129.68 -53.92 1.15 Allowed 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 179.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -43.26 -16.85 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.44 -0.787 . . . . 0.0 110.928 -179.228 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.561 ' O ' ' N ' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -113.45 5.81 16.88 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.208 -0.932 . . . . 0.0 109.846 179.827 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.408 ' C ' ' O ' ' A' ' 62' ' ' MET . 12.0 pt-20 -41.58 -20.45 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.038 0 CA-C-O 121.528 0.68 . . . . 0.0 109.688 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 62' ' ' MET . 42.7 mt-10 -65.59 -28.78 69.38 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.579 -0.7 . . . . 0.0 109.244 179.183 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -74.71 -40.47 61.31 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.332 -0.855 . . . . 0.0 109.629 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 29.5 mtm180 -64.42 -36.41 84.07 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.183 -0.948 . . . . 0.0 108.974 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 33.2 mt -81.61 -28.51 33.7 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.312 -0.867 . . . . 0.0 109.636 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -72.58 -37.2 68.26 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.243 -0.91 . . . . 0.0 110.02 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 12.6 mtt -85.63 -35.39 20.99 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 120.99 -1.069 . . . . 0.0 109.567 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 64.4 ttt180 -72.0 -33.55 68.17 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.761 -1.212 . . . . 0.0 109.801 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -78.48 -46.56 19.37 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.884 -1.135 . . . . 0.0 109.923 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 42.2 t-80 -60.28 -34.3 73.56 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.153 -0.967 . . . . 0.0 110.154 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 68.9 t -75.0 -55.91 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 O-C-N 120.614 -1.304 . . . . 0.0 109.894 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 5.7 mtt -64.0 -17.45 63.33 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.953 -1.092 . . . . 0.0 110.542 -179.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.5 tptm -82.72 -39.05 22.47 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.2 -1.562 . . . . 0.0 110.436 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . 0.667 HD21 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -103.87 -21.89 13.58 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.101 -1.0 . . . . 0.0 112.483 -177.949 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.667 ' H ' HD21 ' A' ' 76' ' ' ASN . 40.5 t -94.99 -35.48 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.414 0 O-C-N 120.404 -1.435 . . . . 0.0 109.507 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -47.57 106.58 0.09 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.043 -1.035 . . . . 0.0 108.889 178.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.56 -72.52 0.33 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.267 -0.895 . . . . 0.0 113.123 -176.791 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.753 ' H ' HD21 ' A' ' 80' ' ' ASN . 0.0 OUTLIER -106.81 26.88 9.49 Favored 'General case' 0 N--CA 1.513 2.69 0 O-C-N 120.661 -1.274 . . . . 0.0 110.802 -177.288 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.402 ' CA ' HE21 ' A' ' 81' ' ' GLN . 0.5 OUTLIER 44.7 71.08 0.28 Allowed 'General case' 0 C--N 1.293 -1.869 0 O-C-N 121.433 -0.792 . . . . 0.0 111.185 178.37 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.565 ' C ' ' H ' ' A' ' 84' ' ' LEU . 1.1 m-20 -136.14 18.86 3.2 Favored 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 106.665 -1.606 . . . . 0.0 106.665 177.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 74.0 mtt180 60.69 -2.37 0.18 Allowed 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -178.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.565 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.9 mt -119.96 133.89 55.41 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 53.2 t -109.23 131.66 59.44 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 58.8 p -97.77 157.53 16.02 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 120.926 -1.109 . . . . 0.0 109.732 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.473 ' C ' ' CD1' ' A' ' 87' ' ' LEU . 0.9 OUTLIER -63.13 -36.62 84.2 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 179.425 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.476 ' H ' ' CD ' ' A' ' 88' ' ' GLU . 20.5 mp0 -58.32 -71.84 0.1 Allowed 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.612 -0.68 . . . . 0.0 112.39 -179.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -61.3 -32.49 72.34 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.882 -1.136 . . . . 0.0 110.233 -177.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -57.27 -48.71 78.18 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 120.934 -1.104 . . . . 0.0 109.258 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.454 ' O ' ' N ' ' A' ' 94' ' ' THR . 54.7 mt -52.05 -47.83 64.91 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.979 -1.076 . . . . 0.0 108.822 178.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.414 ' C ' ' O ' ' A' ' 91' ' ' LEU . . . -41.57 -57.29 2.3 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.62 -0.675 . . . . 0.0 109.923 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 40.8 t -53.08 -33.72 53.37 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.299 -0.875 . . . . 0.0 109.486 179.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.454 ' N ' ' O ' ' A' ' 91' ' ' LEU . 11.6 p -102.27 23.21 12.04 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.441 -0.787 . . . . 0.0 109.296 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -152.95 140.45 19.74 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.248 -0.908 . . . . 0.0 109.854 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.571 ' CG ' HH11 ' A' ' 96' ' ' ARG . 0.0 OUTLIER -145.21 16.01 1.51 Allowed 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 179.377 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.3 mttp 57.75 1.98 0.15 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.723 -0.611 . . . . 0.0 109.906 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.516 ' H ' ' C ' ' A' ' 96' ' ' ARG . 65.1 mt-10 -88.35 49.94 1.88 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.165 -0.959 . . . . 0.0 109.209 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 88.8 m-85 . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 118.054 -0.974 . . . . 0.0 109.646 -179.954 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 8.2 tp . . . . . 0 N--CA 1.492 1.63 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -168.75 -57.22 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.148 -0.97 . . . . 0.0 109.431 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 48.2 tt0 -82.1 99.9 9.47 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.219 -0.925 . . . . 0.0 109.396 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.5 m -57.45 -166.23 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.14 -0.975 . . . . 0.0 109.48 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 71.6 t-105 -162.29 -51.11 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.211 -0.931 . . . . 0.0 109.461 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -61.43 157.17 17.48 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.24 -0.912 . . . . 0.0 109.399 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.1 tt0 -169.77 -21.54 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.213 -0.929 . . . . 0.0 109.357 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 14.9 tp -159.01 92.19 1.08 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.249 -0.907 . . . . 0.0 109.42 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -83.89 76.29 10.04 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.6 -0.688 . . . . 0.0 109.432 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.533 ' O ' ' N ' ' A' ' 12' ' ' ASP . . . -47.63 -36.78 12.93 Favored Glycine 0 N--CA 1.492 2.369 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 37.1 tp -43.54 -17.98 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.594 -0.945 . . . . 0.0 109.731 -179.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.533 ' N ' ' O ' ' A' ' 10' ' ' GLY . 1.3 m-20 -126.7 79.68 71.43 Favored Pre-proline 0 N--CA 1.499 2.024 0 O-C-N 121.351 -0.843 . . . . 0.0 109.394 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -62.0 -2.43 2.94 Favored 'Trans proline' 0 C--N 1.319 -0.996 0 C-N-CA 121.23 1.287 . . . . 0.0 109.654 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.568 ' H ' HD21 ' A' ' 14' ' ' ASN . 2.5 m-80 -43.81 -35.92 2.11 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.566 -0.709 . . . . 0.0 109.866 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.3 mmt180 -81.7 -47.96 12.28 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.2 -0.937 . . . . 0.0 109.278 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -74.31 122.22 22.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.309 -0.87 . . . . 0.0 109.499 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.7 p-10 -172.88 68.41 0.38 Allowed Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 121.25 -0.906 . . . . 0.0 109.491 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -63.55 -20.67 69.97 Favored 'Trans proline' 0 C--N 1.318 -1.031 0 C-N-CA 121.449 1.432 . . . . 0.0 110.006 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -55.28 -33.64 63.4 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.179 -0.95 . . . . 0.0 110.773 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.1 m -74.17 -41.64 61.16 Favored 'General case' 0 N--CA 1.484 1.259 0 O-C-N 120.741 -1.225 . . . . 0.0 110.429 -178.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -55.89 -34.65 65.72 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.906 -1.121 . . . . 0.0 108.301 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -70.32 -34.86 73.18 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.402 -0.811 . . . . 0.0 110.089 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.419 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.7 mt -72.4 -60.84 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 O-C-N 120.827 -1.171 . . . . 0.0 109.261 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.2 tp -45.6 -33.55 2.9 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.196 -0.94 . . . . 0.0 110.932 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 26.9 m170 -83.75 -14.41 51.59 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 120.261 -1.525 . . . . 0.0 109.66 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 23' ' ' ILE . 91.7 m-20 -75.52 94.79 3.2 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.068 -1.02 . . . . 0.0 108.916 179.143 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 28.4 mt -76.81 -49.93 22.45 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.308 0 O-C-N 121.406 -0.809 . . . . 0.0 110.955 -178.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.524 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -89.55 7.12 37.9 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 120.706 -1.246 . . . . 0.0 110.106 -179.698 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 24.6 p 44.35 51.28 7.7 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.097 -1.002 . . . . 0.0 110.624 178.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -93.19 5.37 51.76 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.081 -1.012 . . . . 0.0 108.423 179.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 73.61 2.7 61.0 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.669 -1.372 . . . . 0.0 109.669 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -141.94 166.34 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 O-C-N 121.261 -1.141 . . . . 0.0 108.665 178.59 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.1 tp -113.93 112.36 23.2 Favored 'General case' 0 N--CA 1.512 2.631 0 N-CA-C 107.478 -1.305 . . . . 0.0 107.478 178.074 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.58 178.41 6.79 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.503 -0.748 . . . . 0.0 110.645 -178.129 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -73.53 -42.98 61.04 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.467 -0.77 . . . . 0.0 111.25 -178.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.497 ' NE2' ' C ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -60.41 -24.46 65.18 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 120.513 -1.367 . . . . 0.0 108.591 -179.732 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -85.35 -33.28 22.08 Favored 'General case' 0 N--CA 1.498 1.954 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 178.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.1 tp -71.48 -35.49 70.84 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.55 -0.719 . . . . 0.0 109.336 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -74.3 -51.58 14.8 Favored 'General case' 0 C--N 1.306 -1.32 0 O-C-N 121.163 -0.96 . . . . 0.0 110.825 -179.143 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.8 -33.66 76.38 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.879 -1.138 . . . . 0.0 110.876 -178.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 40.1 tp -73.17 -27.83 61.87 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.956 -1.09 . . . . 0.0 110.089 -179.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -82.18 -47.9 11.93 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 120.716 -1.24 . . . . 0.0 110.156 -179.347 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 18.4 m -59.23 -35.8 74.3 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 120.942 -1.099 . . . . 0.0 110.392 -179.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.45 ' O ' ' N ' ' A' ' 47' ' ' GLU . 27.0 ttmt -73.75 -47.79 36.53 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.999 -1.063 . . . . 0.0 111.478 -178.369 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -53.88 -25.91 22.24 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.559 -1.338 . . . . 0.0 108.18 -179.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.1 tp -73.33 -21.57 60.52 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.45 ' N ' ' O ' ' A' ' 44' ' ' LYS . 11.4 mm-40 -76.74 -35.63 57.65 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.544 -0.722 . . . . 0.0 110.408 -179.573 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.1 pttp -83.49 -11.98 56.82 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 120.898 -1.126 . . . . 0.0 110.658 -178.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 57.0 t -88.57 -44.87 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 O-C-N 120.94 -1.1 . . . . 0.0 108.438 179.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.464 ' OH ' ' SD ' ' A' ' 62' ' ' MET . 50.5 m-85 -90.55 -153.68 0.31 Allowed 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 179.043 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -152.48 68.06 6.95 Favored Pre-proline 0 N--CA 1.502 2.165 0 O-C-N 120.675 -1.266 . . . . 0.0 110.003 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -57.94 -177.36 0.09 OUTLIER 'Trans proline' 0 C--N 1.318 -1.051 0 C-N-CA 121.472 1.448 . . . . 0.0 109.547 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.466 ' O ' ' CB ' ' A' ' 54' ' ' ASN . 60.5 mttt 67.8 98.37 0.06 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.49 -0.756 . . . . 0.0 109.055 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.466 ' CB ' ' O ' ' A' ' 53' ' ' LYS . 1.4 m120 81.94 12.98 0.6 Allowed 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -179.561 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 52.0 mm-40 -139.01 50.82 1.81 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.396 -0.815 . . . . 0.0 108.851 179.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -54.34 174.38 0.06 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.264 -0.898 . . . . 0.0 109.482 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 48.21 67.45 0.84 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.387 -0.821 . . . . 0.0 109.943 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -158.54 -22.7 0.08 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.221 -0.924 . . . . 0.0 109.369 179.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 4.6 mtp -100.04 -6.49 26.35 Favored 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 178.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.529 HH11 ' CG ' ' A' ' 60' ' ' ARG . 0.7 OUTLIER -82.07 -69.1 0.64 Allowed 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.588 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -50.07 -12.92 0.09 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.201 -0.937 . . . . 0.0 109.409 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.482 ' H ' ' C ' ' A' ' 60' ' ' ARG . 15.4 tpt -103.5 -12.01 17.41 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.392 -0.817 . . . . 0.0 109.665 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -54.05 -16.61 2.05 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.569 -1.332 . . . . 0.0 108.095 179.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -65.38 -44.18 88.39 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.421 -0.799 . . . . 0.0 109.022 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.432 ' O ' ' N ' ' A' ' 68' ' ' ARG . 4.8 tp10 -65.55 -43.99 88.21 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.668 -0.645 . . . . 0.0 109.549 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? -46.08 -36.63 5.94 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 38.2 mt -83.37 -27.27 29.79 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.629 -0.669 . . . . 0.0 109.533 179.066 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.432 ' N ' ' O ' ' A' ' 65' ' ' GLU . 12.3 tpt180 -68.42 -36.89 79.73 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.928 -1.108 . . . . 0.0 109.682 -179.347 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.4 mmt -84.57 -50.76 7.41 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.033 -1.042 . . . . 0.0 109.64 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 41.4 ttp180 -54.69 -38.29 66.83 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.878 -1.139 . . . . 0.0 110.309 -179.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -78.35 -53.09 7.67 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.978 -1.077 . . . . 0.0 110.508 -179.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 43.1 t60 -56.42 -33.23 65.63 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.019 -1.05 . . . . 0.0 109.506 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 58.4 t -75.04 -54.69 13.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 120.734 -1.228 . . . . 0.0 109.499 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 32.0 mtp -63.58 -16.3 60.47 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.309 -0.869 . . . . 0.0 110.269 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.462 ' C ' HD21 ' A' ' 76' ' ' ASN . 42.0 tttp -95.56 -38.24 10.5 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.644 -1.285 . . . . 0.0 110.132 -179.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . 0.637 ' N ' HD21 ' A' ' 76' ' ' ASN . 0.8 OUTLIER -98.21 -11.12 23.04 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 120.975 -1.078 . . . . 0.0 112.145 -178.015 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 74.0 t -110.32 -34.87 2.53 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.45 0 O-C-N 120.467 -1.396 . . . . 0.0 109.638 179.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -59.29 104.13 0.23 Allowed 'General case' 0 N--CA 1.494 1.764 0 O-C-N 120.562 -1.336 . . . . 0.0 107.778 177.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -83.16 -53.63 5.64 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.17 -0.956 . . . . 0.0 111.32 -178.22 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -101.87 24.68 9.6 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.24 -0.913 . . . . 0.0 109.666 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 33.08 37.95 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 178.579 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.574 ' C ' ' H ' ' A' ' 84' ' ' LEU . 16.5 p-10 -91.03 14.61 13.5 Favored 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 178.286 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 37.5 mtm180 64.02 -3.88 0.43 Allowed 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.574 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.4 mp -120.52 134.55 55.26 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 179.41 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 82.7 t -112.23 130.12 66.51 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.945 0 O-C-N 121.606 -0.684 . . . . 0.0 109.815 -178.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 26.4 p -103.43 162.35 13.1 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.246 -0.909 . . . . 0.0 108.667 178.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.8 tp -63.35 -35.54 80.73 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.264 -0.898 . . . . 0.0 109.063 179.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -60.73 -68.37 0.31 Allowed 'General case' 0 C--N 1.294 -1.824 0 O-C-N 121.128 -0.982 . . . . 0.0 111.623 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -61.46 -30.73 70.77 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.1 -1.0 . . . . 0.0 110.537 -178.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -64.58 -51.64 61.69 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.932 -1.105 . . . . 0.0 109.523 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 52.0 mt -48.39 -42.53 32.12 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.297 -0.877 . . . . 0.0 109.421 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -55.19 -57.77 10.43 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.064 -1.022 . . . . 0.0 110.373 -179.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 84.8 p -48.08 -61.87 1.76 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.165 -0.959 . . . . 0.0 110.951 -179.119 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.453 ' O ' ' N ' ' A' ' 96' ' ' ARG . 0.2 OUTLIER -62.41 -65.99 0.61 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.105 -0.997 . . . . 0.0 110.302 -178.697 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.447 ' C ' ' O ' ' A' ' 94' ' ' THR . 17.6 mm100 -32.97 -35.79 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.57 -0.706 . . . . 0.0 111.705 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.453 ' N ' ' O ' ' A' ' 94' ' ' THR . 20.7 mmt180 -60.96 95.47 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.861 -1.15 . . . . 0.0 110.124 -179.525 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 45.5 mttp 55.08 10.5 0.41 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.439 -0.788 . . . . 0.0 110.485 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 50.16 69.56 0.6 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.92 -1.113 . . . . 0.0 109.425 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 56.1 t80 . . . . . 0 N--CA 1.494 1.739 0 CA-C-O 118.007 -0.997 . . . . 0.0 109.396 179.944 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 39.2 tp . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -62.15 135.59 57.57 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.248 -0.907 . . . . 0.0 109.483 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -163.55 -33.33 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.28 -0.887 . . . . 0.0 109.357 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.414 ' O ' ' CD1' ' A' ' 5' ' ' TRP . 8.3 p -76.36 161.17 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 O-C-N 121.294 -0.879 . . . . 0.0 109.508 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.414 ' CD1' ' O ' ' A' ' 4' ' ' VAL . 5.1 m-90 -144.13 71.9 1.33 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.284 -0.885 . . . . 0.0 109.15 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -149.83 125.84 10.59 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.221 -0.925 . . . . 0.0 109.502 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 54.73 -109.88 0.52 Allowed 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.524 -0.735 . . . . 0.0 109.641 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.408 ' O ' ' C ' ' A' ' 9' ' ' ASP . 0.9 OUTLIER -170.63 157.47 5.76 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.377 -0.827 . . . . 0.0 109.448 -179.657 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.537 ' O ' ' N ' ' A' ' 11' ' ' LEU . 26.1 m-20 -38.55 133.19 1.06 Allowed 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.49 -0.756 . . . . 0.0 109.894 -179.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -48.47 -9.56 0.09 OUTLIER Glycine 0 N--CA 1.491 2.339 0 O-C-N 120.61 -1.306 . . . . 0.0 110.359 -179.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.537 ' N ' ' O ' ' A' ' 9' ' ' ASP . 0.4 OUTLIER -154.55 62.03 0.68 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.955 -1.321 . . . . 0.0 109.812 -179.952 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -58.33 130.78 84.36 Favored Pre-proline 0 N--CA 1.49 1.527 0 O-C-N 121.081 -1.012 . . . . 0.0 108.763 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -62.0 -10.63 18.34 Favored 'Trans proline' 0 C--O 1.215 -0.63 0 C-N-CA 120.655 0.903 . . . . 0.0 109.867 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 -67.06 -55.21 15.29 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.247 -0.908 . . . . 0.0 109.614 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 38.7 ttp180 48.27 79.29 0.07 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.181 -0.95 . . . . 0.0 109.558 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -78.39 157.13 29.14 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.332 -0.855 . . . . 0.0 109.526 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.653 ' ND2' ' H ' ' A' ' 20' ' ' THR . 0.2 OUTLIER -171.31 67.37 0.45 Allowed Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 121.304 -0.873 . . . . 0.0 109.738 -179.956 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -65.34 -23.05 59.32 Favored 'Trans proline' 0 C--N 1.317 -1.13 0 C-N-CA 121.371 1.381 . . . . 0.0 109.761 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 55.7 tttp -56.77 -41.49 77.73 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.401 -0.812 . . . . 0.0 110.803 -179.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.653 ' H ' ' ND2' ' A' ' 17' ' ' ASN . 29.3 m -64.82 -40.18 94.78 Favored 'General case' 0 N--CA 1.485 1.321 0 O-C-N 120.76 -1.213 . . . . 0.0 110.355 -178.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -55.33 -41.82 72.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.942 -1.099 . . . . 0.0 108.263 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -62.54 -33.13 74.29 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.395 -0.816 . . . . 0.0 110.149 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.411 ' O ' ' N ' ' A' ' 25' ' ' HIS . 96.6 mt -75.84 -62.61 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 O-C-N 120.725 -1.235 . . . . 0.0 109.129 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.9 tp -47.51 -16.2 0.06 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.068 -1.02 . . . . 0.0 111.257 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.54 ' O ' ' ND1' ' A' ' 25' ' ' HIS . 0.7 OUTLIER -100.77 -15.74 17.55 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.479 -1.388 . . . . 0.0 109.833 179.896 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -76.32 89.55 3.17 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.863 -1.148 . . . . 0.0 108.462 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 10.9 mt -71.85 -52.19 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 O-C-N 121.448 -0.782 . . . . 0.0 111.134 -178.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.546 HD21 ' N ' ' A' ' 28' ' ' ASN . 1.7 m120 -86.32 4.48 38.95 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.856 -1.153 . . . . 0.0 110.029 -179.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 18.8 p 46.22 57.65 5.13 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.082 -1.011 . . . . 0.0 110.319 179.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -99.8 -0.07 40.55 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.274 -0.891 . . . . 0.0 108.737 179.4 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.85 3.76 87.84 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 110.101 -1.2 . . . . 0.0 110.101 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.12 165.35 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.121 0 O-C-N 121.16 -1.2 . . . . 0.0 108.328 178.037 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 tp -120.43 115.43 23.47 Favored 'General case' 0 N--CA 1.513 2.703 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 178.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.442 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 27.6 p-10 -98.29 -174.21 2.78 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.244 -0.91 . . . . 0.0 111.567 -178.1 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -72.16 -21.23 61.48 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -178.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.496 ' NE2' ' C ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -77.06 -25.86 52.89 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 120.008 -1.683 . . . . 0.0 109.349 -179.682 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -87.82 -31.84 19.36 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.946 -1.096 . . . . 0.0 108.415 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.2 tp -77.73 -33.58 52.92 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.598 -0.689 . . . . 0.0 109.17 179.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -71.85 -44.97 62.94 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.033 -1.042 . . . . 0.0 109.557 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.4 ' O ' ' CE ' ' A' ' 44' ' ' LYS . . . -72.13 -43.45 64.66 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.043 -1.035 . . . . 0.0 111.3 -178.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.405 ' CD2' ' CD2' ' A' ' 25' ' ' HIS . 35.7 tp -62.39 -24.94 67.66 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.747 -1.221 . . . . 0.0 109.243 -179.404 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.53 -36.34 63.17 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 120.982 -1.074 . . . . 0.0 108.822 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 17.6 m -62.45 -54.93 32.94 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.468 -0.77 . . . . 0.0 111.747 -178.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.4 ' CE ' ' O ' ' A' ' 40' ' ' ALA . 1.7 mtmt -72.95 -47.48 45.11 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 120.601 -1.312 . . . . 0.0 112.171 -177.546 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -52.78 -27.93 20.15 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.36 -1.463 . . . . 0.0 109.064 -178.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.2 tp -82.08 -25.02 34.89 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.253 -0.904 . . . . 0.0 108.849 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -72.4 -2.86 20.98 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.543 -0.723 . . . . 0.0 109.706 178.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.1 mttp -102.2 44.05 1.03 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.233 -0.917 . . . . 0.0 109.634 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 45.6 t -149.78 -54.2 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 O-C-N 121.182 -0.949 . . . . 0.0 109.838 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -84.09 -135.3 0.05 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.2 -0.937 . . . . 0.0 110.013 -179.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -142.67 75.71 18.27 Favored Pre-proline 0 N--CA 1.497 1.919 0 O-C-N 121.264 -0.898 . . . . 0.0 109.27 -179.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -60.34 178.42 0.44 Allowed 'Trans proline' 0 C--N 1.316 -1.147 0 C-N-CA 121.411 1.407 . . . . 0.0 110.15 -179.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.2 mttp 70.29 31.15 3.18 Favored 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 -179.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.513 ' ND2' ' O ' ' A' ' 54' ' ' ASN . 1.1 t-20 -134.24 7.36 3.64 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.695 -0.628 . . . . 0.0 109.539 179.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.503 ' CB ' ' O ' ' A' ' 54' ' ' ASN . 8.3 tt0 80.47 -149.54 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.423 -0.798 . . . . 0.0 109.372 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -93.31 74.41 4.56 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.995 -1.066 . . . . 0.0 108.965 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -146.06 29.76 1.07 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.486 -0.759 . . . . 0.0 109.959 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -172.43 -17.05 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.953 -1.092 . . . . 0.0 109.547 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.493 ' O ' ' SD ' ' A' ' 62' ' ' MET . 3.3 mmt -108.46 15.34 23.98 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 179.309 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.465 ' O ' ' N ' ' A' ' 63' ' ' GLU . 38.4 ttp180 -97.6 -68.31 0.81 Allowed 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 178.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -35.06 -41.26 0.14 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.875 -0.516 . . . . 0.0 112.175 -179.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.594 ' SD ' ' N ' ' A' ' 63' ' ' GLU . 0.0 OUTLIER -89.0 -0.3 57.3 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 120.531 -1.356 . . . . 0.0 111.103 -178.741 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.594 ' N ' ' SD ' ' A' ' 62' ' ' MET . 1.1 pp20? -33.39 -30.08 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.31 0 CA-C-O 121.451 0.643 . . . . 0.0 110.668 -178.562 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.562 ' N ' ' O ' ' A' ' 62' ' ' MET . 46.1 mm-40 -68.8 -54.57 15.11 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.419 -0.8 . . . . 0.0 109.316 178.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.44 ' N ' ' O ' ' A' ' 62' ' ' MET . 7.5 tp10 -43.23 -41.52 3.91 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.604 -0.685 . . . . 0.0 110.698 -179.181 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 6.4 mmm180 -51.81 -46.11 64.15 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.123 -0.986 . . . . 0.0 109.296 -179.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 27.3 mt -79.28 -26.88 42.28 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.276 -0.89 . . . . 0.0 110.211 -179.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.11 -39.67 82.74 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.025 -1.047 . . . . 0.0 110.368 -178.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 9.8 mtt -86.08 -48.7 8.39 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 120.906 -1.121 . . . . 0.0 110.099 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.459 ' CG ' ' NH1' ' A' ' 70' ' ' ARG . 2.7 ttt-85 -55.0 -36.22 65.19 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.771 -1.206 . . . . 0.0 109.767 179.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -71.91 -50.7 26.91 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 120.847 -1.158 . . . . 0.0 110.276 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 45.0 t-80 -56.23 -35.18 67.08 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.045 -1.034 . . . . 0.0 110.529 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 70.2 t -71.54 -55.12 14.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 120.613 -1.304 . . . . 0.0 109.776 -179.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.6 mmt -61.53 -22.13 64.87 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.228 -0.92 . . . . 0.0 110.069 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -84.34 -37.04 22.08 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.505 -1.372 . . . . 0.0 111.162 -179.141 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . 0.672 HD21 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -102.01 -24.99 13.91 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 120.961 -1.087 . . . . 0.0 112.611 -177.933 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.672 ' H ' HD21 ' A' ' 76' ' ' ASN . 32.6 t -92.86 -33.22 5.27 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.5 0 O-C-N 120.29 -1.506 . . . . 0.0 110.038 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -65.72 99.12 0.43 Allowed 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 178.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -82.68 -56.86 3.6 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.077 -1.014 . . . . 0.0 112.324 -177.099 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.541 ' O ' ' N ' ' A' ' 82' ' ' ASP . 4.9 m120 -98.28 23.83 7.91 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.063 -1.023 . . . . 0.0 109.591 -178.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.491 ' C ' ' H ' ' A' ' 83' ' ' ARG . 0.2 OUTLIER 35.65 25.83 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.58 0 CA-C-N 116.31 -0.404 . . . . 0.0 112.015 178.662 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.541 ' N ' ' O ' ' A' ' 80' ' ' ASN . 81.6 m-20 -81.54 11.07 4.93 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 106.696 -1.594 . . . . 0.0 106.696 178.11 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.491 ' H ' ' C ' ' A' ' 81' ' ' GLN . 70.0 mtt180 65.72 -5.74 0.48 Allowed 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 115.131 -0.941 . . . . 0.0 108.737 -178.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.53 ' H ' ' C ' ' A' ' 82' ' ' ASP . 10.9 mt -114.35 134.04 55.25 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 107.481 -1.303 . . . . 0.0 107.481 178.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 70.4 t -112.15 129.8 66.98 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.875 0 O-C-N 121.51 -0.744 . . . . 0.0 109.391 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 17.5 p -106.17 173.88 6.12 Favored 'General case' 0 N--CA 1.5 2.07 0 N-CA-C 108.166 -1.049 . . . . 0.0 108.166 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.6 tp -69.94 -35.22 74.36 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.213 -0.929 . . . . 0.0 109.422 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -61.04 -67.9 0.36 Allowed 'General case' 0 C--N 1.291 -1.952 0 O-C-N 120.897 -1.127 . . . . 0.0 111.578 -177.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -63.12 -30.88 71.94 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.183 -0.948 . . . . 0.0 110.713 -178.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -59.72 -52.36 65.82 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.887 -1.133 . . . . 0.0 109.551 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 87.2 mt -50.79 -48.0 59.64 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.234 -0.916 . . . . 0.0 108.963 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.89 -55.12 10.6 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.39 -0.819 . . . . 0.0 110.173 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 51.1 m -57.32 -28.53 63.16 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.978 -1.076 . . . . 0.0 110.633 -178.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.477 ' O ' ' N ' ' A' ' 96' ' ' ARG . 29.4 p -98.81 13.67 31.56 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 120.993 -1.067 . . . . 0.0 109.881 -179.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -68.34 53.38 0.08 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.113 -0.992 . . . . 0.0 108.944 179.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.477 ' N ' ' O ' ' A' ' 94' ' ' THR . 5.9 tpp180 -177.82 -32.21 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 179.579 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.423 ' O ' ' N ' ' A' ' 99' ' ' PHE . 40.9 mttp -50.34 -19.22 0.77 Allowed 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.281 -0.887 . . . . 0.0 109.141 -179.582 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 46.4 tt0 -62.29 85.37 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.151 -0.968 . . . . 0.0 109.213 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.423 ' N ' ' O ' ' A' ' 97' ' ' LYS . 74.7 m-85 . . . . . 0 N--CA 1.49 1.549 0 CA-C-O 118.014 -0.993 . . . . 0.0 109.233 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 60.7 mttp -143.83 171.91 13.57 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.182 -0.948 . . . . 0.0 109.31 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 43.4 tp10 -169.18 106.24 0.4 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.189 -0.945 . . . . 0.0 109.497 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 56.7 t -67.94 -82.01 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.218 -0.926 . . . . 0.0 109.463 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 17.7 t90 -172.29 -79.98 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.162 -0.961 . . . . 0.0 109.363 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.459 ' OE2' ' NH1' ' A' ' 15' ' ' ARG . 56.8 mm-40 -69.18 -49.95 52.02 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.224 -0.922 . . . . 0.0 109.274 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 53.74 63.69 2.11 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.455 -0.778 . . . . 0.0 109.615 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 18.0 mt -45.21 134.71 6.19 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.464 -0.772 . . . . 0.0 109.244 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.464 ' N ' ' OD1' ' A' ' 9' ' ' ASP . 25.7 p-10 -127.73 54.61 1.68 Allowed 'General case' 0 N--CA 1.498 1.966 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -179.693 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.532 ' O ' ' O ' ' A' ' 11' ' ' LEU . . . 81.74 68.79 1.43 Allowed Glycine 0 N--CA 1.489 2.21 0 N-CA-C 108.264 -1.935 . . . . 0.0 108.264 -178.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.533 ' N ' ' CD1' ' A' ' 11' ' ' LEU . 6.1 mp 50.25 121.72 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.01 0 CA-C-O 121.991 0.901 . . . . 0.0 111.022 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -135.85 70.06 64.72 Favored Pre-proline 0 N--CA 1.498 1.972 0 O-C-N 121.095 -1.003 . . . . 0.0 109.703 179.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -62.04 -37.27 65.7 Favored 'Trans proline' 0 C--N 1.32 -0.932 0 C-N-CA 121.605 1.537 . . . . 0.0 110.041 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -112.51 92.73 4.13 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.459 ' NH1' ' OE2' ' A' ' 6' ' ' GLU . 46.4 mtp180 -61.01 -30.87 70.55 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.314 -0.866 . . . . 0.0 109.394 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -166.69 -70.29 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.208 -0.932 . . . . 0.0 109.953 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 45.1 t-20 -165.76 77.51 1.24 Allowed Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.184 -0.948 . . . . 0.0 109.807 -179.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -60.03 -15.04 31.17 Favored 'Trans proline' 0 C--N 1.318 -1.055 0 C-N-CA 121.352 1.368 . . . . 0.0 110.115 -179.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 58.5 tttp -55.7 -42.2 74.9 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.496 -0.752 . . . . 0.0 111.171 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 58.5 m -69.19 -40.65 77.95 Favored 'General case' 0 N--CA 1.484 1.27 0 O-C-N 120.619 -1.301 . . . . 0.0 110.619 -178.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.615 ' CE2' ' NE2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -54.68 -33.86 61.46 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 179.883 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -69.68 -34.89 74.58 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.493 -0.755 . . . . 0.0 109.977 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.498 ' O ' ' N ' ' A' ' 26' ' ' ASP . 97.8 mt -69.36 -59.92 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 O-C-N 120.866 -1.146 . . . . 0.0 109.1 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.7 tp -44.75 -36.47 3.2 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.468 -0.77 . . . . 0.0 110.577 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.615 ' NE2' ' CE2' ' A' ' 21' ' ' PHE . 56.1 m-70 -81.25 -11.88 59.26 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.273 -1.517 . . . . 0.0 109.609 179.631 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.498 ' N ' ' O ' ' A' ' 23' ' ' ILE . 73.3 m-20 -79.91 90.68 5.34 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.02 -1.05 . . . . 0.0 108.812 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 22.2 mt -75.75 -52.61 17.68 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.354 0 O-C-N 121.283 -0.885 . . . . 0.0 110.878 -178.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.51 HD21 ' N ' ' A' ' 28' ' ' ASN . 1.9 m120 -86.69 11.22 13.49 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.844 -1.16 . . . . 0.0 109.896 -179.569 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 25.0 p 43.6 52.65 6.11 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.333 -0.855 . . . . 0.0 110.554 179.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -95.0 -2.31 50.62 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.08 -1.012 . . . . 0.0 108.332 179.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 76.79 -1.87 61.23 Favored Glycine 0 N--CA 1.488 2.166 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.67 164.9 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.106 0 O-C-N 121.274 -1.133 . . . . 0.0 108.605 178.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 mp -121.36 125.6 47.38 Favored 'General case' 0 N--CA 1.519 3.006 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 178.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -108.03 -176.82 3.16 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.06 -1.025 . . . . 0.0 110.26 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -59.5 -13.21 8.1 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.676 -0.64 . . . . 0.0 111.042 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.547 ' NE2' ' O ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -81.17 -27.68 35.31 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.53 -1.356 . . . . 0.0 109.25 179.724 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -83.9 -37.46 22.35 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.961 -1.087 . . . . 0.0 109.652 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.537 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 1.5 mt -75.59 -30.7 59.7 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.712 -1.243 . . . . 0.0 108.476 178.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -61.73 -45.64 93.05 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 178.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.93 -28.42 61.51 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.395 -0.816 . . . . 0.0 110.733 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.96 -27.11 60.83 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 120.874 -1.141 . . . . 0.0 110.313 -178.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.537 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 37.9 m-85 -80.98 -49.91 10.35 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.677 -1.265 . . . . 0.0 108.989 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 49.0 m -59.18 -54.45 46.84 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.16 -0.963 . . . . 0.0 111.169 -179.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.476 ' CG ' ' N ' ' A' ' 45' ' ' GLU . 15.8 ptmt -61.33 -48.0 83.33 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.142 -0.974 . . . . 0.0 111.864 -177.618 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.476 ' N ' ' CG ' ' A' ' 44' ' ' LYS . 22.5 mm-40 -55.19 -26.27 38.13 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.416 -1.428 . . . . 0.0 109.139 -179.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 41.5 mt -82.84 -37.63 24.13 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.122 -0.986 . . . . 0.0 110.762 -179.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.75 0.02 16.67 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.514 -1.366 . . . . 0.0 109.457 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.4 ttmm -92.44 -27.74 17.28 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.252 -0.905 . . . . 0.0 109.361 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 84.8 t -102.43 -53.92 7.07 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 121.298 -0.876 . . . . 0.0 109.809 -179.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -72.3 -131.05 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.115 -0.99 . . . . 0.0 109.456 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -179.58 69.99 0.17 Allowed Pre-proline 0 N--CA 1.503 2.208 0 O-C-N 121.406 -0.809 . . . . 0.0 109.041 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -59.59 177.15 0.48 Allowed 'Trans proline' 0 C--N 1.316 -1.162 0 C-N-CA 121.47 1.447 . . . . 0.0 109.995 -179.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 60.1 mttp 53.16 42.37 32.15 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.479 -0.763 . . . . 0.0 109.386 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -173.7 -32.26 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.509 -0.744 . . . . 0.0 110.416 179.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.42 ' O ' ' O ' ' A' ' 56' ' ' GLU . 55.1 mt-10 -112.09 163.89 13.78 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.433 -0.792 . . . . 0.0 109.529 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.464 ' C ' ' H ' ' A' ' 58' ' ' ASP . 40.7 mt-10 -55.84 -168.02 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.262 -0.899 . . . . 0.0 109.594 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.558 ' C ' ' H ' ' A' ' 59' ' ' MET . 63.5 m-20 -75.86 35.47 0.13 Allowed 'General case' 0 N--CA 1.486 1.358 0 O-C-N 121.161 -0.962 . . . . 0.0 109.865 -179.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.464 ' H ' ' C ' ' A' ' 56' ' ' GLU . 19.8 m-20 -50.36 -8.62 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.187 -0.945 . . . . 0.0 109.79 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.558 ' H ' ' C ' ' A' ' 57' ' ' ASP . 33.3 mtp -70.14 -5.74 29.29 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.239 -0.913 . . . . 0.0 109.035 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.403 ' O ' ' CG ' ' A' ' 63' ' ' GLU . 26.1 ttm180 -89.16 -49.5 6.71 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.376 -0.827 . . . . 0.0 109.238 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -56.57 -57.37 12.65 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.592 -1.318 . . . . 0.0 109.489 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.569 ' O ' ' N ' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -59.88 -7.12 1.52 Allowed 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.345 -0.847 . . . . 0.0 110.938 -179.239 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.416 ' C ' ' O ' ' A' ' 62' ' ' MET . 12.1 pt-20 -40.3 -21.73 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.406 -0.809 . . . . 0.0 109.99 -179.42 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.569 ' N ' ' O ' ' A' ' 62' ' ' MET . 52.3 mt-10 -54.56 -39.83 68.14 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.318 -0.864 . . . . 0.0 109.196 179.182 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 59.6 mm-40 -71.85 -41.62 67.89 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.216 -0.928 . . . . 0.0 108.871 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.533 ' CG ' HH11 ' A' ' 66' ' ' ARG . 0.0 OUTLIER -51.51 -43.44 62.27 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.452 -0.78 . . . . 0.0 109.12 179.672 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 22.8 mt -76.92 -27.4 54.88 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.385 -0.822 . . . . 0.0 109.87 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.51 ' CG ' HH11 ' A' ' 68' ' ' ARG . 0.0 OUTLIER -73.81 -38.1 64.69 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.023 -1.048 . . . . 0.0 109.88 -179.556 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 23.7 mtt -86.47 -41.59 14.27 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 120.673 -1.267 . . . . 0.0 109.182 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -68.3 -39.74 81.96 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.14 -0.975 . . . . 0.0 110.479 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -84.51 -51.52 6.84 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.987 -1.071 . . . . 0.0 111.419 -178.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.479 ' O ' ' ND2' ' A' ' 76' ' ' ASN . 56.9 t60 -53.76 -40.75 66.47 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.875 -1.141 . . . . 0.0 110.292 -178.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 69.2 t -73.94 -47.23 43.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 120.716 -1.24 . . . . 0.0 109.616 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.502 ' SD ' ' OD2' ' A' ' 78' ' ' ASP . 3.4 mmt -69.5 -17.16 63.57 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.126 -0.984 . . . . 0.0 110.275 -179.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.468 ' CB ' ' NZ ' ' A' ' 75' ' ' LYS . 6.4 ttpm? -90.64 -34.64 15.36 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.362 -1.461 . . . . 0.0 111.159 -178.733 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . 0.638 HD21 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -106.37 -26.49 11.46 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 120.95 -1.094 . . . . 0.0 113.079 -177.67 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.638 ' H ' HD21 ' A' ' 76' ' ' ASN . 40.9 t -94.44 -31.03 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.551 0 O-C-N 120.286 -1.509 . . . . 0.0 110.503 -179.018 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.502 ' OD2' ' SD ' ' A' ' 74' ' ' MET . 1.6 m-20 -69.06 103.53 1.89 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 120.447 -1.408 . . . . 0.0 107.652 178.538 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.23 -53.19 5.95 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.217 -0.927 . . . . 0.0 111.45 -177.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.462 ' O ' ' N ' ' A' ' 82' ' ' ASP . 8.7 t-20 -101.16 23.92 10.18 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 121.201 -0.937 . . . . 0.0 109.578 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.411 ' C ' ' O ' ' A' ' 80' ' ' ASN . 1.3 mm100 31.63 35.97 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 178.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.569 ' C ' ' H ' ' A' ' 84' ' ' LEU . 26.2 t0 -85.27 11.9 9.15 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 178.399 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 36.0 mtm180 65.34 -4.77 0.51 Allowed 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 -178.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.569 ' H ' ' C ' ' A' ' 82' ' ' ASP . 4.4 mp -121.08 134.61 55.27 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 179.117 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 76.1 t -113.85 130.17 68.45 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 O-C-N 121.514 -0.741 . . . . 0.0 110.321 -178.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 47.4 p -100.04 173.76 6.49 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 178.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.1 tp -73.6 -36.91 65.56 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.206 -0.934 . . . . 0.0 109.229 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 -63.6 -60.27 3.55 Favored 'General case' 0 C--N 1.29 -2.013 0 O-C-N 120.823 -1.173 . . . . 0.0 111.678 -177.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -63.66 -32.54 74.06 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.644 -1.285 . . . . 0.0 110.139 -178.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -66.01 -52.43 49.41 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.677 -1.265 . . . . 0.0 109.35 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.4 mp -46.85 -45.6 20.35 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.241 -0.912 . . . . 0.0 108.877 179.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -52.42 -57.6 9.35 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.199 -0.938 . . . . 0.0 110.214 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 40.6 m -45.09 -27.83 0.64 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.242 -0.911 . . . . 0.0 109.977 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.641 ' HG1' ' N ' ' A' ' 95' ' ' GLN . 29.3 p -97.99 -54.07 3.2 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.35 -0.844 . . . . 0.0 108.723 178.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.641 ' N ' ' HG1' ' A' ' 94' ' ' THR . 2.8 tt0 -52.31 177.87 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.202 -0.936 . . . . 0.0 109.335 179.686 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.511 ' CG ' HH11 ' A' ' 96' ' ' ARG . 0.0 OUTLIER -162.37 42.0 0.13 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.256 -0.902 . . . . 0.0 109.215 -179.972 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 30.8 ttpt -50.8 -19.59 1.02 Allowed 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.304 -0.872 . . . . 0.0 109.683 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 44.7 mm-40 -66.35 92.62 0.2 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.276 -0.89 . . . . 0.0 109.635 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 58.9 t80 . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 117.932 -1.032 . . . . 0.0 109.51 179.805 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 18.9 mt . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 67.8 mttm 51.5 -102.51 0.12 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.26 -0.9 . . . . 0.0 109.401 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.528 ' O ' ' N ' ' A' ' 5' ' ' TRP . 0.0 OUTLIER -162.41 -22.76 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.156 -0.965 . . . . 0.0 109.658 -179.95 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.421 ' O ' ' O ' ' A' ' 5' ' ' TRP . 27.5 t 55.06 -84.21 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.373 -0.829 . . . . 0.0 109.729 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.528 ' N ' ' O ' ' A' ' 3' ' ' GLU . 61.0 m95 -62.64 -135.84 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.003 -1.061 . . . . 0.0 109.582 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -160.95 148.13 15.36 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.171 -0.956 . . . . 0.0 109.631 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.482 ' N ' ' OE2' ' A' ' 7' ' ' GLU . 1.1 pm0 -167.47 41.47 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.675 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.3 tp -174.89 140.6 0.56 Allowed 'General case' 0 N--CA 1.491 1.617 0 N-CA-C 107.883 -1.155 . . . . 0.0 107.883 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.505 ' OD1' ' N ' ' A' ' 12' ' ' ASP . 0.6 OUTLIER -91.37 -21.33 21.05 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.867 -1.146 . . . . 0.0 109.042 179.758 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.99 -0.99 89.3 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 108.815 -1.714 . . . . 0.0 108.815 -179.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.427 ' N ' ' OD1' ' A' ' 9' ' ' ASP . 0.4 OUTLIER -169.62 69.71 0.06 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.484 -1.009 . . . . 0.0 109.374 179.982 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.505 ' N ' ' OD1' ' A' ' 9' ' ' ASP . 2.5 p30 -82.78 149.52 60.23 Favored Pre-proline 0 N--CA 1.494 1.738 0 O-C-N 121.139 -0.975 . . . . 0.0 109.104 -179.666 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.495 ' O ' ' N ' ' A' ' 15' ' ' ARG . 3.4 Cg_endo -61.46 -11.05 18.09 Favored 'Trans proline' 0 C--N 1.324 -0.759 0 C-N-CA 121.003 1.135 . . . . 0.0 109.641 179.322 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 33.0 m120 -65.57 67.74 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.268 -0.895 . . . . 0.0 109.642 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.495 ' N ' ' O ' ' A' ' 13' ' ' PRO . 99.2 mtt180 -60.67 173.21 0.76 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.317 -0.864 . . . . 0.0 109.343 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 24.5 p90 -77.25 25.59 0.17 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.205 -0.934 . . . . 0.0 109.538 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.475 ' H ' ' C ' ' A' ' 15' ' ' ARG . 9.5 m120 51.53 69.34 2.57 Favored Pre-proline 0 N--CA 1.491 1.582 0 O-C-N 121.282 -0.887 . . . . 0.0 109.805 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -62.84 -18.76 66.28 Favored 'Trans proline' 0 C--N 1.318 -1.071 0 C-N-CA 121.573 1.515 . . . . 0.0 110.013 -179.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -55.17 -36.84 66.29 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.404 -0.81 . . . . 0.0 110.924 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.5 m -72.21 -40.91 67.47 Favored 'General case' 0 N--CA 1.484 1.266 0 O-C-N 120.802 -1.186 . . . . 0.0 110.523 -178.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -56.24 -34.85 66.74 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.9 -1.125 . . . . 0.0 108.038 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -69.68 -33.6 72.79 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.453 -0.779 . . . . 0.0 109.884 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 98.2 mt -72.85 -60.54 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 O-C-N 120.838 -1.164 . . . . 0.0 109.278 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -45.92 -39.26 8.52 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.297 -0.877 . . . . 0.0 110.798 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -78.78 -15.86 57.88 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.332 -1.48 . . . . 0.0 110.155 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -78.38 96.42 5.33 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.984 -1.073 . . . . 0.0 108.64 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 14.9 mt -75.9 -48.36 29.42 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.363 0 O-C-N 121.501 -0.749 . . . . 0.0 111.032 -178.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.513 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -89.31 8.04 32.53 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.853 -1.154 . . . . 0.0 110.003 -179.696 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 46.4 p 44.59 54.75 6.28 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.112 -0.993 . . . . 0.0 110.59 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.466 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 21.0 p-10 -94.77 -3.18 49.59 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.054 -1.029 . . . . 0.0 108.71 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 79.41 -5.69 59.58 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -132.43 165.57 31.76 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 178.507 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.1 tp -116.66 123.5 47.42 Favored 'General case' 0 N--CA 1.515 2.82 0 N-CA-C 107.68 -1.229 . . . . 0.0 107.68 178.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 35.4 p-10 -103.94 179.59 4.23 Favored 'General case' 0 N--CA 1.507 2.379 0 CA-C-O 122.06 0.933 . . . . 0.0 111.038 -178.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -68.19 -8.2 36.72 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.389 -179.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.9 mm100 -85.66 -47.11 10.12 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 120.812 -1.18 . . . . 0.0 109.292 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -73.91 -29.4 62.03 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.333 -0.854 . . . . 0.0 108.814 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.0 tp -79.23 -40.56 30.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.45 -0.781 . . . . 0.0 109.792 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 47.5 mm-40 -74.65 -44.15 51.8 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.598 -1.314 . . . . 0.0 109.59 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.83 -32.57 71.05 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 120.971 -1.081 . . . . 0.0 110.632 -179.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 55.6 tp -76.59 -27.67 55.9 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.906 -1.121 . . . . 0.0 110.481 -178.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -81.73 -50.25 9.49 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 120.686 -1.259 . . . . 0.0 109.27 -179.594 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 20.7 m -62.24 -44.46 96.5 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.34 -0.85 . . . . 0.0 110.758 -178.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.1 ptmt -67.75 -43.15 80.56 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.799 -1.188 . . . . 0.0 111.17 -177.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -52.89 -36.82 59.8 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.286 -1.508 . . . . 0.0 108.789 -179.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.488 ' C ' ' H ' ' A' ' 48' ' ' LYS . 4.8 tp -67.85 -25.66 65.65 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 179.371 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -60.23 -3.69 0.67 Allowed 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.488 ' H ' ' C ' ' A' ' 46' ' ' LEU . 61.1 mttm -119.92 46.55 1.92 Allowed 'General case' 0 N--CA 1.498 1.969 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 179.405 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 60.3 t -149.91 -53.87 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.221 -0.925 . . . . 0.0 109.57 -179.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -81.91 12.55 3.97 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.245 -0.909 . . . . 0.0 109.943 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.8 t70 60.73 103.87 0.03 OUTLIER Pre-proline 0 N--CA 1.501 2.112 0 O-C-N 121.25 -0.906 . . . . 0.0 109.176 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.414 ' C ' ' H ' ' A' ' 54' ' ' ASN . 9.9 Cg_endo -70.9 170.7 17.31 Favored 'Trans proline' 0 C--N 1.324 -0.747 0 N-CA-C 109.458 -1.016 . . . . 0.0 109.458 -179.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.409 ' CB ' ' NZ ' ' A' ' 53' ' ' LYS . 8.8 mtmp? 59.8 5.91 0.8 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.663 -0.648 . . . . 0.0 109.702 -179.418 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.414 ' H ' ' C ' ' A' ' 52' ' ' PRO . 57.9 t-20 -86.01 -2.83 58.68 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.162 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.565 ' O ' ' N ' ' A' ' 57' ' ' ASP . 19.6 mm-40 50.45 -145.09 0.49 Allowed 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.553 -0.717 . . . . 0.0 109.387 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.526 ' O ' ' N ' ' A' ' 58' ' ' ASP . 44.1 mt-10 48.31 -87.46 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.595 -0.69 . . . . 0.0 109.722 179.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.655 ' C ' ' H ' ' A' ' 59' ' ' MET . 0.7 OUTLIER -60.86 77.5 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.271 -0.893 . . . . 0.0 109.685 179.962 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.526 ' N ' ' O ' ' A' ' 56' ' ' GLU . 8.2 m-20 -59.05 21.56 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.586 -0.696 . . . . 0.0 111.212 -179.428 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.655 ' H ' ' C ' ' A' ' 57' ' ' ASP . 75.0 mmm 52.41 42.69 31.23 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 120.885 -1.134 . . . . 0.0 108.975 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.421 ' O ' ' OE2' ' A' ' 63' ' ' GLU . 37.1 ttp180 -132.86 -67.15 0.65 Allowed 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -179.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.406 ' C ' ' O ' ' A' ' 60' ' ' ARG . 49.6 mm-40 -45.11 -30.36 1.1 Allowed 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.004 -1.06 . . . . 0.0 109.709 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.577 ' C ' ' H ' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -85.09 3.67 37.75 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.274 -0.891 . . . . 0.0 110.396 -179.821 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.549 ' OE1' ' N ' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -53.97 -1.61 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.135 -0.978 . . . . 0.0 110.019 179.844 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.577 ' H ' ' C ' ' A' ' 62' ' ' MET . 15.0 mm-40 -72.97 -48.86 32.96 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.046 -1.034 . . . . 0.0 109.662 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -67.97 -39.46 83.32 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.221 -0.924 . . . . 0.0 109.442 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 38.7 ttt180 -55.46 -36.78 66.94 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.362 -0.836 . . . . 0.0 109.447 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.414 ' O ' ' OE1' ' A' ' 71' ' ' GLU . 24.6 mt -81.88 -28.3 33.0 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.038 -1.039 . . . . 0.0 110.043 -179.59 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.9 -40.41 87.73 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.036 -1.04 . . . . 0.0 109.788 -179.309 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.4 mtm -84.75 -50.23 7.77 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.058 -1.026 . . . . 0.0 109.895 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.4 ttp180 -54.04 -27.69 33.79 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.795 -1.191 . . . . 0.0 109.982 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.414 ' OE1' ' O ' ' A' ' 67' ' ' LEU . 37.5 mt-10 -80.23 -51.22 9.2 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.853 -1.154 . . . . 0.0 110.103 -179.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -54.59 -34.48 62.03 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.092 -1.005 . . . . 0.0 110.547 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 72.6 t -73.2 -54.02 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 120.665 -1.272 . . . . 0.0 109.938 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.422 ' O ' ' CG ' ' A' ' 78' ' ' ASP . 2.0 mmt -62.41 -17.77 60.01 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.16 -0.962 . . . . 0.0 109.786 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.29 -38.57 10.94 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.633 -1.292 . . . . 0.0 111.014 -178.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . 0.49 ' N ' HD21 ' A' ' 76' ' ' ASN . 1.0 OUTLIER -98.06 -9.16 26.42 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.101 -1.0 . . . . 0.0 112.254 -177.707 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 84.6 t -116.1 -34.1 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.579 0 O-C-N 120.614 -1.304 . . . . 0.0 110.42 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.425 ' OD2' ' OE1' ' A' ' 81' ' ' GLN . 14.5 p-10 -48.93 108.0 0.16 Allowed 'General case' 0 N--CA 1.497 1.925 0 O-C-N 120.684 -1.26 . . . . 0.0 109.099 178.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -83.15 -66.62 0.87 Allowed 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.015 -1.053 . . . . 0.0 110.791 -178.024 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.53 ' O ' ' N ' ' A' ' 82' ' ' ASP . 10.5 m120 -104.62 25.2 10.59 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.109 -0.994 . . . . 0.0 109.351 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.5 ' C ' ' H ' ' A' ' 83' ' ' ARG . 0.2 OUTLIER 37.23 26.28 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.176 0.512 . . . . 0.0 111.135 178.937 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.554 ' C ' ' H ' ' A' ' 84' ' ' LEU . 56.4 t0 -81.32 12.84 3.27 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 178.405 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.5 ' H ' ' C ' ' A' ' 81' ' ' GLN . 72.6 mtt180 65.67 -5.29 0.51 Allowed 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 -178.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.554 ' H ' ' C ' ' A' ' 82' ' ' ASP . 9.9 mt -116.08 133.71 55.73 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 178.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 69.8 t -111.05 130.95 63.57 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.031 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 51.5 p -104.86 159.37 15.85 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.26 -0.9 . . . . 0.0 109.378 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.0 tp -61.3 -36.61 80.57 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -57.02 -68.55 0.21 Allowed 'General case' 0 C--N 1.294 -1.839 0 O-C-N 121.534 -0.728 . . . . 0.0 110.866 -178.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 56.8 mm-40 -63.94 -34.91 79.04 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.193 -0.942 . . . . 0.0 110.938 -178.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -58.3 -49.84 75.74 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.589 -1.319 . . . . 0.0 109.102 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 71.1 mt -51.71 -46.13 63.82 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.098 -1.001 . . . . 0.0 108.844 178.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -43.94 -51.36 7.71 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.458 -0.776 . . . . 0.0 110.094 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 93.7 p -58.0 -32.19 67.68 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.313 -0.867 . . . . 0.0 110.734 -179.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.556 ' HG1' ' N ' ' A' ' 95' ' ' GLN . 22.2 p -93.83 -69.67 0.74 Allowed 'General case' 0 N--CA 1.502 2.172 0 O-C-N 120.999 -1.063 . . . . 0.0 110.271 -179.333 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.556 ' N ' ' HG1' ' A' ' 94' ' ' THR . 2.1 pt20 -46.21 170.29 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.008 -1.057 . . . . 0.0 109.755 -179.632 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.511 ' NE ' ' O ' ' A' ' 96' ' ' ARG . 0.4 OUTLIER -164.36 93.44 0.68 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.059 -1.026 . . . . 0.0 109.47 179.897 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.535 ' O ' ' N ' ' A' ' 99' ' ' PHE . 39.6 tptt -167.99 77.43 0.15 Allowed 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.232 -0.917 . . . . 0.0 109.536 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.403 ' O ' ' OE1' ' A' ' 98' ' ' GLU . 0.0 OUTLIER -64.33 66.76 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.38 -0.825 . . . . 0.0 109.882 -179.87 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.535 ' N ' ' O ' ' A' ' 97' ' ' LYS . 77.9 t80 . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 118.024 -0.989 . . . . 0.0 109.379 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 61.8 tp . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -72.24 179.5 3.34 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.31 -0.869 . . . . 0.0 109.433 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.438 ' CD ' ' N ' ' A' ' 3' ' ' GLU . 3.3 mp0 -65.46 140.39 58.6 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.137 -0.977 . . . . 0.0 109.383 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 34.1 t -64.51 127.52 25.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.292 -0.88 . . . . 0.0 109.507 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 84.3 m95 -64.75 109.17 1.95 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.268 -0.895 . . . . 0.0 109.554 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -163.88 65.76 0.16 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.236 -0.915 . . . . 0.0 109.366 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 64.1 tt0 -168.02 156.46 8.99 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.084 -1.01 . . . . 0.0 109.568 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.2 tp -148.85 125.61 11.16 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.293 -0.879 . . . . 0.0 109.023 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -97.85 70.33 2.15 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.146 -0.971 . . . . 0.0 109.166 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -162.06 -74.09 0.02 OUTLIER Glycine 0 N--CA 1.489 2.201 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 41.7 mt -130.72 -83.86 0.53 Allowed 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.587 -0.949 . . . . 0.0 109.364 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -154.77 161.72 28.74 Favored Pre-proline 0 N--CA 1.497 1.908 0 O-C-N 121.007 -1.058 . . . . 0.0 108.629 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -58.79 -45.33 29.74 Favored 'Trans proline' 0 C--N 1.32 -0.943 0 C-N-CA 121.354 1.37 . . . . 0.0 109.867 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.581 ' CG ' ' H ' ' A' ' 15' ' ' ARG . 1.5 p30 -81.84 -118.4 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.109 -0.995 . . . . 0.0 109.473 -179.715 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.581 ' H ' ' CG ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -175.62 174.23 2.28 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.748 -1.22 . . . . 0.0 109.137 -179.955 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -58.56 98.93 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.17 -0.956 . . . . 0.0 108.859 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -136.84 79.92 38.06 Favored Pre-proline 0 N--CA 1.498 1.927 0 O-C-N 121.401 -0.812 . . . . 0.0 109.671 -179.387 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -58.98 -8.74 6.54 Favored 'Trans proline' 0 C--N 1.318 -1.07 0 C-N-CA 121.192 1.262 . . . . 0.0 109.877 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.0 tttp -60.87 -37.18 81.25 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.455 -0.778 . . . . 0.0 110.533 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 48.3 m -70.53 -39.14 74.22 Favored 'General case' 0 C--N 1.308 -1.228 0 O-C-N 120.854 -1.154 . . . . 0.0 110.261 -178.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.447 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.11 -39.95 72.98 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.972 -1.08 . . . . 0.0 108.264 179.692 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.447 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 35.9 t80 -64.97 -36.76 85.44 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.319 -0.863 . . . . 0.0 110.543 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.442 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.9 mt -71.5 -61.32 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 O-C-N 120.735 -1.228 . . . . 0.0 109.491 -179.226 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -46.72 -37.42 8.42 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.098 -1.001 . . . . 0.0 110.178 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 12.5 m-70 -74.69 -14.74 60.78 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.552 -1.342 . . . . 0.0 109.56 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.442 ' N ' ' O ' ' A' ' 23' ' ' ILE . 65.9 m-20 -76.26 93.22 3.38 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.948 -1.095 . . . . 0.0 108.859 179.052 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 33.0 mt -75.1 -53.18 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 O-C-N 121.135 -0.978 . . . . 0.0 110.731 -178.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.533 HD21 ' N ' ' A' ' 28' ' ' ASN . 1.7 m120 -86.42 13.86 7.61 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 120.844 -1.16 . . . . 0.0 109.955 -179.681 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.406 ' OG ' ' O ' ' A' ' 29' ' ' SER . 6.7 t 42.54 51.43 4.86 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.416 -0.803 . . . . 0.0 110.516 178.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -94.44 -4.07 48.94 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.11 -0.994 . . . . 0.0 108.33 179.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 77.25 -2.11 62.64 Favored Glycine 0 N--CA 1.489 2.167 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -140.5 164.82 21.39 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.04 0 O-C-N 121.41 -1.053 . . . . 0.0 108.601 178.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 mp -118.43 129.77 55.58 Favored 'General case' 0 N--CA 1.52 3.035 0 N-CA-C 107.872 -1.159 . . . . 0.0 107.872 177.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.479 ' C ' ' H ' ' A' ' 36' ' ' GLN . 26.2 p-10 -108.01 168.62 9.16 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.3 -0.875 . . . . 0.0 110.325 -179.076 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -50.8 -8.79 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.552 -0.717 . . . . 0.0 110.458 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.479 ' H ' ' C ' ' A' ' 34' ' ' ASP . 3.1 mm100 -84.09 -38.28 20.98 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 120.973 -1.079 . . . . 0.0 109.026 178.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -77.99 -29.61 49.74 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.211 -0.931 . . . . 0.0 109.012 179.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.543 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 10.4 mp -78.02 -40.53 38.65 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.107 -0.996 . . . . 0.0 108.368 179.369 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -69.03 -44.64 72.31 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.967 -1.083 . . . . 0.0 109.474 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.88 -27.9 65.19 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.323 -0.86 . . . . 0.0 110.59 -179.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.424 ' O ' ' OE1' ' A' ' 45' ' ' GLU . 22.4 tp -75.32 -25.77 58.11 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.501 -1.374 . . . . 0.0 110.706 -178.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.543 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 11.4 m-85 -82.88 -39.9 20.94 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 120.296 -1.502 . . . . 0.0 110.287 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 84.8 m -72.42 -41.69 65.94 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.717 -1.239 . . . . 0.0 111.406 -178.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.465 ' CE ' ' N ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -73.98 -50.94 17.63 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 120.652 -1.28 . . . . 0.0 109.421 -178.331 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.424 ' OE1' ' O ' ' A' ' 41' ' ' LEU . 15.4 pt-20 -51.14 -28.63 11.36 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 120.987 -1.07 . . . . 0.0 108.971 -179.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.3 tp -84.77 -35.31 22.49 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.261 -0.899 . . . . 0.0 109.292 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -52.51 -33.73 46.42 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.295 -0.878 . . . . 0.0 110.257 179.342 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.9 pttt -81.7 17.38 1.48 Allowed 'General case' 0 N--CA 1.496 1.857 0 O-C-N 120.686 -1.259 . . . . 0.0 109.734 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 59.7 t -120.31 -59.39 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.386 -0.821 . . . . 0.0 110.196 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -85.46 -129.94 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.983 -1.073 . . . . 0.0 109.933 -179.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.564 ' C ' ' H ' ' A' ' 53' ' ' LYS . 50.7 p-10 -172.93 78.65 0.42 Allowed Pre-proline 0 N--CA 1.49 1.548 0 O-C-N 121.141 -0.974 . . . . 0.0 109.006 -179.443 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -65.85 17.65 0.09 OUTLIER 'Trans proline' 0 C--N 1.319 -0.986 0 C-N-CA 121.639 1.56 . . . . 0.0 110.889 -179.045 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.564 ' H ' ' C ' ' A' ' 51' ' ' ASP . 0.1 OUTLIER -136.26 6.96 3.09 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.304 -0.873 . . . . 0.0 109.553 179.795 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.529 ' ND2' ' O ' ' A' ' 53' ' ' LYS . 16.5 m120 -141.55 14.07 2.15 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.196 -0.94 . . . . 0.0 109.858 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.462 ' C ' ' H ' ' A' ' 57' ' ' ASP . 21.8 tp10 -152.48 140.89 20.63 Favored 'General case' 0 C--N 1.308 -1.219 0 O-C-N 120.964 -1.085 . . . . 0.0 108.852 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.503 ' OE2' ' N ' ' A' ' 56' ' ' GLU . 2.3 mp0 -79.12 30.84 0.21 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.235 -0.915 . . . . 0.0 109.341 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' A' ' 59' ' ' MET . 13.6 p-10 -72.52 -11.91 60.86 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.298 -0.876 . . . . 0.0 109.838 -179.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 46.04 15.6 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.253 -0.904 . . . . 0.0 109.859 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.518 ' N ' ' O ' ' A' ' 57' ' ' ASP . 37.8 mmm 51.41 49.22 21.43 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.288 -0.883 . . . . 0.0 108.767 -179.395 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.497 ' O ' ' N ' ' A' ' 62' ' ' MET . 41.8 ttp180 -129.05 -57.31 1.16 Allowed 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -179.361 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -45.35 -17.54 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.08 -1.013 . . . . 0.0 110.065 -179.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.6 ' SD ' ' N ' ' A' ' 63' ' ' GLU . 0.0 OUTLIER -101.14 -0.38 36.23 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.167 -0.958 . . . . 0.0 109.724 -179.9 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.6 ' N ' ' SD ' ' A' ' 62' ' ' MET . 16.2 pt-20 -43.86 -16.2 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.914 0 CA-C-O 121.564 0.697 . . . . 0.0 109.536 -179.152 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.562 ' N ' ' O ' ' A' ' 62' ' ' MET . 35.6 mt-10 -62.38 -58.66 6.84 Favored 'General case' 0 C--N 1.3 -1.545 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.771 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 -62.93 -35.6 80.65 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.286 -0.884 . . . . 0.0 109.431 179.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 33.5 ttp180 -54.15 -50.41 67.03 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.43 -0.794 . . . . 0.0 109.403 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.423 ' C ' ' CD1' ' A' ' 67' ' ' LEU . 0.6 OUTLIER -79.65 -26.73 40.99 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.31 -0.868 . . . . 0.0 109.716 -179.65 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.77 -38.65 85.97 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.886 -1.134 . . . . 0.0 109.664 -179.685 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 25.9 mtt -83.79 -50.41 8.15 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.927 -1.108 . . . . 0.0 109.864 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 52.8 ttt180 -50.43 -26.57 5.19 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 120.6 -1.312 . . . . 0.0 110.496 -179.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 -85.16 -51.78 6.39 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.774 -1.203 . . . . 0.0 110.684 -179.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.528 ' CE1' ' OD1' ' A' ' 76' ' ' ASN . 59.2 t-80 -54.82 -39.87 68.96 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.963 -1.086 . . . . 0.0 110.337 -179.281 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 68.9 t -73.29 -53.57 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 120.704 -1.248 . . . . 0.0 109.865 -179.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.445 ' O ' ' CG ' ' A' ' 78' ' ' ASP . 4.0 mmt -63.99 -22.8 67.08 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.014 -1.053 . . . . 0.0 109.815 -179.304 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.43 ' CB ' ' HZ1' ' A' ' 75' ' ' LYS . 7.3 ttpm? -89.42 -35.9 15.76 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.641 -1.287 . . . . 0.0 110.727 -178.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . 0.528 ' OD1' ' CE1' ' A' ' 72' ' ' HIS . 5.5 m120 -100.15 -8.95 23.05 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.027 -1.046 . . . . 0.0 112.339 -178.263 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 90.1 t -118.4 -31.56 1.74 Allowed 'Isoleucine or valine' 0 N--CA 1.513 2.684 0 O-C-N 120.497 -1.377 . . . . 0.0 111.063 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.445 ' CG ' ' O ' ' A' ' 74' ' ' MET . 17.1 p-10 -48.9 103.42 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.928 0 O-C-N 120.499 -1.375 . . . . 0.0 109.158 179.396 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -78.58 -63.55 1.38 Allowed 'General case' 0 C--N 1.298 -1.647 0 O-C-N 120.754 -1.216 . . . . 0.0 110.259 -178.518 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.445 ' ND2' ' O ' ' A' ' 80' ' ' ASN . 1.0 OUTLIER -107.98 26.91 9.79 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.142 -0.974 . . . . 0.0 109.745 179.836 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.433 ' OE1' ' OD2' ' A' ' 78' ' ' ASP . 0.2 OUTLIER 36.64 31.32 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.864 0 CA-C-O 121.203 0.525 . . . . 0.0 111.333 178.817 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.572 ' C ' ' H ' ' A' ' 84' ' ' LEU . 89.9 m-20 -87.34 15.66 6.19 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 178.681 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.469 ' CG ' ' NH1' ' A' ' 83' ' ' ARG . 6.5 mtt-85 63.17 -2.94 0.39 Allowed 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 -178.574 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.572 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.8 mp -122.73 134.12 54.46 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 179.309 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 75.6 t -112.61 129.52 68.04 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.111 0 O-C-N 121.634 -0.666 . . . . 0.0 109.407 -179.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 64.5 p -94.57 167.22 11.62 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 120.967 -1.083 . . . . 0.0 109.121 179.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.476 ' C ' ' CD1' ' A' ' 87' ' ' LEU . 1.0 OUTLIER -70.14 -38.36 75.48 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.685 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -58.94 -69.37 0.2 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.415 -0.803 . . . . 0.0 111.431 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.406 ' N ' ' CD ' ' A' ' 89' ' ' GLU . 4.9 mp0 -56.49 -32.28 64.86 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.008 -1.058 . . . . 0.0 110.497 -178.417 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -61.79 -48.93 78.42 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 120.799 -1.188 . . . . 0.0 110.135 -179.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.425 ' O ' ' N ' ' A' ' 95' ' ' GLN . 87.4 mt -51.32 -48.39 62.38 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.809 -1.182 . . . . 0.0 108.899 179.172 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -46.22 -59.88 2.64 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.4 -0.812 . . . . 0.0 110.295 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 44.1 t -48.88 -28.05 3.5 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.156 -0.965 . . . . 0.0 110.511 -179.03 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 43.9 p -96.17 -57.62 2.29 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.093 -1.004 . . . . 0.0 108.987 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.425 ' N ' ' O ' ' A' ' 91' ' ' LEU . 26.4 mt-30 -53.08 123.98 13.15 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.18 -0.95 . . . . 0.0 109.011 179.46 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.433 ' O ' ' O ' ' A' ' 97' ' ' LYS . 7.3 ttp180 -166.15 117.62 1.03 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.114 -0.991 . . . . 0.0 109.459 -179.729 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.433 ' O ' ' O ' ' A' ' 96' ' ' ARG . 66.8 mmtt 55.3 105.48 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.321 -0.862 . . . . 0.0 109.435 -179.755 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -68.35 81.3 0.25 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.176 -0.953 . . . . 0.0 109.279 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 74.5 t80 . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 118.06 -0.972 . . . . 0.0 109.432 179.959 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 59.4 mttp -144.77 91.46 2.17 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.187 -0.946 . . . . 0.0 109.356 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.469 ' C ' ' H ' ' A' ' 5' ' ' TRP . 9.0 mm-40 52.65 -174.96 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.291 -0.88 . . . . 0.0 109.471 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 26.8 m -73.6 16.08 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.246 -0.909 . . . . 0.0 109.66 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.469 ' H ' ' C ' ' A' ' 3' ' ' GLU . 3.0 t90 -67.12 -71.16 0.21 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.252 -0.905 . . . . 0.0 109.222 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 52.31 -105.78 0.24 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.209 -0.932 . . . . 0.0 109.33 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 71.8 tt0 -170.27 -42.52 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.868 -1.145 . . . . 0.0 109.468 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.492 ' O ' ' N ' ' A' ' 10' ' ' GLY . 12.9 tp -166.81 96.12 0.52 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.201 -0.937 . . . . 0.0 109.41 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.426 ' N ' ' OD1' ' A' ' 9' ' ' ASP . 17.8 p-10 -66.31 56.73 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.482 -0.761 . . . . 0.0 109.876 -179.709 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 8' ' ' LEU . . . 164.07 81.61 0.04 OUTLIER Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 63.7 tp -51.39 108.16 0.24 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.324 -1.104 . . . . 0.0 108.887 179.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -160.38 151.03 15.33 Favored Pre-proline 0 N--CA 1.493 1.72 0 O-C-N 121.152 -0.967 . . . . 0.0 109.129 -179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -57.45 -46.74 25.58 Favored 'Trans proline' 0 C--N 1.324 -0.76 0 C-N-CA 121.083 1.189 . . . . 0.0 109.918 179.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.413 ' O ' ' O ' ' A' ' 15' ' ' ARG . 15.4 m120 -154.76 66.97 0.68 Allowed 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.222 -0.924 . . . . 0.0 109.361 -179.397 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.413 ' O ' ' O ' ' A' ' 14' ' ' ASN . 55.2 mtp180 51.18 -179.68 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.159 -0.963 . . . . 0.0 109.555 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.445 ' O ' ' CD2' ' A' ' 16' ' ' PHE . 64.3 t80 -96.95 32.58 2.09 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.277 -0.889 . . . . 0.0 109.502 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.424 ' C ' HD21 ' A' ' 17' ' ' ASN . 0.4 OUTLIER -170.58 68.16 0.52 Allowed Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.168 -0.958 . . . . 0.0 109.836 -179.858 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -64.65 -23.53 63.51 Favored 'Trans proline' 0 C--N 1.318 -1.045 0 C-N-CA 121.468 1.445 . . . . 0.0 109.751 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 61.1 tttp -59.21 -40.06 84.62 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.365 -0.834 . . . . 0.0 110.937 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 52.5 m -68.3 -41.5 80.8 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 120.767 -1.208 . . . . 0.0 110.525 -178.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -55.54 -36.86 67.24 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.026 -1.046 . . . . 0.0 108.371 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -66.87 -35.61 80.42 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.46 -0.775 . . . . 0.0 110.149 -179.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 97.5 mt -71.36 -60.99 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 O-C-N 120.702 -1.249 . . . . 0.0 108.985 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 tp -46.21 -37.51 7.23 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.334 -0.854 . . . . 0.0 110.795 -179.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.524 ' O ' ' ND1' ' A' ' 25' ' ' HIS . 0.9 OUTLIER -76.28 -16.22 59.83 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.517 -1.364 . . . . 0.0 109.548 -179.943 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -79.54 94.82 5.69 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.17 -0.956 . . . . 0.0 108.891 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 18.5 mt -75.93 -52.21 18.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 O-C-N 121.322 -0.861 . . . . 0.0 110.819 -178.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.614 ' H ' ' ND2' ' A' ' 28' ' ' ASN . 0.1 OUTLIER -84.57 -2.52 57.51 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.969 -1.082 . . . . 0.0 110.032 -179.615 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.465 ' N ' HD21 ' A' ' 28' ' ' ASN . 1.4 m 57.2 53.16 8.04 Favored 'General case' 0 C--N 1.294 -1.828 0 O-C-N 121.19 -0.944 . . . . 0.0 110.345 178.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -96.21 -1.07 48.99 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.163 -0.961 . . . . 0.0 108.468 179.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 76.45 -0.09 65.45 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.46 160.35 16.94 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 O-C-N 121.262 -1.14 . . . . 0.0 108.578 178.064 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 80.3 mt -107.85 128.6 54.75 Favored 'General case' 0 N--CA 1.511 2.616 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 178.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.455 ' C ' ' H ' ' A' ' 36' ' ' GLN . 39.2 p-10 -106.58 165.02 11.59 Favored 'General case' 0 N--CA 1.501 2.086 0 CA-C-O 121.757 0.789 . . . . 0.0 110.175 -179.279 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.414 ' O ' ' OE2' ' A' ' 39' ' ' GLU . 62.6 mt-10 -52.76 -8.56 0.09 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.771 -0.581 . . . . 0.0 110.325 -179.614 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.455 ' H ' ' C ' ' A' ' 34' ' ' ASP . 3.0 mm100 -86.33 -48.88 8.1 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.812 -1.18 . . . . 0.0 109.707 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 59.3 mt-10 -71.12 -29.19 64.94 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.277 -0.889 . . . . 0.0 109.18 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.4 tp -77.83 -39.04 44.92 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.506 -0.746 . . . . 0.0 109.885 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.53 ' OE1' ' N ' ' A' ' 39' ' ' GLU . 0.2 OUTLIER -74.68 -40.37 61.43 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.847 -1.158 . . . . 0.0 109.916 179.993 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.65 -39.31 73.71 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.075 -1.016 . . . . 0.0 111.686 -178.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 41.3 tp -73.07 -25.53 60.94 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 120.833 -1.167 . . . . 0.0 110.214 -178.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 1.4 m-30 -84.82 -49.65 8.24 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 120.853 -1.154 . . . . 0.0 109.388 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 16.2 m -63.01 -34.7 78.12 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.994 -1.066 . . . . 0.0 110.054 -179.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 30.0 ttpt -70.65 -46.64 62.89 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.073 -1.017 . . . . 0.0 110.246 -179.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -56.21 -27.48 54.89 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.888 -1.132 . . . . 0.0 110.036 -179.402 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 7.2 tp -71.03 -24.29 62.33 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.978 -1.076 . . . . 0.0 109.958 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.86 2.86 28.38 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 120.875 -1.141 . . . . 0.0 109.496 179.532 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -105.57 -23.39 12.79 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.233 -0.917 . . . . 0.0 109.524 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 55.5 t -90.36 -38.07 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.265 -0.897 . . . . 0.0 109.101 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -88.06 -17.95 29.99 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.25 -0.906 . . . . 0.0 109.792 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 48.24 81.72 0.25 Allowed Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 120.7 -1.25 . . . . 0.0 110.296 178.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -60.07 179.09 0.32 Allowed 'Trans proline' 0 C--N 1.318 -1.078 0 C-N-CA 121.098 1.199 . . . . 0.0 109.513 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 9.3 mtmm -131.15 -64.81 0.8 Allowed 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.425 -0.797 . . . . 0.0 110.005 -179.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -172.26 97.53 0.16 Allowed 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.227 -0.921 . . . . 0.0 109.079 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 57.15 98.77 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.488 -0.758 . . . . 0.0 109.245 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.473 ' N ' ' CD ' ' A' ' 56' ' ' GLU . 1.5 pm0 -129.72 -168.84 2.01 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -147.05 -57.54 0.26 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.138 -0.976 . . . . 0.0 109.65 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.431 ' OD1' ' N ' ' A' ' 58' ' ' ASP . 12.8 p-10 -46.84 -30.82 2.67 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.151 -0.968 . . . . 0.0 109.717 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.409 ' C ' ' SD ' ' A' ' 59' ' ' MET . 1.5 tmt? -56.3 -34.03 66.12 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.473 -0.767 . . . . 0.0 109.027 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.414 ' C ' ' H ' ' A' ' 62' ' ' MET . 42.8 ttp180 -79.28 -44.9 20.77 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.262 -0.899 . . . . 0.0 109.138 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.427 ' O ' ' OE1' ' A' ' 64' ' ' GLU . 42.7 tt0 -54.59 -11.58 0.59 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.329 -0.857 . . . . 0.0 109.509 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.599 ' C ' ' H ' ' A' ' 64' ' ' GLU . 4.6 tpt -100.19 -6.92 25.37 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.347 -0.846 . . . . 0.0 108.998 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 14.6 pt-20 -53.97 4.64 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.188 -0.945 . . . . 0.0 111.282 -179.238 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.599 ' H ' ' C ' ' A' ' 62' ' ' MET . 20.9 mp0 -61.72 -30.8 71.0 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.63 -1.293 . . . . 0.0 110.045 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -55.23 -27.19 44.46 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.061 -1.024 . . . . 0.0 109.802 -179.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 43.5 mtm180 -70.08 -44.17 69.63 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.002 -1.061 . . . . 0.0 109.691 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 72.3 mt -57.85 -41.78 83.08 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.097 -1.002 . . . . 0.0 110.124 -178.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -70.21 -37.24 75.01 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.286 -0.884 . . . . 0.0 109.867 -179.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -82.52 -32.29 28.77 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.144 -0.972 . . . . 0.0 108.87 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 40.7 ttp180 -73.85 -49.74 23.63 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.02 -1.05 . . . . 0.0 109.915 179.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -60.58 -49.43 77.58 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.925 -1.11 . . . . 0.0 110.182 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 8.0 t60 -54.58 -36.41 64.37 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.169 -0.957 . . . . 0.0 110.259 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 69.5 t -75.5 -54.94 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 120.611 -1.306 . . . . 0.0 109.916 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.414 ' O ' ' CG ' ' A' ' 78' ' ' ASP . 4.1 mmt -63.32 -19.03 64.26 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.032 -1.043 . . . . 0.0 110.188 -179.163 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 72.7 tttt -93.43 -39.72 10.75 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.903 -1.123 . . . . 0.0 111.215 -178.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . 0.572 ' N ' HD21 ' A' ' 76' ' ' ASN . 1.0 OUTLIER -101.46 -9.47 21.05 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 121.081 -1.012 . . . . 0.0 112.33 -177.706 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 87.1 t -110.62 -35.38 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.471 0 O-C-N 120.475 -1.391 . . . . 0.0 109.692 179.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.424 ' OD2' ' OE1' ' A' ' 81' ' ' GLN . 11.9 p-10 -49.1 109.12 0.23 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.763 -1.211 . . . . 0.0 108.649 178.577 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.413 ' OG1' ' N ' ' A' ' 80' ' ' ASN . 0.1 OUTLIER -85.3 -62.54 1.51 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 120.914 -1.116 . . . . 0.0 110.397 -177.661 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.498 ' ND2' ' O ' ' A' ' 80' ' ' ASN . 0.7 OUTLIER -104.46 17.43 24.14 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.238 -0.914 . . . . 0.0 109.805 -179.557 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.424 ' OE1' ' OD2' ' A' ' 78' ' ' ASP . 0.3 OUTLIER 43.79 75.01 0.1 Allowed 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.414 -0.804 . . . . 0.0 111.013 177.967 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.582 ' C ' ' H ' ' A' ' 84' ' ' LEU . 45.8 t0 -132.33 19.44 4.4 Favored 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 107.899 -1.149 . . . . 0.0 107.899 178.525 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.513 HH11 ' CG ' ' A' ' 83' ' ' ARG . 5.1 mtt-85 59.62 -3.51 0.11 Allowed 'General case' 0 N--CA 1.491 1.621 0 CA-C-O 121.478 0.656 . . . . 0.0 109.236 -178.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.582 ' H ' ' C ' ' A' ' 82' ' ' ASP . 11.2 mt -123.39 134.96 53.93 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 179.569 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 74.4 t -110.4 128.43 66.68 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.036 0 O-C-N 121.493 -0.754 . . . . 0.0 109.124 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 60.9 p -102.37 156.54 17.52 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.264 -0.898 . . . . 0.0 109.346 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.1 tp -59.06 -39.27 81.55 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.484 -0.76 . . . . 0.0 108.955 179.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -58.8 -68.57 0.25 Allowed 'General case' 0 C--N 1.295 -1.803 0 O-C-N 121.607 -0.683 . . . . 0.0 110.993 -177.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -61.52 -30.28 70.53 Favored 'General case' 0 C--N 1.299 -1.618 0 O-C-N 121.233 -0.917 . . . . 0.0 110.717 -178.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -63.13 -51.68 65.53 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.902 -1.124 . . . . 0.0 109.68 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 78.7 mt -50.33 -45.07 54.58 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.263 -0.898 . . . . 0.0 109.376 179.466 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -51.52 -57.79 8.08 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.236 -0.915 . . . . 0.0 110.162 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 37.7 t -46.34 -34.34 4.5 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.24 -0.913 . . . . 0.0 110.518 -179.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 44.0 p -86.85 -51.68 5.93 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.003 -1.06 . . . . 0.0 109.063 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -53.46 144.24 17.43 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.053 -1.03 . . . . 0.0 108.784 179.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.521 ' NH1' ' O ' ' A' ' 98' ' ' GLU . 0.0 OUTLIER -164.11 49.93 0.13 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.027 -1.046 . . . . 0.0 109.1 -179.655 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.494 ' O ' ' N ' ' A' ' 99' ' ' PHE . 25.6 mtpt -50.04 -37.75 34.61 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 121.048 -1.032 . . . . 0.0 109.356 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.532 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 2.8 mp0 -48.41 95.01 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.165 -0.959 . . . . 0.0 109.241 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.494 ' N ' ' O ' ' A' ' 97' ' ' LYS . 65.7 m-85 . . . . . 0 N--CA 1.498 1.941 0 CA-C-O 117.957 -1.02 . . . . 0.0 110.385 -179.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.524 ' CD2' ' N ' ' A' ' 1' ' ' LEU . 3.5 mm? . . . . . 0 N--CA 1.49 1.532 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -51.06 -45.44 61.37 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.206 -0.934 . . . . 0.0 109.546 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -63.34 -178.81 0.28 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.207 -0.933 . . . . 0.0 109.543 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.5 p -59.08 157.98 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.292 -0.88 . . . . 0.0 109.446 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.439 ' O ' ' CG ' ' A' ' 5' ' ' TRP . 29.8 t90 -170.55 0.5 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.281 -0.887 . . . . 0.0 109.585 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.461 ' CD ' ' N ' ' A' ' 6' ' ' GLU . 4.4 mp0 -80.01 -158.74 0.18 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.229 -0.92 . . . . 0.0 109.53 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.482 ' CD ' ' N ' ' A' ' 7' ' ' GLU . 1.1 pm0 -164.41 17.18 0.06 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.21 -0.931 . . . . 0.0 109.249 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.3 tp -166.18 141.44 4.65 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -135.17 30.96 3.25 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.068 -1.02 . . . . 0.0 109.422 -179.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.465 ' O ' ' C ' ' A' ' 11' ' ' LEU . . . 172.73 82.69 0.05 OUTLIER Glycine 0 N--CA 1.488 2.109 0 N-CA-C 108.995 -1.642 . . . . 0.0 108.995 -179.539 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.465 ' C ' ' O ' ' A' ' 10' ' ' GLY . 18.7 tp -32.09 127.46 0.24 Allowed 'General case' 0 N--CA 1.509 2.523 0 O-C-N 122.28 -0.541 . . . . 0.0 110.603 -179.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.539 ' C ' ' H ' ' A' ' 14' ' ' ASN . 4.4 m-20 -57.73 150.54 46.77 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.153 -0.967 . . . . 0.0 109.115 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -59.79 4.22 0.17 Allowed 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 121.312 1.341 . . . . 0.0 110.506 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.552 ' CG ' ' H ' ' A' ' 15' ' ' ARG . 8.6 t-20 -127.2 -148.15 0.38 Allowed 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.552 ' H ' ' CG ' ' A' ' 14' ' ' ASN . 0.3 OUTLIER 44.53 93.27 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.656 -0.653 . . . . 0.0 109.73 179.877 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -135.17 70.28 1.44 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.423 -0.798 . . . . 0.0 109.452 -179.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.8 m120 50.76 76.1 0.58 Allowed Pre-proline 0 N--CA 1.489 1.5 0 O-C-N 121.246 -0.909 . . . . 0.0 109.556 179.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -59.48 -11.76 14.95 Favored 'Trans proline' 0 C--N 1.319 -1.006 0 C-N-CA 121.445 1.43 . . . . 0.0 110.274 -179.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 48.4 tttm -56.05 -48.22 76.43 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.337 -0.852 . . . . 0.0 110.495 179.685 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 46.2 m -59.66 -37.98 80.19 Favored 'General case' 0 C--N 1.306 -1.296 0 O-C-N 120.963 -1.086 . . . . 0.0 110.444 -178.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.401 ' CD2' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.35 -47.71 78.27 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.915 -1.116 . . . . 0.0 108.126 179.717 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.401 ' N ' ' CD2' ' A' ' 21' ' ' PHE . 20.7 t80 -54.51 -32.7 58.56 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.527 -0.733 . . . . 0.0 109.896 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.48 ' O ' ' N ' ' A' ' 25' ' ' HIS . 96.5 mt -75.04 -61.94 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.223 0 O-C-N 120.814 -1.179 . . . . 0.0 109.676 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 20.5 mt -47.74 -13.23 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.785 -1.197 . . . . 0.0 110.742 -179.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.503 ' O ' ' ND1' ' A' ' 25' ' ' HIS . 1.0 OUTLIER -104.62 -14.02 15.76 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.526 -1.359 . . . . 0.0 110.582 -179.417 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.472 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 20.6 p-10 -79.59 70.33 6.05 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 120.827 -1.17 . . . . 0.0 109.238 179.662 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 8.1 mt -50.1 -53.18 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 O-C-N 121.041 -1.037 . . . . 0.0 111.127 -179.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.671 ' H ' ' ND2' ' A' ' 28' ' ' ASN . 0.0 OUTLIER -85.85 -1.85 57.67 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.891 -1.131 . . . . 0.0 110.095 -179.412 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.415 ' OG ' ' O ' ' A' ' 28' ' ' ASN . 19.9 p 53.34 50.82 16.69 Favored 'General case' 0 C--N 1.292 -1.895 0 O-C-N 121.289 -0.882 . . . . 0.0 110.49 178.69 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -95.11 3.41 54.79 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 74.47 1.13 60.31 Favored Glycine 0 N--CA 1.489 2.213 0 N-CA-C 109.776 -1.329 . . . . 0.0 109.776 -179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.67 163.39 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.093 0 O-C-N 121.131 -1.217 . . . . 0.0 108.931 178.371 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 68.4 mt -113.7 124.83 53.24 Favored 'General case' 0 N--CA 1.513 2.709 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 178.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -105.61 163.0 13.01 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.614 -0.679 . . . . 0.0 109.931 -179.3 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -49.23 -32.29 10.34 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.418 -0.801 . . . . 0.0 111.625 -178.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -64.61 -33.06 75.05 Favored 'General case' 0 C--N 1.293 -1.877 0 O-C-N 120.558 -1.339 . . . . 0.0 109.244 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -74.34 -38.14 63.34 Favored 'General case' 0 N--CA 1.496 1.852 0 C-N-CA 119.269 -0.972 . . . . 0.0 108.831 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.9 mt -81.58 -39.18 24.96 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.141 -0.975 . . . . 0.0 109.264 178.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -59.97 -39.93 87.33 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 120.628 -1.295 . . . . 0.0 108.775 179.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.21 -29.39 62.77 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.295 -0.878 . . . . 0.0 110.369 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.403 ' CD2' ' CD ' ' A' ' 45' ' ' GLU . 0.8 OUTLIER -76.45 -24.3 53.89 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.195 -0.941 . . . . 0.0 110.289 -179.173 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -82.7 -50.5 8.65 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.672 -1.267 . . . . 0.0 109.646 -179.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 31.3 m -60.4 -41.74 94.48 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.368 -0.833 . . . . 0.0 111.233 -179.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -73.77 -47.48 38.67 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.039 -1.038 . . . . 0.0 111.808 -177.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.403 ' CD ' ' CD2' ' A' ' 41' ' ' LEU . 18.9 mt-10 -53.91 -28.04 34.26 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.446 -1.408 . . . . 0.0 109.685 -178.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.487 ' C ' ' H ' ' A' ' 48' ' ' LYS . 30.7 mt -77.05 -31.33 56.13 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.926 -1.109 . . . . 0.0 110.441 -179.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.426 ' OE1' ' O ' ' A' ' 47' ' ' GLU . 0.9 OUTLIER -62.89 1.74 0.38 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.8 -1.188 . . . . 0.0 109.627 179.887 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.487 ' H ' ' C ' ' A' ' 46' ' ' LEU . 43.1 mttt -123.9 31.05 5.95 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.188 -0.945 . . . . 0.0 109.679 179.23 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 44.6 t -148.38 -59.01 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 O-C-N 120.915 -1.116 . . . . 0.0 110.338 -179.641 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.581 ' CZ ' ' SD ' ' A' ' 62' ' ' MET . 84.2 m-85 -85.62 -18.81 32.19 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.977 -1.077 . . . . 0.0 110.358 -179.066 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.543 ' C ' ' H ' ' A' ' 53' ' ' LYS . 25.3 m-20 51.91 71.62 1.44 Allowed Pre-proline 0 N--CA 1.49 1.526 0 O-C-N 120.97 -1.081 . . . . 0.0 109.211 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -65.73 14.51 0.1 Allowed 'Trans proline' 0 C--N 1.317 -1.089 0 C-N-CA 121.753 1.635 . . . . 0.0 110.658 -179.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.543 ' H ' ' C ' ' A' ' 51' ' ' ASP . 66.6 mttm -121.42 25.85 9.18 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.451 -0.78 . . . . 0.0 109.745 -179.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -160.17 26.03 0.17 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.117 -0.989 . . . . 0.0 109.916 179.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.462 ' O ' ' C ' ' A' ' 56' ' ' GLU . 36.2 mt-10 -156.33 73.01 0.78 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.107 -0.996 . . . . 0.0 109.342 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.472 ' N ' ' CD ' ' A' ' 56' ' ' GLU . 1.4 mp0 32.8 -104.95 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.844 -0.535 . . . . 0.0 110.763 179.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.47 ' OD1' ' N ' ' A' ' 57' ' ' ASP . 10.0 p-10 -147.55 29.82 0.93 Allowed 'General case' 0 N--CA 1.496 1.832 0 O-C-N 120.996 -1.065 . . . . 0.0 109.888 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.42 ' OD1' ' N ' ' A' ' 58' ' ' ASP . 0.6 OUTLIER -71.22 -1.27 12.04 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.973 -1.08 . . . . 0.0 109.609 -179.817 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -54.19 -32.28 55.15 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.256 -0.903 . . . . 0.0 109.059 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.557 ' O ' ' N ' ' A' ' 62' ' ' MET . 99.5 mtt180 -82.1 -36.28 27.73 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.33 -0.856 . . . . 0.0 109.694 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -46.1 -12.72 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.885 -1.134 . . . . 0.0 110.25 -179.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.581 ' SD ' ' CZ ' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -122.62 4.79 9.54 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.331 -0.855 . . . . 0.0 109.639 179.878 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.438 ' CD ' HH21 ' A' ' 66' ' ' ARG . 1.4 tt0 -44.17 -16.47 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.458 -0.776 . . . . 0.0 109.471 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.547 ' N ' ' O ' ' A' ' 62' ' ' MET . 74.5 mm-40 -61.01 -24.68 66.35 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.253 -0.905 . . . . 0.0 110.139 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -72.68 -41.87 64.88 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.156 -0.965 . . . . 0.0 109.752 -179.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.438 HH21 ' CD ' ' A' ' 63' ' ' GLU . 5.9 mtm180 -50.91 -38.24 48.84 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.169 -0.957 . . . . 0.0 108.902 -179.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 64.8 mt -75.05 -28.81 60.55 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.163 -0.961 . . . . 0.0 109.422 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.473 ' HG2' HH11 ' A' ' 68' ' ' ARG . 0.0 OUTLIER -64.67 -40.69 95.85 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.112 -0.992 . . . . 0.0 109.498 -179.683 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 9.1 mtm -86.07 -50.3 7.14 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 120.988 -1.07 . . . . 0.0 109.367 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 24.8 ttt-85 -58.51 -41.71 86.05 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.915 -1.116 . . . . 0.0 110.576 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -74.9 -52.18 11.93 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 120.808 -1.183 . . . . 0.0 110.671 -179.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 17.6 t60 -54.32 -41.13 68.65 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.942 -1.099 . . . . 0.0 110.294 -179.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . 0.405 ' HA ' HD22 ' A' ' 76' ' ' ASN . 75.3 t -71.34 -49.07 50.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 120.689 -1.257 . . . . 0.0 109.522 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 16.9 mtp -67.81 -19.85 65.12 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.201 -0.937 . . . . 0.0 110.877 -179.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 35.1 pttt -88.11 -32.2 18.81 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 120.302 -1.499 . . . . 0.0 110.721 -179.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . 0.626 HD21 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -104.91 -27.07 11.93 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.104 -0.997 . . . . 0.0 112.587 -178.09 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.626 ' H ' HD21 ' A' ' 76' ' ' ASN . 40.2 t -92.61 -33.7 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 O-C-N 120.253 -1.53 . . . . 0.0 110.236 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -66.04 105.24 1.3 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.467 -1.396 . . . . 0.0 108.001 178.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.48 -54.16 5.17 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.298 -0.876 . . . . 0.0 111.417 -178.176 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.427 ' O ' ' C ' ' A' ' 81' ' ' GLN . 6.1 m120 -100.12 24.84 8.12 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.287 -0.883 . . . . 0.0 109.642 -179.438 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.427 ' C ' ' O ' ' A' ' 80' ' ' ASN . 0.9 OUTLIER 32.45 37.05 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 178.857 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.584 ' C ' ' H ' ' A' ' 84' ' ' LEU . 26.0 t0 -88.69 13.73 11.66 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 178.414 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 40.8 mtp180 61.93 -2.52 0.29 Allowed 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 -178.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.584 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.5 mp -122.92 134.53 54.36 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 106.695 -1.594 . . . . 0.0 106.695 178.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 69.0 t -112.84 129.98 67.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.049 0 O-C-N 121.687 -0.633 . . . . 0.0 110.21 -178.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 30.1 p -101.78 173.9 6.2 Favored 'General case' 0 N--CA 1.499 1.999 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.9 tp -73.14 -34.76 66.27 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.164 -0.96 . . . . 0.0 109.236 179.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -61.32 -68.24 0.33 Allowed 'General case' 0 C--N 1.293 -1.852 0 O-C-N 121.034 -1.041 . . . . 0.0 111.379 -177.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -60.01 -31.36 69.86 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.242 -0.911 . . . . 0.0 110.719 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -64.26 -52.37 59.0 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.912 -1.118 . . . . 0.0 110.136 -179.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.505 ' O ' ' N ' ' A' ' 95' ' ' GLN . 77.5 mt -49.97 -42.49 48.91 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.124 -0.985 . . . . 0.0 109.301 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -53.39 -57.64 9.92 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.297 -0.877 . . . . 0.0 110.304 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 42.9 t -48.31 -28.9 3.4 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.122 -0.986 . . . . 0.0 109.992 -179.158 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.423 ' OG1' ' N ' ' A' ' 95' ' ' GLN . 33.2 p -98.96 -65.86 0.94 Allowed 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.242 -0.911 . . . . 0.0 108.993 179.677 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.505 ' N ' ' O ' ' A' ' 91' ' ' LEU . 23.8 mt-30 -43.02 -48.87 6.1 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.392 -0.817 . . . . 0.0 110.315 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 20.6 mmm180 52.47 54.44 10.65 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.957 -1.089 . . . . 0.0 109.583 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 63.8 tttm -51.07 -24.45 3.92 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.306 -0.872 . . . . 0.0 109.465 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -74.79 93.48 2.62 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.372 -0.83 . . . . 0.0 109.585 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 118.006 -0.997 . . . . 0.0 109.424 179.999 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 24.0 mt . . . . . 0 N--CA 1.49 1.555 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -61.95 -30.51 70.97 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.282 -0.886 . . . . 0.0 109.677 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -67.46 128.94 38.3 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.193 -0.942 . . . . 0.0 109.509 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 10.6 p -169.12 134.24 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.218 -0.927 . . . . 0.0 109.483 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.419 ' CE3' ' O ' ' A' ' 5' ' ' TRP . 23.1 p-90 -87.37 66.05 8.96 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.252 -0.905 . . . . 0.0 109.633 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 54.7 tt0 -101.89 150.73 22.88 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.372 -0.83 . . . . 0.0 109.46 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.476 ' O ' ' CB ' ' A' ' 8' ' ' LEU . 7.4 tp10 66.4 169.86 0.23 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.321 -0.862 . . . . 0.0 109.013 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.476 ' CB ' ' O ' ' A' ' 7' ' ' GLU . 2.3 tp 74.15 36.71 0.66 Allowed 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.277 -0.889 . . . . 0.0 108.873 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -73.14 -24.57 60.6 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.27 -0.894 . . . . 0.0 109.576 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.444 ' O ' ' N ' ' A' ' 12' ' ' ASP . . . -77.74 -73.84 1.04 Allowed Glycine 0 N--CA 1.488 2.155 0 N-CA-C 109.211 -1.556 . . . . 0.0 109.211 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.483 ' CD2' ' N ' ' A' ' 11' ' ' LEU . 3.2 mm? -63.71 81.59 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.254 -1.144 . . . . 0.0 109.036 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.444 ' N ' ' O ' ' A' ' 10' ' ' GLY . 1.0 OUTLIER -68.76 153.43 95.93 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.208 -0.932 . . . . 0.0 108.677 179.909 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_endo -61.45 172.11 3.74 Favored 'Trans proline' 0 C--N 1.321 -0.879 0 C-N-CA 121.328 1.352 . . . . 0.0 109.618 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 -104.76 82.13 1.85 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.565 -0.71 . . . . 0.0 109.302 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.6 ptp180 -138.42 -6.68 1.54 Allowed 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.491 -0.756 . . . . 0.0 109.146 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -77.62 -109.15 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.305 -0.872 . . . . 0.0 109.499 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.661 ' N ' HD21 ' A' ' 17' ' ' ASN . 0.6 OUTLIER 45.58 65.13 6.91 Favored Pre-proline 0 N--CA 1.493 1.68 0 O-C-N 121.296 -0.878 . . . . 0.0 109.725 -179.778 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -68.3 -20.33 42.88 Favored 'Trans proline' 0 C--N 1.318 -1.066 0 C-N-CA 121.585 1.523 . . . . 0.0 110.54 -179.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -68.32 -49.42 60.48 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.176 -0.953 . . . . 0.0 111.362 -178.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.1 m -63.89 -41.34 97.74 Favored 'General case' 0 N--CA 1.485 1.283 0 O-C-N 120.723 -1.236 . . . . 0.0 110.53 -178.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.47 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.05 -39.56 72.21 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.948 -1.095 . . . . 0.0 108.357 -179.803 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.47 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 53.1 t80 -63.35 -34.0 76.76 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.188 -0.945 . . . . 0.0 110.074 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.47 ' O ' ' N ' ' A' ' 26' ' ' ASP . 97.0 mt -69.92 -59.83 3.11 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 O-C-N 120.714 -1.241 . . . . 0.0 109.099 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.7 tp -45.15 -38.91 5.6 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.325 -0.859 . . . . 0.0 110.377 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -75.15 -17.01 60.49 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 120.428 -1.42 . . . . 0.0 109.402 179.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.47 ' N ' ' O ' ' A' ' 23' ' ' ILE . 75.7 m-20 -80.02 92.25 5.57 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.094 -1.004 . . . . 0.0 109.066 179.624 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.1 mt -76.3 -45.17 35.36 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.429 0 O-C-N 121.318 -0.863 . . . . 0.0 110.635 -178.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.512 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -94.04 8.21 42.28 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.788 -1.195 . . . . 0.0 110.12 -179.626 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 54.3 p 44.67 64.16 1.45 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.152 -0.967 . . . . 0.0 110.749 178.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -104.39 4.93 33.93 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.257 -0.902 . . . . 0.0 108.914 179.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 70.93 -0.05 31.53 Favored Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -139.2 165.32 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.033 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 177.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.2 tp -106.76 110.16 22.26 Favored 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 178.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -80.55 147.87 30.61 Favored 'General case' 0 N--CA 1.498 1.93 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.305 -178.477 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -52.32 -38.52 58.78 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.45 -0.781 . . . . 0.0 110.406 -179.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.9 mm100 -64.02 -34.21 77.49 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 120.927 -1.108 . . . . 0.0 108.605 179.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -73.46 -33.86 65.08 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 179.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.2 tp -76.5 -37.22 57.12 Favored 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -72.63 -49.7 30.16 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.957 -1.089 . . . . 0.0 110.119 -179.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.17 -50.46 61.04 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.895 -1.128 . . . . 0.0 110.902 -178.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 40.2 tp -56.16 -26.03 48.92 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.075 -1.015 . . . . 0.0 110.035 -178.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -83.13 -49.3 9.64 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 120.896 -1.127 . . . . 0.0 109.379 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 30.1 m -63.37 -41.0 98.78 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 120.943 -1.098 . . . . 0.0 110.22 -179.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.9 ttpt -73.4 -49.05 29.14 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.028 -1.045 . . . . 0.0 110.982 -178.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -54.62 -26.55 33.53 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.541 -1.349 . . . . 0.0 109.088 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.494 ' C ' ' H ' ' A' ' 48' ' ' LYS . 5.7 tp -80.43 -36.07 34.2 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.468 -0.77 . . . . 0.0 109.88 -179.484 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -67.09 5.02 0.75 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 120.939 -1.101 . . . . 0.0 109.11 179.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.494 ' H ' ' C ' ' A' ' 46' ' ' LEU . 37.0 mtpt -112.72 -6.9 13.84 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.503 -0.748 . . . . 0.0 109.038 179.486 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 77.9 t -97.9 -61.27 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.3 -0.875 . . . . 0.0 108.846 179.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -67.21 -137.33 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 178.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.446 ' O ' ' NZ ' ' A' ' 53' ' ' LYS . 6.9 p-10 -166.03 67.25 1.07 Allowed Pre-proline 0 N--CA 1.49 1.526 0 O-C-N 120.923 -1.11 . . . . 0.0 109.267 -179.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -63.41 173.18 4.53 Favored 'Trans proline' 0 C--N 1.317 -1.12 0 C-N-CA 121.259 1.306 . . . . 0.0 109.814 -179.594 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.446 ' NZ ' ' O ' ' A' ' 51' ' ' ASP . 5.4 mtmm -139.07 49.53 1.85 Allowed 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.655 HD21 ' N ' ' A' ' 54' ' ' ASN . 0.9 OUTLIER 51.33 48.56 22.75 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 -179.301 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -106.55 139.19 41.41 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.697 -0.627 . . . . 0.0 109.622 -179.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -76.61 -7.46 55.29 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.184 -0.947 . . . . 0.0 109.441 179.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -143.97 94.45 2.59 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.328 -0.857 . . . . 0.0 109.697 -179.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -166.02 -22.23 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.182 -0.949 . . . . 0.0 109.544 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.494 ' O ' ' SD ' ' A' ' 62' ' ' MET . 55.0 mtp -98.87 29.93 3.58 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.33 -0.856 . . . . 0.0 109.379 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.44 ' O ' ' N ' ' A' ' 63' ' ' GLU . 98.4 mtt180 -104.59 -55.16 2.39 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.376 -0.828 . . . . 0.0 109.724 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.526 ' CD ' ' H ' ' A' ' 61' ' ' GLU . 5.2 mp0 -39.6 -42.26 1.15 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.195 -0.94 . . . . 0.0 111.416 -178.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.589 ' N ' ' SD ' ' A' ' 62' ' ' MET . 0.0 OUTLIER -83.87 6.05 22.96 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.717 -1.239 . . . . 0.0 110.481 -179.21 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.461 ' N ' ' SD ' ' A' ' 62' ' ' MET . 2.9 pp20? -45.56 -15.28 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.267 -0.896 . . . . 0.0 109.331 -179.614 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.553 ' N ' ' O ' ' A' ' 62' ' ' MET . 26.4 mm-40 -63.13 -57.6 10.03 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.519 -0.738 . . . . 0.0 109.053 178.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -64.17 -35.93 82.41 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.478 -0.764 . . . . 0.0 109.584 -179.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 24.9 ttp180 -55.69 -49.3 73.34 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.29 -0.881 . . . . 0.0 109.649 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.427 ' C ' ' CD1' ' A' ' 67' ' ' LEU . 0.5 OUTLIER -78.83 -26.85 44.22 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.19 -0.944 . . . . 0.0 109.948 -179.622 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.473 ' HG2' HH11 ' A' ' 68' ' ' ARG . 0.0 OUTLIER -65.55 -38.76 90.54 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 120.959 -1.088 . . . . 0.0 109.889 -179.452 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 9.0 mtt -85.05 -29.56 24.83 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.121 -0.987 . . . . 0.0 109.857 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -72.95 -40.86 65.03 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.861 -1.149 . . . . 0.0 110.29 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -73.02 -47.28 46.34 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 120.793 -1.192 . . . . 0.0 110.501 -179.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 35.4 t-80 -55.75 -40.87 73.13 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.147 -0.971 . . . . 0.0 110.863 -179.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 66.0 t -72.6 -54.18 16.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 120.551 -1.343 . . . . 0.0 110.126 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.7 mmt -61.11 -19.72 61.81 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.141 -0.975 . . . . 0.0 110.018 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 43.4 tttp -82.64 -40.05 21.27 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.662 -1.273 . . . . 0.0 111.399 -178.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . 0.676 HD21 ' H ' ' A' ' 77' ' ' VAL . 0.0 OUTLIER -102.91 -20.77 14.14 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 120.983 -1.073 . . . . 0.0 112.35 -177.842 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.676 ' H ' HD21 ' A' ' 76' ' ' ASN . 31.3 t -97.83 -32.02 3.91 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.391 0 O-C-N 120.455 -1.403 . . . . 0.0 110.025 -179.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -53.28 107.76 0.27 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.724 -1.235 . . . . 0.0 109.302 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -81.18 -69.11 0.63 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.339 -0.85 . . . . 0.0 112.815 -177.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.466 ' O ' ' N ' ' A' ' 82' ' ' ASP . 9.5 m120 -107.88 27.8 8.86 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 120.879 -1.138 . . . . 0.0 110.748 -177.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.503 ' C ' ' H ' ' A' ' 83' ' ' ARG . 0.3 OUTLIER 42.13 23.24 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.751 0 O-C-N 121.58 -0.7 . . . . 0.0 111.245 178.794 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.522 ' C ' ' H ' ' A' ' 84' ' ' LEU . 37.3 t0 -82.78 13.97 3.51 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 177.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.503 ' H ' ' C ' ' A' ' 81' ' ' GLN . 44.0 mtm180 64.05 -2.25 0.59 Allowed 'General case' 0 N--CA 1.486 1.363 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.797 -179.036 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.522 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.3 mt -115.46 133.57 55.9 Favored 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 179.013 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 78.1 t -109.58 130.98 61.7 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 53.8 p -107.03 153.27 22.85 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.138 -0.976 . . . . 0.0 109.81 -179.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.4 tp -55.36 -34.62 64.43 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 179.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -57.09 -69.42 0.16 Allowed 'General case' 0 C--N 1.296 -1.743 0 O-C-N 121.43 -0.794 . . . . 0.0 111.862 -178.095 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -68.97 -33.24 73.37 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.862 -1.149 . . . . 0.0 110.895 -177.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -56.38 -50.93 70.13 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 120.765 -1.21 . . . . 0.0 108.777 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 52.9 mt -51.65 -49.72 61.77 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.187 -0.945 . . . . 0.0 109.337 179.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -44.48 -46.07 9.53 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.415 -0.803 . . . . 0.0 109.85 -179.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 53.5 p -57.27 -34.97 69.19 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.363 -0.836 . . . . 0.0 109.712 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 22.2 p -94.06 -51.33 4.89 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.199 -0.938 . . . . 0.0 109.222 179.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 20.0 mm100 -68.26 124.58 23.87 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.246 -0.909 . . . . 0.0 109.422 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 23.4 mmm180 -130.72 -24.28 2.46 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.402 -0.811 . . . . 0.0 109.185 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 56.4 tttp -44.2 108.86 0.12 Allowed 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.374 -0.829 . . . . 0.0 110.101 -179.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 77.2 mt-10 -85.31 89.79 7.75 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.161 -0.962 . . . . 0.0 109.411 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 88.3 t80 . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 117.976 -1.011 . . . . 0.0 109.418 179.932 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.499 ' CD1' ' N ' ' A' ' 1' ' ' LEU . 8.6 mp . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.311 -0.625 . . . . 0.0 109.311 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 73.4 tttt 51.35 -127.33 2.39 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.299 -0.876 . . . . 0.0 109.405 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -68.6 116.71 9.44 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.155 -0.966 . . . . 0.0 109.488 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 26.1 t -75.54 -8.86 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.227 -0.921 . . . . 0.0 109.492 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 90.3 t90 -144.17 134.71 24.75 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.247 -0.908 . . . . 0.0 109.321 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -167.93 111.96 0.65 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.215 -0.928 . . . . 0.0 109.357 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -167.53 137.38 2.78 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.222 -0.923 . . . . 0.0 109.79 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.9 tp -105.01 -31.68 9.09 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.565 -0.709 . . . . 0.0 109.191 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 -68.84 76.01 0.3 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.221 -0.925 . . . . 0.0 109.532 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -149.35 58.65 0.45 Allowed Glycine 0 N--CA 1.495 2.587 0 N-CA-C 109.576 -1.409 . . . . 0.0 109.576 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 35.5 mt 46.11 53.39 9.32 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.286 -1.126 . . . . 0.0 109.809 179.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.98 152.64 76.5 Favored Pre-proline 0 N--CA 1.489 1.521 0 O-C-N 121.187 -0.946 . . . . 0.0 108.698 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -54.94 -42.92 64.45 Favored 'Trans proline' 0 C--N 1.321 -0.894 0 C-N-CA 120.989 1.126 . . . . 0.0 109.62 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -84.52 44.08 1.02 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.237 -0.914 . . . . 0.0 109.223 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.53 HH11 ' CG ' ' A' ' 15' ' ' ARG . 0.3 OUTLIER -53.56 133.74 41.14 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.378 -0.827 . . . . 0.0 109.623 -179.947 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -170.14 -36.38 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.295 -0.878 . . . . 0.0 109.451 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.403 ' OD1' ' OG1' ' A' ' 20' ' ' THR . 5.8 t-20 50.22 68.6 3.27 Favored Pre-proline 0 N--CA 1.49 1.549 0 O-C-N 121.26 -0.9 . . . . 0.0 109.68 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -63.9 -21.97 68.81 Favored 'Trans proline' 0 C--N 1.318 -1.051 0 C-N-CA 121.402 1.401 . . . . 0.0 109.895 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -58.26 -37.38 74.83 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.165 -0.959 . . . . 0.0 110.801 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.403 ' OG1' ' OD1' ' A' ' 17' ' ' ASN . 52.7 m -71.52 -40.98 69.75 Favored 'General case' 0 C--N 1.307 -1.263 0 O-C-N 120.742 -1.224 . . . . 0.0 110.565 -178.568 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -55.85 -35.16 66.12 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.88 -1.137 . . . . 0.0 107.969 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -68.2 -33.3 74.18 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.423 -0.798 . . . . 0.0 109.268 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.505 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 96.7 mt -73.13 -61.51 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.217 0 O-C-N 120.882 -1.136 . . . . 0.0 108.992 179.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -44.37 -27.69 0.46 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.889 -1.132 . . . . 0.0 110.725 -179.644 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.665 ' N ' ' HD1' ' A' ' 25' ' ' HIS . 0.2 OUTLIER -90.21 -13.73 34.91 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.142 -1.599 . . . . 0.0 110.31 179.887 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.505 ' OD1' ' O ' ' A' ' 23' ' ' ILE . 20.3 p-10 -74.45 62.37 0.99 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.779 -1.2 . . . . 0.0 109.553 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 64.4 mt -48.83 -52.06 10.48 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 O-C-N 120.929 -1.107 . . . . 0.0 110.977 -179.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.523 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -90.1 12.47 17.71 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.818 -1.176 . . . . 0.0 110.056 -179.459 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.402 ' C ' ' O ' ' A' ' 28' ' ' ASN . 26.5 p 42.23 50.91 4.55 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.261 -0.9 . . . . 0.0 110.699 178.683 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.408 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 10.9 t70 -95.04 -3.89 47.45 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.03 -1.044 . . . . 0.0 108.53 179.365 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.61 4.51 87.72 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 -179.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.78 164.19 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 O-C-N 121.177 -1.19 . . . . 0.0 108.876 178.521 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.0 mp -115.43 121.06 41.61 Favored 'General case' 0 N--CA 1.518 2.934 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 177.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.544 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 0.2 OUTLIER -105.68 172.91 6.55 Favored 'General case' 0 N--CA 1.505 2.286 0 CA-C-O 121.766 0.794 . . . . 0.0 111.108 -177.82 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -53.92 -40.6 66.84 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.493 -0.755 . . . . 0.0 112.156 -178.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.493 ' NE2' ' C ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -61.88 -24.45 66.94 Favored 'General case' 0 C--N 1.295 -1.764 0 O-C-N 120.161 -1.587 . . . . 0.0 108.717 -179.799 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -81.09 -40.89 23.41 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.12 -0.987 . . . . 0.0 109.653 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.49 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 6.4 mt -75.81 -30.41 59.02 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.885 -1.134 . . . . 0.0 108.716 178.544 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -60.72 -46.2 91.32 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 120.887 -1.133 . . . . 0.0 108.699 178.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.44 -29.58 62.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.455 -0.778 . . . . 0.0 110.706 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -72.67 -25.76 61.38 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.057 -1.027 . . . . 0.0 110.248 -178.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.49 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 38.1 m-85 -80.67 -49.27 11.45 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 120.862 -1.149 . . . . 0.0 109.732 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 28.2 m -59.39 -48.7 80.65 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.142 -0.974 . . . . 0.0 111.266 -178.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 12.8 ptpt -66.71 -41.26 88.24 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.811 -1.181 . . . . 0.0 111.674 -177.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -56.86 -28.22 61.45 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 120.304 -1.498 . . . . 0.0 108.466 -179.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.4 mt -85.9 -26.38 25.63 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.363 -0.836 . . . . 0.0 110.163 179.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.5 1.17 1.26 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 120.966 -1.084 . . . . 0.0 110.552 -178.633 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.3 pttp -120.87 42.15 3.11 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.289 -0.882 . . . . 0.0 110.873 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -171.77 -38.45 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 120.669 -1.27 . . . . 0.0 110.6 178.057 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -95.07 -12.23 26.91 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.839 -1.163 . . . . 0.0 109.556 -179.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.579 ' C ' ' H ' ' A' ' 53' ' ' LYS . 0.5 OUTLIER 50.58 75.86 0.61 Allowed Pre-proline 0 N--CA 1.49 1.548 0 O-C-N 121.086 -1.009 . . . . 0.0 109.661 179.618 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -65.82 13.39 0.12 Allowed 'Trans proline' 0 C--N 1.318 -1.051 0 C-N-CA 121.612 1.541 . . . . 0.0 110.367 -179.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.579 ' H ' ' C ' ' A' ' 51' ' ' ASP . 5.1 mtmp? -107.21 -31.68 8.13 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.489 -0.757 . . . . 0.0 109.403 179.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.418 ' OD1' ' O ' ' A' ' 51' ' ' ASP . 52.2 p30 -66.6 12.33 0.07 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.375 -0.828 . . . . 0.0 109.951 179.533 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.604 ' O ' ' N ' ' A' ' 57' ' ' ASP . 36.2 mt-10 49.82 -147.48 0.33 Allowed 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.0 -1.063 . . . . 0.0 109.505 179.462 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 56.83 -70.76 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.94 -0.475 . . . . 0.0 110.076 179.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.662 ' C ' ' H ' ' A' ' 59' ' ' MET . 25.3 t70 -76.52 81.0 3.21 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.113 -0.992 . . . . 0.0 109.442 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -56.62 12.17 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.565 -0.709 . . . . 0.0 110.77 -179.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.662 ' H ' ' C ' ' A' ' 57' ' ' ASP . 68.8 mmm 56.4 16.26 2.36 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.082 -1.011 . . . . 0.0 109.296 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 28.7 ttm180 -97.42 -49.61 4.84 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.452 -0.78 . . . . 0.0 109.155 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -55.58 -50.91 68.83 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.996 -1.065 . . . . 0.0 110.588 -179.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.529 ' O ' ' N ' ' A' ' 64' ' ' GLU . 0.2 OUTLIER -72.2 -3.97 26.57 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.994 -1.066 . . . . 0.0 110.929 -178.548 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.428 ' C ' ' O ' ' A' ' 62' ' ' MET . 15.4 pt-20 -38.09 -26.13 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.662 -0.649 . . . . 0.0 110.296 -179.636 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.529 ' N ' ' O ' ' A' ' 62' ' ' MET . 75.5 mm-40 -56.41 -24.0 41.96 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.285 -0.884 . . . . 0.0 109.457 179.447 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -76.88 -46.48 24.38 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.209 -0.932 . . . . 0.0 109.775 -179.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 37.4 mtm180 -52.95 -45.14 67.57 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.155 -0.966 . . . . 0.0 108.983 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 30.1 mt -68.92 -27.67 65.97 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.203 -0.936 . . . . 0.0 109.586 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.3 -41.04 94.5 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.289 -0.882 . . . . 0.0 109.526 -179.62 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.9 mtt -85.8 -50.11 7.4 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.944 -1.098 . . . . 0.0 109.382 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.531 ' CG ' HH11 ' A' ' 70' ' ' ARG . 0.9 OUTLIER -56.1 -45.16 79.55 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.027 -1.045 . . . . 0.0 110.669 -179.703 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -75.55 -52.36 10.8 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.0 -1.063 . . . . 0.0 111.146 -178.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.515 ' O ' ' ND2' ' A' ' 76' ' ' ASN . 13.8 t60 -55.49 -39.77 70.86 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.062 -1.024 . . . . 0.0 110.455 -179.249 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 72.1 t -71.87 -53.79 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 120.654 -1.279 . . . . 0.0 109.782 -179.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.439 ' O ' ' OD1' ' A' ' 78' ' ' ASP . 3.0 mmt -64.67 -15.5 61.41 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.242 -0.911 . . . . 0.0 110.335 -179.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -93.86 -38.78 11.05 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.719 -1.238 . . . . 0.0 111.084 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . 0.636 HD21 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -100.61 -26.24 13.89 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 120.947 -1.096 . . . . 0.0 112.039 -178.178 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.636 ' H ' HD21 ' A' ' 76' ' ' ASN . 40.3 t -90.63 -36.14 7.97 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.279 0 O-C-N 120.268 -1.52 . . . . 0.0 109.197 179.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.439 ' OD1' ' O ' ' A' ' 74' ' ' MET . 10.0 p-10 -49.27 109.49 0.27 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.808 -1.182 . . . . 0.0 108.659 178.534 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.427 ' OG1' ' N ' ' A' ' 80' ' ' ASN . 0.1 OUTLIER -86.94 -64.18 1.19 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.994 -1.066 . . . . 0.0 110.318 -177.567 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.72 ' H ' HD21 ' A' ' 80' ' ' ASN . 0.1 OUTLIER -102.41 16.28 26.73 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.244 -0.91 . . . . 0.0 109.574 -179.651 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.43 ' OE1' ' OD2' ' A' ' 78' ' ' ASP . 0.4 OUTLIER 42.96 74.0 0.13 Allowed 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.495 -0.753 . . . . 0.0 111.09 178.127 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.583 ' C ' ' H ' ' A' ' 84' ' ' LEU . 38.9 t0 -129.45 18.36 5.84 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 178.313 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 78.2 mtt180 61.88 -4.71 0.18 Allowed 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 -178.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.583 ' H ' ' C ' ' A' ' 82' ' ' ASP . 9.8 mt -124.26 134.45 53.23 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 75.0 t -109.91 129.42 64.87 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.529 -0.732 . . . . 0.0 109.083 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 65.4 p -101.79 162.15 13.13 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.195 -0.941 . . . . 0.0 109.187 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.8 tp -63.8 -37.64 88.12 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -58.33 -68.72 0.23 Allowed 'General case' 0 C--N 1.293 -1.872 0 O-C-N 121.468 -0.77 . . . . 0.0 110.894 -178.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -61.95 -30.55 70.99 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.324 -0.86 . . . . 0.0 110.863 -178.368 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -64.26 -51.6 62.8 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.763 -1.21 . . . . 0.0 109.539 -179.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.485 ' O ' ' N ' ' A' ' 95' ' ' GLN . 67.4 mt -49.12 -44.31 42.26 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.224 -0.923 . . . . 0.0 109.224 179.399 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -51.16 -58.81 5.15 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.326 -0.859 . . . . 0.0 110.054 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 43.2 t -45.61 -29.99 1.38 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.135 -0.978 . . . . 0.0 109.968 -179.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 29.9 p -95.86 -58.61 2.05 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.241 -0.912 . . . . 0.0 108.856 179.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.485 ' N ' ' O ' ' A' ' 91' ' ' LEU . 2.9 tt0 -41.59 -48.55 4.04 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.544 -0.723 . . . . 0.0 110.472 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.418 ' HE ' ' CA ' ' A' ' 96' ' ' ARG . 0.0 OUTLIER -55.96 87.87 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.841 -1.162 . . . . 0.0 109.536 -179.861 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.484 ' N ' ' O ' ' A' ' 95' ' ' GLN . 88.6 tttt -45.53 113.18 0.55 Allowed 'General case' 0 N--CA 1.486 1.354 0 O-C-N 121.268 -0.895 . . . . 0.0 109.843 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 54.5 tt0 -58.34 92.77 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.169 -0.957 . . . . 0.0 109.524 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 69.9 t80 . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 118.0 -1.0 . . . . 0.0 109.412 179.864 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 17.1 mt . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 54.9 mttp -148.55 67.81 1.07 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.266 -0.896 . . . . 0.0 109.345 -179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -168.64 134.37 1.75 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.301 -0.874 . . . . 0.0 109.322 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 23.2 t -147.02 -20.01 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 O-C-N 121.293 -0.88 . . . . 0.0 109.418 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 72.7 t-105 -56.57 113.32 1.57 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.181 -0.95 . . . . 0.0 109.388 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -78.79 53.04 1.3 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.308 -0.87 . . . . 0.0 109.633 -179.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.446 ' CD ' HH22 ' A' ' 15' ' ' ARG . 43.1 mt-10 52.62 -163.43 0.08 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.3 -0.875 . . . . 0.0 109.14 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.7 pp -159.04 133.63 7.98 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.22 -0.925 . . . . 0.0 109.492 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -89.46 77.96 7.21 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.218 -0.926 . . . . 0.0 109.624 -179.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -163.86 -28.01 0.02 OUTLIER Glycine 0 N--CA 1.491 2.319 0 C-N-CA 119.621 -1.276 . . . . 0.0 109.951 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.3 mt -149.23 60.48 1.04 Allowed 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.21 -1.171 . . . . 0.0 108.685 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -74.85 148.99 85.32 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 120.981 -1.074 . . . . 0.0 109.307 -179.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_endo -62.62 -37.69 55.94 Favored 'Trans proline' 0 C--N 1.324 -0.741 0 C-N-CA 121.199 1.266 . . . . 0.0 109.715 179.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.546 ' CG ' ' H ' ' A' ' 15' ' ' ARG . 19.0 t30 -140.21 -114.56 0.14 Allowed 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.404 -0.81 . . . . 0.0 109.293 -179.212 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.546 ' H ' ' CG ' ' A' ' 14' ' ' ASN . 97.4 mtt180 52.95 -173.28 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.644 -1.285 . . . . 0.0 109.513 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -62.83 156.56 23.69 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.31 -0.869 . . . . 0.0 109.993 -179.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.488 ' N ' ' ND2' ' A' ' 17' ' ' ASN . 0.1 OUTLIER -159.75 66.38 2.73 Favored Pre-proline 0 N--CA 1.491 1.602 0 O-C-N 121.305 -0.872 . . . . 0.0 109.295 179.633 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -64.82 -17.19 58.74 Favored 'Trans proline' 0 C--N 1.318 -1.066 0 C-N-CA 121.535 1.49 . . . . 0.0 110.299 -179.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 43.4 tttm -57.48 -36.84 71.98 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.247 -0.908 . . . . 0.0 110.767 -179.269 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.4 m -69.13 -39.37 78.92 Favored 'General case' 0 C--N 1.306 -1.291 0 O-C-N 120.804 -1.185 . . . . 0.0 110.091 -179.125 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.419 ' CE2' ' CD2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -56.72 -40.5 75.78 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.091 -1.006 . . . . 0.0 108.508 -179.951 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -64.11 -36.28 83.51 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.358 -0.839 . . . . 0.0 110.583 -179.318 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.415 ' O ' ' N ' ' A' ' 26' ' ' ASP . 84.0 mt -73.96 -61.33 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.247 0 O-C-N 120.71 -1.244 . . . . 0.0 109.323 -179.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 34.9 tp -46.31 -30.78 2.2 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.098 -1.001 . . . . 0.0 110.743 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.515 ' N ' ' HD1' ' A' ' 25' ' ' HIS . 1.1 m80 -84.75 -14.73 47.38 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.27 -1.519 . . . . 0.0 109.424 179.537 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.415 ' N ' ' O ' ' A' ' 23' ' ' ILE . 95.0 m-20 -74.81 94.18 2.73 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.151 -0.968 . . . . 0.0 108.895 179.131 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 25.7 mt -76.64 -51.6 18.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.346 0 O-C-N 121.414 -0.804 . . . . 0.0 110.964 -178.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.52 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.9 OUTLIER -87.65 7.91 27.81 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 120.753 -1.217 . . . . 0.0 110.03 -179.494 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 24.8 p 44.03 48.88 7.41 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.165 -0.959 . . . . 0.0 110.528 178.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.511 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 19.6 p-10 -91.98 0.01 57.48 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.128 -0.982 . . . . 0.0 108.489 179.1 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 79.28 -2.77 69.51 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 109.791 -1.324 . . . . 0.0 109.791 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -138.61 164.16 26.83 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 O-C-N 121.286 -1.126 . . . . 0.0 108.673 178.374 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.7 tp -113.92 110.04 19.46 Favored 'General case' 0 N--CA 1.511 2.576 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 177.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.72 -176.09 5.13 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.472 -0.768 . . . . 0.0 110.751 -177.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -73.46 -44.49 57.96 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.523 -0.736 . . . . 0.0 111.372 -178.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.51 ' NE2' ' C ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -59.29 -25.0 63.75 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 120.455 -1.403 . . . . 0.0 108.323 -179.768 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -85.02 -33.68 22.47 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 179.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.4 tp -74.65 -32.27 62.22 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.42 -0.8 . . . . 0.0 109.283 179.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.24 -46.51 60.9 Favored 'General case' 0 C--N 1.305 -1.342 0 O-C-N 121.28 -0.888 . . . . 0.0 109.733 -179.524 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.53 -35.51 73.2 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.103 -0.998 . . . . 0.0 110.514 -179.305 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.6 mt -69.3 -25.76 64.39 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.938 -1.101 . . . . 0.0 109.325 -179.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.412 ' CZ ' ' SD ' ' A' ' 69' ' ' MET . 0.1 OUTLIER -81.58 -51.81 7.86 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 120.881 -1.137 . . . . 0.0 109.781 -179.13 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 68.6 m -69.4 -47.08 65.29 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.218 -0.926 . . . . 0.0 111.345 -178.392 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 18.4 ttpt -74.6 -47.5 32.01 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.018 -1.051 . . . . 0.0 111.811 -177.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -57.22 -29.38 63.69 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.224 -1.548 . . . . 0.0 109.708 -179.044 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.503 ' C ' ' H ' ' A' ' 48' ' ' LYS . 12.6 tp -71.87 -24.1 61.62 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.232 -0.918 . . . . 0.0 109.844 -179.58 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -56.48 -5.48 0.21 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.297 -0.877 . . . . 0.0 109.232 179.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.503 ' H ' ' C ' ' A' ' 46' ' ' LEU . 39.2 mttp -108.65 37.36 2.54 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.368 -0.833 . . . . 0.0 109.86 -179.516 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 85.3 t -151.01 -60.09 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 O-C-N 121.04 -1.038 . . . . 0.0 109.67 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 40.8 m-85 -79.71 -20.32 46.75 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.14 -0.975 . . . . 0.0 109.753 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 48.81 73.73 0.94 Allowed Pre-proline 0 N--CA 1.493 1.695 0 O-C-N 120.76 -1.212 . . . . 0.0 109.554 179.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -60.78 174.59 1.62 Allowed 'Trans proline' 0 C--N 1.315 -1.207 0 C-N-CA 121.308 1.339 . . . . 0.0 110.026 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.512 ' CG ' ' H ' ' A' ' 54' ' ' ASN . 0.0 OUTLIER -150.46 -90.55 0.07 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.546 -0.721 . . . . 0.0 109.224 -179.816 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.522 ' ND2' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -165.75 90.46 0.46 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.185 -0.947 . . . . 0.0 109.447 -179.937 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -143.5 -177.86 5.6 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.285 -0.884 . . . . 0.0 109.492 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 80.0 mt-10 -81.54 -13.2 58.37 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.323 -0.861 . . . . 0.0 109.789 -179.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.533 ' O ' ' N ' ' A' ' 59' ' ' MET . 77.2 m-20 -102.53 44.81 0.99 Allowed 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.315 -0.866 . . . . 0.0 109.135 179.791 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -42.78 90.26 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.684 -0.635 . . . . 0.0 110.741 -179.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.533 ' N ' ' O ' ' A' ' 57' ' ' ASP . 61.2 mtp 53.3 50.37 17.73 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.548 -0.72 . . . . 0.0 109.104 -179.717 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.575 ' O ' ' N ' ' A' ' 62' ' ' MET . 42.2 ttm180 -122.55 -59.56 1.61 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.67 -0.644 . . . . 0.0 109.394 -179.58 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -41.54 -16.54 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.092 -1.005 . . . . 0.0 111.193 -178.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.575 ' N ' ' O ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -116.3 3.44 13.37 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.239 -0.913 . . . . 0.0 110.122 179.794 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.493 ' N ' ' SD ' ' A' ' 62' ' ' MET . 1.8 tt0 -42.8 -17.77 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.438 -0.789 . . . . 0.0 109.674 -178.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 62' ' ' MET . 50.9 mt-10 -59.37 -56.74 18.15 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.309 -0.87 . . . . 0.0 109.175 179.104 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -58.3 -38.38 76.94 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.27 -0.894 . . . . 0.0 109.675 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.411 ' CG ' HH11 ' A' ' 66' ' ' ARG . 0.0 OUTLIER -53.51 -51.8 61.64 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.361 -0.837 . . . . 0.0 109.915 -179.767 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.423 ' C ' ' CD1' ' A' ' 67' ' ' LEU . 0.6 OUTLIER -79.68 -27.34 40.78 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.228 -0.92 . . . . 0.0 110.037 -179.149 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -62.05 -39.27 91.8 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.98 -1.075 . . . . 0.0 109.883 -179.347 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' MET . . . . . 0.412 ' SD ' ' CZ ' ' A' ' 42' ' ' PHE . 17.8 ttm -86.11 -33.02 21.02 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.05 -1.031 . . . . 0.0 109.859 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 66.4 ttt180 -65.07 -30.33 71.28 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.593 -1.317 . . . . 0.0 109.363 179.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 67.0 mt-10 -77.81 -48.18 17.14 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.205 -0.934 . . . . 0.0 109.975 -179.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.519 ' CD2' ' OD1' ' A' ' 76' ' ' ASN . 29.4 t60 -59.63 -35.15 73.81 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.16 -0.962 . . . . 0.0 110.007 -179.488 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 69.6 t -74.47 -54.17 15.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 120.708 -1.245 . . . . 0.0 109.381 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.486 ' SD ' ' OD2' ' A' ' 78' ' ' ASP . 2.7 mmt -58.78 -22.41 58.15 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.087 -1.008 . . . . 0.0 109.298 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.8 ttpt -94.4 -27.66 15.93 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.801 -1.187 . . . . 0.0 110.759 -179.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . 0.519 ' OD1' ' CD2' ' A' ' 72' ' ' HIS . 12.9 m120 -105.95 -12.1 15.94 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.159 -0.963 . . . . 0.0 112.643 -177.897 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 57.3 t -118.13 -34.86 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.533 0 O-C-N 120.372 -1.455 . . . . 0.0 111.397 -178.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.486 ' OD2' ' SD ' ' A' ' 74' ' ' MET . 0.9 OUTLIER -67.15 99.48 0.68 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.241 -1.537 . . . . 0.0 107.574 178.929 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -80.77 -52.25 7.73 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.213 -0.93 . . . . 0.0 111.891 -177.476 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.529 ' O ' ' N ' ' A' ' 82' ' ' ASP . 9.5 t-20 -99.63 24.1 8.69 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.061 -1.024 . . . . 0.0 109.532 -179.406 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.473 ' C ' ' H ' ' A' ' 83' ' ' ARG . 0.9 OUTLIER 32.95 30.51 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.754 0 CA-C-O 120.985 0.421 . . . . 0.0 112.062 178.697 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.552 ' C ' ' H ' ' A' ' 84' ' ' LEU . 87.0 m-20 -81.03 10.6 4.95 Favored 'General case' 0 C--N 1.299 -1.613 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 178.406 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.473 ' H ' ' C ' ' A' ' 81' ' ' GLN . 25.3 mtp180 65.12 -4.03 0.55 Allowed 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 -178.391 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.552 ' H ' ' C ' ' A' ' 82' ' ' ASP . 4.6 mp -118.48 134.47 55.05 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 178.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 88.9 t -112.3 129.39 67.91 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.076 0 O-C-N 121.617 -0.677 . . . . 0.0 109.541 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 22.0 p -103.36 167.22 9.95 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.262 -0.898 . . . . 0.0 108.722 178.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.464 ' C ' ' CD1' ' A' ' 87' ' ' LEU . 1.2 tm? -65.15 -35.47 81.21 Favored 'General case' 0 C--N 1.297 -1.705 0 O-C-N 121.383 -0.823 . . . . 0.0 108.782 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -61.75 -70.06 0.21 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.946 -1.096 . . . . 0.0 112.811 -178.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -59.37 -32.66 70.33 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.773 -1.204 . . . . 0.0 110.914 -177.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -58.83 -50.92 72.16 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.92 -1.113 . . . . 0.0 109.901 -179.366 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.434 ' O ' ' N ' ' A' ' 95' ' ' GLN . 78.7 mt -52.78 -48.94 66.49 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 120.924 -1.11 . . . . 0.0 109.602 179.472 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -46.66 -44.69 18.7 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.27 -0.894 . . . . 0.0 110.077 -179.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 46.5 m -62.41 -30.66 71.38 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.279 -0.888 . . . . 0.0 110.266 -179.309 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.554 ' HG1' ' N ' ' A' ' 95' ' ' GLN . 44.6 p -95.94 -57.6 2.32 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.018 -1.051 . . . . 0.0 109.081 179.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.554 ' N ' ' HG1' ' A' ' 94' ' ' THR . 27.7 mt-30 -50.99 118.17 3.01 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.176 -0.953 . . . . 0.0 109.187 179.6 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -169.21 55.39 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.197 -0.939 . . . . 0.0 109.138 -179.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 87.3 mttt 52.61 40.53 30.23 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.291 -0.881 . . . . 0.0 109.343 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 54.18 59.95 3.89 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.259 -0.9 . . . . 0.0 109.335 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.445 ' CD2' ' O ' ' A' ' 99' ' ' PHE . 61.5 t80 . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 117.979 -1.01 . . . . 0.0 109.534 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.463 ' CD1' ' N ' ' A' ' 1' ' ' LEU . 9.4 mp . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -80.67 83.48 6.43 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.194 -0.942 . . . . 0.0 109.472 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.443 ' CD ' ' N ' ' A' ' 3' ' ' GLU . 5.9 mp0 -64.37 -166.16 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.251 -0.906 . . . . 0.0 109.471 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 37.1 t -56.45 -34.72 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.164 -0.96 . . . . 0.0 109.425 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 66.5 m95 -60.7 163.63 5.37 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.319 -0.863 . . . . 0.0 109.484 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -168.42 96.24 0.4 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.163 -0.96 . . . . 0.0 109.454 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 53.0 -109.66 0.49 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.425 -0.797 . . . . 0.0 109.087 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.498 ' C ' ' H ' ' A' ' 10' ' ' GLY . 0.4 OUTLIER -153.39 36.49 0.47 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.247 -0.908 . . . . 0.0 109.488 179.783 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 65.6 -4.51 0.58 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.411 -0.806 . . . . 0.0 109.403 -179.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.498 ' H ' ' C ' ' A' ' 8' ' ' LEU . . . 59.73 60.13 9.28 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 17.1 mt -70.56 51.61 0.13 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.258 -1.142 . . . . 0.0 108.88 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.42 ' N ' ' O ' ' A' ' 10' ' ' GLY . 35.5 t0 -170.22 70.98 0.6 Allowed Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.339 -0.851 . . . . 0.0 108.81 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.447 ' O ' ' N ' ' A' ' 15' ' ' ARG . 3.2 Cg_exo -57.23 -16.03 20.62 Favored 'Trans proline' 0 C--N 1.315 -1.189 0 C-N-CA 121.197 1.265 . . . . 0.0 110.241 -178.187 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.446 ' O ' ' ND2' ' A' ' 14' ' ' ASN . 0.3 OUTLIER -68.37 68.19 0.13 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.259 -0.901 . . . . 0.0 109.359 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.447 ' N ' ' O ' ' A' ' 13' ' ' PRO . 33.9 ptt180 -158.31 -158.73 0.74 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.346 -0.846 . . . . 0.0 109.404 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.404 ' O ' ' O ' ' A' ' 15' ' ' ARG . 83.4 m-85 -54.96 -172.29 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.245 -0.909 . . . . 0.0 109.636 -179.89 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.45 ' C ' HD21 ' A' ' 17' ' ' ASN . 0.4 OUTLIER 49.07 63.17 10.86 Favored Pre-proline 0 N--CA 1.49 1.569 0 O-C-N 121.33 -0.856 . . . . 0.0 110.059 -179.695 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -65.93 -21.92 56.44 Favored 'Trans proline' 0 C--N 1.319 -0.975 0 C-N-CA 121.588 1.525 . . . . 0.0 110.033 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 69.7 tttt -57.3 -35.85 70.35 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.216 -0.928 . . . . 0.0 110.887 -179.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.4 m -71.01 -41.24 71.15 Favored 'General case' 0 C--N 1.306 -1.303 0 O-C-N 120.785 -1.197 . . . . 0.0 110.272 -178.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.482 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.37 -36.91 69.36 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.042 -1.036 . . . . 0.0 108.487 -179.835 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.482 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 36.4 t80 -67.15 -34.81 78.37 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.335 -0.853 . . . . 0.0 110.135 -179.614 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.1 mt -74.54 -61.18 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.241 0 O-C-N 120.731 -1.23 . . . . 0.0 109.39 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.3 tp -46.57 -37.57 8.24 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.066 -1.021 . . . . 0.0 110.811 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.523 ' N ' ' HD1' ' A' ' 25' ' ' HIS . 0.6 OUTLIER -75.99 -18.26 59.37 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.367 -1.458 . . . . 0.0 109.709 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -75.98 90.67 3.01 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.131 -0.981 . . . . 0.0 108.783 179.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 13.9 mt -71.23 -52.26 28.28 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 O-C-N 121.319 -0.863 . . . . 0.0 110.801 -178.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.525 HD21 ' N ' ' A' ' 28' ' ' ASN . 1.8 m120 -84.08 11.6 7.72 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.831 -1.168 . . . . 0.0 109.83 -179.83 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.445 ' OG ' ' O ' ' A' ' 29' ' ' SER . 10.0 t 43.88 43.76 5.41 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.222 -0.924 . . . . 0.0 110.373 178.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -87.35 -3.41 59.03 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.009 -1.057 . . . . 0.0 108.819 179.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.38 -0.34 75.42 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -142.42 161.5 19.2 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 O-C-N 121.196 -1.179 . . . . 0.0 108.783 178.621 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.6 mp -113.12 131.74 55.72 Favored 'General case' 0 N--CA 1.517 2.91 0 N-CA-C 107.764 -1.198 . . . . 0.0 107.764 177.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 39.8 p-10 -106.51 174.2 5.99 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 121.371 -0.831 . . . . 0.0 109.934 -179.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -59.63 -7.69 1.63 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.431 -0.793 . . . . 0.0 110.088 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.9 mm100 -85.29 -40.22 16.83 Favored 'General case' 0 C--N 1.297 -1.706 0 O-C-N 121.052 -1.03 . . . . 0.0 109.845 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -67.79 -33.03 74.01 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.157 -0.964 . . . . 0.0 109.56 -179.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.459 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 1.4 mt -80.45 -38.48 29.95 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.958 -1.089 . . . . 0.0 109.38 179.192 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.49 ' OE1' ' N ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -59.76 -41.81 91.88 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.882 -1.137 . . . . 0.0 108.794 179.481 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.07 -29.21 61.76 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.236 -0.915 . . . . 0.0 111.142 -179.204 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -76.76 -26.63 54.75 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 120.896 -1.127 . . . . 0.0 110.819 -178.654 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.459 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 28.9 m-85 -80.49 -49.19 11.71 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 120.42 -1.425 . . . . 0.0 108.929 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 53.5 m -64.04 -39.35 93.9 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.245 -0.909 . . . . 0.0 110.277 -179.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 28.2 ttpt -74.92 -47.58 28.98 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.199 -0.938 . . . . 0.0 111.404 -178.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -53.68 -28.86 36.01 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.719 -1.238 . . . . 0.0 109.849 -178.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 21.1 mt -78.13 -24.63 47.32 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.119 -0.988 . . . . 0.0 109.973 -179.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -78.09 -2.6 38.14 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 120.828 -1.17 . . . . 0.0 110.272 -179.087 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.507 ' CB ' ' NZ ' ' A' ' 48' ' ' LYS . 6.4 mtmp? -113.57 26.05 10.73 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.072 -1.018 . . . . 0.0 109.891 -179.519 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 57.3 t -149.14 -48.14 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 121.11 -0.994 . . . . 0.0 109.654 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.578 ' CZ ' ' SD ' ' A' ' 62' ' ' MET . 68.7 m-85 -83.48 -24.85 31.59 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.972 -1.08 . . . . 0.0 109.214 179.714 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 12.9 t70 63.05 69.19 0.87 Allowed Pre-proline 0 N--CA 1.502 2.141 0 O-C-N 121.36 -0.838 . . . . 0.0 109.969 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -60.27 178.29 0.45 Allowed 'Trans proline' 0 C--N 1.315 -1.204 0 C-N-CA 121.312 1.342 . . . . 0.0 109.565 179.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 16.2 mtmt -120.32 -91.46 0.56 Allowed 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.521 -0.737 . . . . 0.0 109.587 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.478 ' ND2' ' O ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -179.46 96.59 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.015 -1.053 . . . . 0.0 109.013 179.944 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -145.03 179.23 7.49 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.174 -0.954 . . . . 0.0 109.43 -179.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 64.5 mt-10 -53.36 -92.8 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.11 -0.994 . . . . 0.0 109.016 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.597 ' C ' ' H ' ' A' ' 59' ' ' MET . 30.1 t70 -135.59 26.56 3.4 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.13 -0.981 . . . . 0.0 109.462 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -62.49 14.39 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.059 -1.025 . . . . 0.0 110.451 -179.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.597 ' H ' ' C ' ' A' ' 57' ' ' ASP . 0.0 OUTLIER -80.55 -4.71 55.01 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.755 -1.215 . . . . 0.0 108.129 179.256 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.4 ' O ' ' CG ' ' A' ' 63' ' ' GLU . 30.3 ttp180 -45.37 -39.16 6.56 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.629 -0.669 . . . . 0.0 109.673 179.842 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.625 ' C ' ' H ' ' A' ' 63' ' ' GLU . 63.2 mm-40 -61.27 167.12 3.34 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 120.688 -1.257 . . . . 0.0 108.73 179.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.578 ' SD ' ' CZ ' ' A' ' 50' ' ' TYR . 9.3 tpt 56.56 -10.9 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.319 -0.863 . . . . 0.0 111.282 179.456 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.625 ' H ' ' C ' ' A' ' 61' ' ' GLU . 15.8 pt-20 -60.87 2.97 0.09 Allowed 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.498 -1.376 . . . . 0.0 110.105 -179.705 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.511 ' H ' ' C ' ' A' ' 62' ' ' MET . 59.1 mt-10 -67.33 -44.12 79.89 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.035 -1.041 . . . . 0.0 110.506 -179.231 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.4 tp10 -69.54 -27.36 65.09 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.905 -1.122 . . . . 0.0 109.698 -179.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -53.8 -37.66 63.74 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.13 -0.981 . . . . 0.0 108.581 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 25.0 mt -79.45 -28.72 41.62 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.459 -0.776 . . . . 0.0 109.303 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -65.42 -37.24 86.36 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.211 -0.93 . . . . 0.0 109.677 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 13.7 mtt -85.34 -37.93 19.36 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.922 -1.111 . . . . 0.0 109.677 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.519 ' CG ' HH11 ' A' ' 70' ' ' ARG . 0.0 OUTLIER -66.25 -51.88 53.17 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.022 -1.049 . . . . 0.0 110.393 -179.386 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -69.85 -51.55 32.43 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.152 -0.967 . . . . 0.0 110.934 -178.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.491 ' CE1' ' OD1' ' A' ' 76' ' ' ASN . 62.0 t-80 -55.73 -42.03 74.77 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.921 -1.112 . . . . 0.0 110.516 -178.792 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 77.4 t -73.05 -54.21 16.37 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 120.645 -1.285 . . . . 0.0 109.804 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.462 ' SD ' ' NH1' ' A' ' 70' ' ' ARG . 37.2 mtp -65.36 -19.67 66.05 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.971 -1.081 . . . . 0.0 110.264 -179.098 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.5 ttpp -94.79 -32.66 13.2 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.727 -1.233 . . . . 0.0 110.237 -179.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . 0.491 ' OD1' ' CE1' ' A' ' 72' ' ' HIS . 6.3 m120 -100.57 -8.79 22.64 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.203 -0.936 . . . . 0.0 111.792 -178.464 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 85.5 t -117.13 -38.04 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.539 0 O-C-N 120.593 -1.317 . . . . 0.0 110.376 179.253 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.401 ' OD2' ' O ' ' A' ' 74' ' ' MET . 83.9 m-20 -49.47 112.38 0.63 Allowed 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.606 -1.309 . . . . 0.0 108.983 178.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.58 -59.24 2.3 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.284 -0.885 . . . . 0.0 110.41 -177.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.422 ' ND2' ' O ' ' A' ' 80' ' ' ASN . 1.1 t-20 -103.43 25.53 9.51 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.309 -0.869 . . . . 0.0 109.447 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.403 ' C ' ' O ' ' A' ' 80' ' ' ASN . 1.3 mm100 34.63 48.22 0.29 Allowed 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.054 0.454 . . . . 0.0 112.146 178.363 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.579 ' C ' ' H ' ' A' ' 84' ' ' LEU . 12.8 p-10 -99.72 15.33 27.16 Favored 'General case' 0 N--CA 1.495 1.809 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 178.463 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.437 HH11 ' HG3' ' A' ' 83' ' ' ARG . 10.5 mtm-85 63.06 -2.83 0.38 Allowed 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 -178.345 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.579 ' H ' ' C ' ' A' ' 82' ' ' ASP . 4.8 mp -125.62 135.3 52.03 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 179.524 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 70.2 t -112.81 129.71 67.94 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.083 0 O-C-N 121.552 -0.718 . . . . 0.0 109.615 -178.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 68.8 p -98.1 163.01 12.93 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.225 -0.922 . . . . 0.0 109.13 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.463 ' C ' ' CD1' ' A' ' 87' ' ' LEU . 1.4 tm? -66.04 -38.61 88.81 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 179.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -59.38 -69.71 0.19 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.344 -0.848 . . . . 0.0 111.456 -179.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -57.24 -30.07 64.31 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.101 -0.999 . . . . 0.0 110.36 -178.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -61.5 -51.22 69.56 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.024 -1.048 . . . . 0.0 110.076 -179.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.526 ' O ' ' N ' ' A' ' 95' ' ' GLN . 92.4 mt -52.81 -44.98 67.03 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.984 -1.073 . . . . 0.0 109.354 179.294 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -46.9 -49.68 20.0 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.185 -0.947 . . . . 0.0 109.911 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 41.9 m -60.5 -26.27 66.7 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.249 -0.907 . . . . 0.0 110.179 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.451 ' OG1' ' N ' ' A' ' 95' ' ' GLN . 26.4 p -102.37 -63.4 1.16 Allowed 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.213 -0.929 . . . . 0.0 110.047 -179.544 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.526 ' N ' ' O ' ' A' ' 91' ' ' LEU . 1.2 tp-100 -48.12 -60.42 2.65 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.154 -0.966 . . . . 0.0 109.897 -179.482 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.552 ' CG ' HH11 ' A' ' 96' ' ' ARG . 0.0 OUTLIER -48.79 -35.73 15.06 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.868 -1.145 . . . . 0.0 110.03 -179.402 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -54.29 -19.93 6.22 Favored 'General case' 0 N--CA 1.484 1.266 0 O-C-N 120.868 -1.145 . . . . 0.0 109.851 -179.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 53.9 tt0 -72.79 77.1 1.13 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.245 -0.909 . . . . 0.0 109.407 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 55.6 t80 . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 118.012 -0.994 . . . . 0.0 109.472 179.953 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.451 ' CD1' ' N ' ' A' ' 1' ' ' LEU . 9.7 mp . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp 54.22 63.64 2.1 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.429 -0.794 . . . . 0.0 109.663 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.51 ' OE2' ' CH2' ' A' ' 5' ' ' TRP . 6.8 pt-20 -70.94 70.16 0.49 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.386 -0.821 . . . . 0.0 109.065 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 58.8 t -71.92 102.09 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.339 -0.851 . . . . 0.0 109.878 -179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.51 ' CH2' ' OE2' ' A' ' 3' ' ' GLU . 8.2 m0 -90.96 92.22 8.66 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.187 -0.945 . . . . 0.0 109.578 179.628 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 55.67 87.38 0.05 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.316 -0.865 . . . . 0.0 110.147 179.453 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.404 ' O ' ' O ' ' A' ' 8' ' ' LEU . 72.8 mt-10 52.82 175.48 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.451 -0.781 . . . . 0.0 109.892 179.527 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.404 ' O ' ' O ' ' A' ' 7' ' ' GLU . 24.0 mt 60.39 157.61 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.065 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 -179.357 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -73.78 -25.99 60.42 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.78 -1.2 . . . . 0.0 109.312 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 177.7 -73.81 0.07 OUTLIER Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.817 -1.313 . . . . 0.0 109.817 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 31.7 mt -132.43 109.02 9.53 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.538 -0.978 . . . . 0.0 109.868 -179.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.445 ' OD1' ' N ' ' A' ' 12' ' ' ASP . 19.9 p-10 -90.59 147.45 36.39 Favored Pre-proline 0 N--CA 1.493 1.711 0 O-C-N 121.288 -0.882 . . . . 0.0 108.678 179.249 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.525 ' C ' ' H ' ' A' ' 15' ' ' ARG . 4.9 Cg_endo -61.38 -29.13 85.06 Favored 'Trans proline' 0 N--CA 1.48 0.68 0 C-N-CA 121.349 1.366 . . . . 0.0 110.593 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -71.55 32.57 0.05 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.967 -1.083 . . . . 0.0 110.218 -179.037 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.525 ' H ' ' C ' ' A' ' 13' ' ' PRO . 3.2 ptm180 -59.91 174.99 0.42 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.07 -1.019 . . . . 0.0 109.054 179.587 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 51.8 p90 -170.44 142.23 2.09 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.07 -1.019 . . . . 0.0 109.843 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -170.07 65.24 0.5 Allowed Pre-proline 0 N--CA 1.489 1.52 0 O-C-N 121.277 -0.889 . . . . 0.0 109.954 179.708 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -65.35 -22.44 59.94 Favored 'Trans proline' 0 C--N 1.319 -1.009 0 C-N-CA 121.509 1.473 . . . . 0.0 109.698 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -56.24 -36.07 68.09 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.352 -0.842 . . . . 0.0 110.991 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 69.9 m -73.17 -41.64 63.65 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 120.687 -1.258 . . . . 0.0 110.617 -178.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -56.39 -35.02 67.27 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.919 -1.113 . . . . 0.0 108.184 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -69.25 -34.96 75.6 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.323 -0.861 . . . . 0.0 109.836 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.485 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.9 mt -69.89 -59.69 3.25 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.157 0 O-C-N 120.798 -1.189 . . . . 0.0 109.006 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 tp -44.49 -36.39 2.92 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.353 -0.842 . . . . 0.0 110.735 -179.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.602 ' N ' ' HD1' ' A' ' 25' ' ' HIS . 0.3 OUTLIER -80.57 -14.19 58.42 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.391 -1.443 . . . . 0.0 109.536 179.758 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.485 ' N ' ' O ' ' A' ' 23' ' ' ILE . 82.1 m-20 -78.34 93.29 4.65 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.174 -0.954 . . . . 0.0 109.236 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 75.5 mt -77.3 -51.8 17.78 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.437 0 O-C-N 121.407 -0.808 . . . . 0.0 110.65 -178.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.631 ' H ' ' ND2' ' A' ' 28' ' ' ASN . 0.0 OUTLIER -88.18 -3.12 58.92 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.917 -1.115 . . . . 0.0 110.234 -179.41 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.458 ' N ' HD21 ' A' ' 28' ' ' ASN . 4.5 t 52.86 57.83 5.96 Favored 'General case' 0 C--N 1.295 -1.796 0 O-C-N 121.263 -0.898 . . . . 0.0 110.402 179.111 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -99.9 7.17 45.08 Favored 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 72.88 5.47 64.93 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.876 -1.29 . . . . 0.0 109.876 -179.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -144.18 164.85 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.985 0 O-C-N 121.196 -1.179 . . . . 0.0 108.565 177.658 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 tp -112.81 128.6 56.48 Favored 'General case' 0 N--CA 1.512 2.643 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 178.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 40.0 p-10 -104.91 163.04 12.82 Favored 'General case' 0 N--CA 1.504 2.265 0 CA-C-O 121.896 0.855 . . . . 0.0 110.606 -178.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.527 ' H ' ' CD ' ' A' ' 35' ' ' GLU . 1.7 mp0 -57.73 -8.95 1.03 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.911 -0.493 . . . . 0.0 111.069 -179.216 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -85.12 -36.64 20.98 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.765 -1.209 . . . . 0.0 109.548 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -81.12 -34.9 32.22 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 179.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.4 tp -72.75 -42.02 64.51 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.614 -0.679 . . . . 0.0 110.029 179.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -71.85 -34.03 68.93 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.553 -1.342 . . . . 0.0 108.892 179.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.3 -28.63 62.2 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.256 -0.902 . . . . 0.0 110.285 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.63 -31.2 68.07 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.913 -1.117 . . . . 0.0 109.855 -179.111 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -77.8 -47.98 17.63 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 120.509 -1.37 . . . . 0.0 109.812 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 54.3 m -57.45 -44.24 84.62 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.069 -1.02 . . . . 0.0 111.321 -178.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.8 mtmt -74.46 -47.9 30.66 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.894 -1.129 . . . . 0.0 111.959 -177.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -57.55 -27.9 63.05 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 120.459 -1.401 . . . . 0.0 110.069 -178.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.489 ' C ' ' H ' ' A' ' 48' ' ' LYS . 24.1 mt -70.14 -25.68 63.59 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.849 -1.157 . . . . 0.0 109.646 -179.731 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.408 ' OE2' ' O ' ' A' ' 47' ' ' GLU . 0.1 OUTLIER -65.31 3.76 0.61 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.042 -1.036 . . . . 0.0 109.67 -179.845 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.489 ' H ' ' C ' ' A' ' 46' ' ' LEU . 7.7 mtmp? -106.86 -1.95 21.88 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.239 -0.913 . . . . 0.0 109.673 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 61.7 t -114.88 -59.15 3.28 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 121.535 -0.728 . . . . 0.0 109.641 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -83.5 -159.77 0.38 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.107 -0.996 . . . . 0.0 109.376 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.407 ' O ' ' OD1' ' A' ' 51' ' ' ASP . 18.5 p30 -147.23 66.22 10.03 Favored Pre-proline 0 N--CA 1.494 1.772 0 O-C-N 121.262 -0.899 . . . . 0.0 109.414 179.824 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -64.53 174.4 4.42 Favored 'Trans proline' 0 C--N 1.318 -1.04 0 C-N-CA 121.55 1.5 . . . . 0.0 109.762 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.486 ' C ' ' H ' ' A' ' 55' ' ' GLU . 23.0 mtmt -97.58 51.79 1.08 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.305 -0.872 . . . . 0.0 109.026 179.51 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.512 ' ND2' ' O ' ' A' ' 54' ' ' ASN . 0.4 OUTLIER 57.76 5.28 0.33 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.367 -0.833 . . . . 0.0 109.51 -179.756 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.486 ' H ' ' C ' ' A' ' 53' ' ' LYS . 69.9 mm-40 -140.38 129.35 23.38 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.343 -0.848 . . . . 0.0 109.223 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.442 ' N ' ' CD ' ' A' ' 56' ' ' GLU . 2.4 mp0 -66.4 95.82 0.33 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.144 -0.972 . . . . 0.0 109.369 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -170.65 46.53 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.19 -0.944 . . . . 0.0 109.457 179.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -171.6 -0.39 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.272 -0.893 . . . . 0.0 109.386 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 58.6 mtp -98.64 3.56 47.87 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.105 -0.997 . . . . 0.0 109.018 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.57 ' O ' ' N ' ' A' ' 62' ' ' MET . 68.6 ttt180 -45.16 -54.91 6.28 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.432 -0.792 . . . . 0.0 109.729 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.537 ' CD ' ' H ' ' A' ' 61' ' ' GLU . 16.8 mp0 -43.45 -12.78 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.442 -0.786 . . . . 0.0 111.368 -178.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.57 ' N ' ' O ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -134.99 5.59 3.33 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 120.871 -1.143 . . . . 0.0 109.811 -179.909 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -47.85 -12.1 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.295 -0.878 . . . . 0.0 109.116 179.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.527 ' N ' ' O ' ' A' ' 62' ' ' MET . 13.3 mp0 -63.17 -28.92 70.38 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.214 -0.929 . . . . 0.0 110.035 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -69.56 -49.09 57.56 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.012 -1.055 . . . . 0.0 109.815 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . 0.424 HH22 ' CG ' ' A' ' 56' ' ' GLU . 47.8 mtt180 -48.27 -38.35 18.51 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.366 -0.834 . . . . 0.0 109.753 -179.292 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.445 ' C ' ' CD1' ' A' ' 67' ' ' LEU . 0.0 OUTLIER -82.68 -33.09 27.78 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.024 -1.048 . . . . 0.0 109.832 -178.936 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.4 tpp180 -63.8 -38.82 92.53 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.111 -0.993 . . . . 0.0 110.009 -179.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 4.0 mtt -83.65 -51.12 7.55 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.068 -1.02 . . . . 0.0 109.272 179.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 29.1 ttp180 -51.07 -41.05 59.67 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.842 -1.161 . . . . 0.0 109.79 179.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -74.91 -52.52 11.05 Favored 'General case' 0 C--N 1.305 -1.343 0 O-C-N 120.841 -1.162 . . . . 0.0 111.166 -178.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.457 ' CD2' ' OD1' ' A' ' 76' ' ' ASN . 23.5 t60 -55.95 -36.85 68.24 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.92 -1.112 . . . . 0.0 110.059 -179.587 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 78.9 t -75.56 -55.32 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 120.68 -1.263 . . . . 0.0 109.798 -179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 35.7 mtp -62.48 -18.06 61.01 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.304 -0.872 . . . . 0.0 109.889 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 43.3 tttp -94.01 -37.66 11.55 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.656 -1.277 . . . . 0.0 109.929 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . 0.457 ' OD1' ' CD2' ' A' ' 72' ' ' HIS . 11.9 m120 -98.23 -11.05 23.09 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.146 -0.971 . . . . 0.0 112.05 -178.15 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 64.5 t -111.26 -35.76 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.559 0 O-C-N 120.458 -1.401 . . . . 0.0 109.911 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -57.88 109.46 0.73 Allowed 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.477 -1.39 . . . . 0.0 108.123 177.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -85.06 -55.15 4.2 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.173 -0.955 . . . . 0.0 111.102 -178.158 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.527 ' O ' ' N ' ' A' ' 82' ' ' ASP . 23.9 m120 -101.95 25.15 9.02 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.231 -0.918 . . . . 0.0 109.687 -179.442 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.445 ' C ' ' H ' ' A' ' 83' ' ' ARG . 0.6 OUTLIER 33.83 29.37 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 178.609 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.533 ' C ' ' H ' ' A' ' 84' ' ' LEU . 19.8 p-10 -81.36 9.98 6.36 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 178.428 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.445 ' H ' ' C ' ' A' ' 81' ' ' GLN . 8.4 mtm-85 66.86 -5.43 0.66 Allowed 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 -178.731 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.533 ' H ' ' C ' ' A' ' 82' ' ' ASP . 13.6 mt -116.81 134.89 54.23 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 107.583 -1.265 . . . . 0.0 107.583 178.661 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 82.0 t -111.49 129.92 65.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.976 0 O-C-N 121.576 -0.703 . . . . 0.0 109.948 -178.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 31.9 p -105.53 159.87 15.61 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.6 tp -60.92 -36.78 80.18 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.382 -0.824 . . . . 0.0 109.223 179.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -60.18 -69.56 0.21 Allowed 'General case' 0 C--N 1.295 -1.788 0 O-C-N 121.254 -0.904 . . . . 0.0 111.495 -177.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -60.42 -30.31 69.53 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.161 -0.962 . . . . 0.0 110.334 -178.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -64.91 -51.95 59.12 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.874 -1.142 . . . . 0.0 109.893 -179.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 57.3 mt -48.25 -44.87 33.78 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.142 -0.974 . . . . 0.0 109.294 179.651 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -54.69 -60.3 3.54 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.403 -0.811 . . . . 0.0 110.497 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.0 t -42.44 -35.17 0.97 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.445 -0.784 . . . . 0.0 111.349 -178.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 50.7 p -84.28 -51.06 7.3 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 120.671 -1.268 . . . . 0.0 108.767 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 44.5 mm-40 -53.02 126.03 19.2 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.008 -1.058 . . . . 0.0 108.71 179.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.431 ' O ' ' O ' ' A' ' 97' ' ' LYS . 0.7 OUTLIER -153.9 83.27 1.15 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.999 -1.063 . . . . 0.0 109.582 -179.508 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.431 ' O ' ' O ' ' A' ' 96' ' ' ARG . 21.5 ttpp 53.48 101.97 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.219 -0.926 . . . . 0.0 109.711 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -58.55 90.96 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.144 -0.972 . . . . 0.0 109.361 179.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.409 ' N ' ' O ' ' A' ' 97' ' ' LYS . 30.1 m-85 . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 117.938 -1.03 . . . . 0.0 109.399 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.48 ' CD1' ' N ' ' A' ' 1' ' ' LEU . 8.8 mp . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 59.7 tttm -63.29 -18.07 63.2 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.281 -0.887 . . . . 0.0 109.418 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -55.3 132.42 47.89 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.319 -0.863 . . . . 0.0 109.508 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 29.2 t -58.74 130.84 22.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.319 -0.863 . . . . 0.0 109.517 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 69.0 m95 -61.22 110.91 1.53 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.252 -0.905 . . . . 0.0 109.425 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -58.28 -175.49 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.273 -0.892 . . . . 0.0 109.281 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -168.61 72.7 0.09 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.24 -0.912 . . . . 0.0 109.412 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.0 tp -109.89 67.77 0.66 Allowed 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.566 -0.709 . . . . 0.0 109.14 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -82.75 -24.54 33.47 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.214 -0.929 . . . . 0.0 109.289 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -167.85 -37.3 0.02 OUTLIER Glycine 0 N--CA 1.489 2.196 0 N-CA-C 109.286 -1.526 . . . . 0.0 109.286 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 53.3 tp -49.05 122.87 6.32 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.29 -1.124 . . . . 0.0 108.949 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -76.39 150.3 82.39 Favored Pre-proline 0 N--CA 1.491 1.576 0 O-C-N 121.23 -0.919 . . . . 0.0 109.07 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_endo -61.44 -18.51 59.8 Favored 'Trans proline' 0 C--N 1.325 -0.678 0 C-N-CA 121.011 1.14 . . . . 0.0 110.093 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.512 ' OD1' ' CE2' ' A' ' 16' ' ' PHE . 23.8 t-20 -74.83 64.17 1.25 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.965 -1.084 . . . . 0.0 109.7 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.571 HH11 ' CG ' ' A' ' 15' ' ' ARG . 0.3 OUTLIER -97.79 77.74 2.54 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.304 -0.872 . . . . 0.0 109.497 179.965 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.512 ' CE2' ' OD1' ' A' ' 14' ' ' ASN . 49.4 m-85 -58.36 145.52 37.84 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.165 -0.96 . . . . 0.0 109.304 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -171.57 68.09 0.45 Allowed Pre-proline 0 N--CA 1.492 1.633 0 O-C-N 121.303 -0.873 . . . . 0.0 109.678 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -63.95 -21.37 68.7 Favored 'Trans proline' 0 C--N 1.317 -1.081 0 C-N-CA 121.354 1.37 . . . . 0.0 109.862 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 55.8 tttp -55.41 -38.64 69.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.434 -0.791 . . . . 0.0 111.15 -179.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 49.4 m -70.78 -41.9 71.06 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 120.477 -1.389 . . . . 0.0 110.37 -178.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.514 ' CE2' ' NE2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -54.46 -44.88 72.93 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 179.761 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.421 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 20.9 t80 -57.67 -34.0 68.92 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.468 -0.77 . . . . 0.0 109.548 179.524 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.52 ' O ' ' N ' ' A' ' 25' ' ' HIS . 92.8 mt -72.41 -61.64 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 O-C-N 120.819 -1.175 . . . . 0.0 108.559 179.403 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.43 ' C ' ' HD1' ' A' ' 25' ' ' HIS . 4.6 tp -45.48 -14.32 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.072 -1.018 . . . . 0.0 110.846 179.865 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.605 ' N ' ' HD1' ' A' ' 25' ' ' HIS . 0.6 OUTLIER -104.21 -12.69 16.53 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 120.644 -1.285 . . . . 0.0 110.215 179.909 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.477 ' OD1' ' O ' ' A' ' 23' ' ' ILE . 33.7 p-10 -78.64 67.3 4.36 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.87 -1.144 . . . . 0.0 109.446 179.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 69.1 mt -50.53 -51.91 17.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 O-C-N 121.191 -0.943 . . . . 0.0 110.993 -179.3 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.527 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -89.38 12.44 16.28 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 120.721 -1.237 . . . . 0.0 110.128 -179.454 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.451 ' OG ' ' O ' ' A' ' 29' ' ' SER . 6.9 t 41.71 51.78 4.0 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.355 -0.841 . . . . 0.0 110.774 178.661 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -95.28 1.66 54.56 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.987 -1.071 . . . . 0.0 108.395 179.252 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 74.22 -0.17 54.69 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 109.453 -1.459 . . . . 0.0 109.453 -179.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -143.84 162.46 15.68 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 O-C-N 121.289 -1.124 . . . . 0.0 108.905 178.666 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 73.0 mt -107.94 110.76 22.58 Favored 'General case' 0 N--CA 1.513 2.715 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 177.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -86.17 -178.33 6.48 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.481 -0.762 . . . . 0.0 110.127 -179.2 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -73.3 -43.06 61.6 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.292 -0.88 . . . . 0.0 111.468 -178.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.503 ' NE2' ' C ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -61.86 -24.57 67.0 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 120.36 -1.463 . . . . 0.0 108.589 -179.885 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 -86.51 -32.42 20.76 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.375 -0.828 . . . . 0.0 109.069 179.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.0 tp -72.38 -34.96 68.33 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.343 -0.848 . . . . 0.0 109.554 179.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -74.71 -51.18 14.97 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.315 -0.866 . . . . 0.0 110.73 -179.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.24 -32.99 74.8 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.924 -1.11 . . . . 0.0 110.713 -178.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 39.0 tp -74.1 -31.01 62.62 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.85 -1.156 . . . . 0.0 109.942 -179.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -84.01 -50.71 7.75 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 120.46 -1.4 . . . . 0.0 109.823 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 43.1 m -64.99 -42.52 94.44 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.066 -1.022 . . . . 0.0 110.447 -179.155 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.7 ttpt -72.59 -45.42 59.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.185 -0.947 . . . . 0.0 111.514 -178.221 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.2 tm-20 -53.77 -40.53 66.31 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 120.503 -1.373 . . . . 0.0 110.573 -178.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.6 mt -53.61 -25.25 16.69 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.871 -1.143 . . . . 0.0 110.131 -179.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -60.23 -24.98 65.29 Favored 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.21 -0.931 . . . . 0.0 110.018 -179.135 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 83.6 mttt -99.74 41.38 1.16 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.172 -0.955 . . . . 0.0 110.181 -179.263 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 59.2 t -150.06 -59.33 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 121.04 -1.038 . . . . 0.0 109.526 179.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -88.99 -131.37 0.08 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.217 -0.927 . . . . 0.0 109.905 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.556 ' C ' ' H ' ' A' ' 53' ' ' LYS . 1.7 p-10 -142.68 111.57 5.8 Favored Pre-proline 0 N--CA 1.495 1.818 0 O-C-N 121.266 -0.896 . . . . 0.0 108.61 -179.275 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -69.95 42.92 0.37 Allowed 'Trans proline' 0 C--O 1.213 -0.774 0 N-CA-C 109.662 -0.938 . . . . 0.0 109.662 -179.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.556 ' H ' ' C ' ' A' ' 51' ' ' ASP . 55.3 mttt 72.78 9.44 5.54 Favored 'General case' 0 N--CA 1.501 2.086 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.566 179.126 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -86.55 -15.21 40.66 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.021 -1.049 . . . . 0.0 108.817 179.117 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -157.89 132.82 8.59 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.364 -0.835 . . . . 0.0 109.467 179.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 49.42 -170.63 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.192 -0.943 . . . . 0.0 109.425 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -145.88 112.75 6.03 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.198 -0.939 . . . . 0.0 108.576 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -160.5 4.24 0.07 Allowed 'General case' 0 C--N 1.302 -1.5 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 179.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.519 ' O ' ' SD ' ' A' ' 62' ' ' MET . 0.5 OUTLIER -84.48 -11.66 55.73 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.531 -0.731 . . . . 0.0 109.046 -179.887 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.541 ' O ' ' N ' ' A' ' 62' ' ' MET . 26.3 ttm180 -97.29 -58.67 1.96 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.176 -0.953 . . . . 0.0 109.247 179.635 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.525 ' CD ' ' H ' ' A' ' 61' ' ' GLU . 24.9 mp0 -36.92 -23.53 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.689 -0.632 . . . . 0.0 112.092 -178.484 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.568 ' O ' ' N ' ' A' ' 64' ' ' GLU . 0.1 OUTLIER -109.02 4.13 22.85 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 120.971 -1.081 . . . . 0.0 110.605 -179.646 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.42 ' N ' ' SD ' ' A' ' 62' ' ' MET . 15.9 pt-20 -39.19 -23.01 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.109 0 CA-C-O 121.405 0.621 . . . . 0.0 110.154 -179.39 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.568 ' N ' ' O ' ' A' ' 62' ' ' MET . 31.3 mm-40 -67.01 -24.02 65.98 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.506 -0.747 . . . . 0.0 109.589 179.305 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -69.0 -28.0 66.2 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.255 -0.903 . . . . 0.0 110.102 -179.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 25.0 mtm180 -60.44 -47.99 83.7 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.172 -0.955 . . . . 0.0 109.219 -179.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . 0.41 ' C ' ' CD1' ' A' ' 67' ' ' LEU . 0.7 OUTLIER -74.5 -27.62 60.63 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.276 -0.89 . . . . 0.0 110.075 -179.518 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.475 ' O ' ' NE ' ' A' ' 68' ' ' ARG . 8.7 tpm_? -65.71 -37.96 87.87 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.841 -1.162 . . . . 0.0 109.37 -179.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.6 mtt -84.16 -50.69 7.68 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.224 -0.922 . . . . 0.0 109.131 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.471 ' HG2' HH11 ' A' ' 70' ' ' ARG . 7.1 ttt-85 -52.14 -32.75 37.08 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.979 -1.076 . . . . 0.0 110.02 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 -86.42 -53.48 4.97 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 120.921 -1.112 . . . . 0.0 110.814 -178.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 11.2 t-80 -54.88 -34.6 63.17 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.911 -1.118 . . . . 0.0 110.006 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 54.6 t -74.52 -53.88 15.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 120.672 -1.267 . . . . 0.0 109.738 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.452 ' SD ' ' NH1' ' A' ' 70' ' ' ARG . 29.8 mtp -65.41 -15.67 62.84 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.065 -1.022 . . . . 0.0 110.225 -179.702 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 42.4 tttp -85.23 -37.98 19.46 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.453 -1.404 . . . . 0.0 110.526 -179.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . 0.693 HD21 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -105.18 -24.3 12.77 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.123 -0.985 . . . . 0.0 112.558 -178.027 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.693 ' H ' HD21 ' A' ' 76' ' ' ASN . 34.1 t -91.18 -36.75 8.39 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.422 0 O-C-N 120.235 -1.541 . . . . 0.0 110.032 -179.362 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -66.7 105.06 1.45 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.411 -1.431 . . . . 0.0 107.606 178.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -83.5 -53.49 5.65 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.327 -0.858 . . . . 0.0 111.587 -177.733 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.471 ' O ' ' N ' ' A' ' 82' ' ' ASP . 6.2 m120 -98.59 23.91 8.08 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.15 -0.968 . . . . 0.0 109.46 -179.345 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.429 ' C ' ' O ' ' A' ' 80' ' ' ASN . 1.3 mm100 31.37 35.07 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 178.786 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.561 ' C ' ' H ' ' A' ' 84' ' ' LEU . 81.3 m-20 -84.99 12.54 7.38 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 178.532 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.521 HH11 ' CG ' ' A' ' 83' ' ' ARG . 3.9 mtt-85 65.03 -4.13 0.53 Allowed 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 -178.485 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.561 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.6 mp -119.31 133.9 55.49 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 179.157 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 92.9 t -112.85 129.54 68.29 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 O-C-N 121.643 -0.66 . . . . 0.0 110.143 -178.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 25.6 p -102.02 174.8 5.77 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 178.161 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -75.07 -32.8 61.57 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.999 -1.063 . . . . 0.0 109.192 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -64.05 -66.51 0.53 Allowed 'General case' 0 C--N 1.294 -1.818 0 O-C-N 120.922 -1.111 . . . . 0.0 111.514 -178.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -59.27 -33.64 71.3 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.909 -1.12 . . . . 0.0 110.435 -177.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -66.29 -50.84 62.31 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 120.736 -1.228 . . . . 0.0 109.404 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.9 mp -46.74 -46.39 20.33 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.308 -0.87 . . . . 0.0 108.853 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -52.93 -58.31 7.37 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.221 -0.925 . . . . 0.0 110.277 -179.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 25.4 m -44.31 -27.47 0.43 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.239 -0.913 . . . . 0.0 109.952 -179.402 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.601 ' HG1' ' H ' ' A' ' 95' ' ' GLN . 31.8 p -100.02 -57.97 2.02 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.314 -0.866 . . . . 0.0 108.741 179.096 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.601 ' H ' ' HG1' ' A' ' 94' ' ' THR . 3.4 tt0 -46.49 121.89 3.75 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.268 -0.895 . . . . 0.0 109.58 179.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 14.0 tpt180 -170.99 65.11 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.216 -0.927 . . . . 0.0 109.546 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -45.15 110.03 0.21 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.341 -0.85 . . . . 0.0 110.003 -179.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -79.02 75.21 5.54 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.204 -0.935 . . . . 0.0 109.556 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 64.3 t80 . . . . . 0 N--CA 1.494 1.75 0 CA-C-O 117.998 -1.001 . . . . 0.0 109.335 -179.936 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 21.2 mt . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.535 ' O ' ' N ' ' A' ' 4' ' ' VAL . 55.8 mttp -140.92 81.89 1.81 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.274 -0.891 . . . . 0.0 109.174 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 62.25 -72.12 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.57 -0.706 . . . . 0.0 109.655 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.535 ' N ' ' O ' ' A' ' 2' ' ' LYS . 23.5 t -49.36 125.14 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.244 -0.91 . . . . 0.0 109.563 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 12.4 m-90 -74.97 -126.62 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.169 -0.957 . . . . 0.0 109.439 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.407 ' OE2' ' NZ ' ' A' ' 19' ' ' LYS . 24.0 tp10 -167.52 -75.54 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.149 -0.969 . . . . 0.0 109.647 -179.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.405 ' CG ' ' N ' ' A' ' 8' ' ' LEU . 30.4 tt0 -169.68 165.32 10.09 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.2 -0.937 . . . . 0.0 109.354 -179.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.474 ' O ' ' N ' ' A' ' 10' ' ' GLY . 0.2 OUTLIER -144.28 101.71 3.74 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.204 -0.935 . . . . 0.0 109.134 179.787 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -63.18 77.37 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.311 -0.868 . . . . 0.0 109.604 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.474 ' N ' ' O ' ' A' ' 8' ' ' LEU . . . -151.24 38.11 0.84 Allowed Glycine 0 N--CA 1.494 2.505 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.529 ' CD2' ' N ' ' A' ' 11' ' ' LEU . 3.4 mm? 51.07 96.94 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.316 -1.108 . . . . 0.0 109.236 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -53.94 148.92 19.18 Favored Pre-proline 0 N--CA 1.49 1.55 0 O-C-N 121.208 -0.932 . . . . 0.0 108.963 -179.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -60.55 -46.28 18.1 Favored 'Trans proline' 0 C--N 1.323 -0.78 0 C-N-CA 120.961 1.107 . . . . 0.0 109.774 179.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -149.11 -54.34 0.18 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.084 -1.01 . . . . 0.0 109.536 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.421 HH11 ' HG3' ' A' ' 15' ' ' ARG . 3.4 ptm180 -49.15 134.04 18.18 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.236 -0.915 . . . . 0.0 109.587 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.492 ' C ' ' ND2' ' A' ' 17' ' ' ASN . 35.9 t80 -82.17 -120.86 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.346 -0.847 . . . . 0.0 109.307 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.492 ' ND2' ' C ' ' A' ' 16' ' ' PHE . 2.3 m-80 -146.38 69.11 12.57 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.172 -0.955 . . . . 0.0 109.259 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -62.96 -20.49 71.66 Favored 'Trans proline' 0 C--N 1.319 -1.001 0 C-N-CA 121.545 1.496 . . . . 0.0 110.269 -179.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.407 ' NZ ' ' OE2' ' A' ' 6' ' ' GLU . 86.8 tttt -55.81 -36.64 67.66 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.312 -0.868 . . . . 0.0 111.135 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 58.4 m -74.04 -43.27 58.46 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 120.679 -1.263 . . . . 0.0 110.562 -178.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.502 ' CE2' ' CD2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -54.85 -33.97 62.37 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 179.909 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -69.76 -34.52 73.9 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.422 -0.799 . . . . 0.0 109.816 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 97.4 mt -71.87 -60.68 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 O-C-N 120.832 -1.167 . . . . 0.0 108.907 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 tp -46.01 -37.93 7.2 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.313 -0.867 . . . . 0.0 111.048 -179.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.625 ' N ' ' HD1' ' A' ' 25' ' ' HIS . 0.3 OUTLIER -79.17 -15.11 58.57 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.433 -1.417 . . . . 0.0 110.082 -179.526 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -79.84 96.27 6.28 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.02 -1.05 . . . . 0.0 108.717 179.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.3 mt -74.55 -51.98 21.06 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 O-C-N 121.455 -0.778 . . . . 0.0 110.736 -178.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.533 HD21 ' N ' ' A' ' 28' ' ' ASN . 1.8 m120 -86.78 8.57 22.16 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.787 -1.195 . . . . 0.0 109.948 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.443 ' OG ' ' O ' ' A' ' 29' ' ' SER . 5.2 t 44.32 57.47 4.31 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.166 -0.959 . . . . 0.0 110.496 178.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -100.31 0.2 39.66 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.079 -1.013 . . . . 0.0 108.654 179.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.67 -2.51 67.71 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -144.31 160.22 15.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.052 -1.263 . . . . 0.0 108.621 178.052 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 17.6 mt -110.89 128.96 55.98 Favored 'General case' 0 N--CA 1.512 2.626 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.487 ' C ' ' H ' ' A' ' 36' ' ' GLN . 24.6 p-10 -105.12 166.83 10.12 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.504 -0.748 . . . . 0.0 109.643 -179.544 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -52.27 -6.34 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.578 -0.701 . . . . 0.0 110.79 -179.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.487 ' H ' ' C ' ' A' ' 34' ' ' ASP . 2.3 mm100 -85.77 -42.66 14.0 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.807 -1.183 . . . . 0.0 109.862 -179.819 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -80.71 -31.18 36.23 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.0 tp -76.37 -36.82 57.95 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.43 -0.794 . . . . 0.0 109.281 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -74.62 -51.35 14.73 Favored 'General case' 0 N--CA 1.484 1.275 0 O-C-N 120.935 -1.103 . . . . 0.0 109.429 179.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.21 -29.53 69.87 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.325 -0.859 . . . . 0.0 110.33 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 41.6 tp -76.71 -27.7 55.57 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.167 -0.958 . . . . 0.0 110.542 -178.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -82.88 -40.06 20.75 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 120.354 -1.466 . . . . 0.0 110.006 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 17.7 m -69.94 -55.16 10.38 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.78 -1.2 . . . . 0.0 109.842 -179.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.408 ' HG3' ' H ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -60.4 -45.39 93.74 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.303 -0.873 . . . . 0.0 111.059 -178.401 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.408 ' H ' ' HG3' ' A' ' 44' ' ' LYS . 30.5 tt0 -60.31 -27.82 67.62 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.429 -1.419 . . . . 0.0 109.795 -179.23 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.53 ' C ' ' H ' ' A' ' 48' ' ' LYS . 11.6 tp -68.93 -23.49 64.17 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.132 -0.98 . . . . 0.0 108.644 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.58 4.12 0.11 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.421 -0.799 . . . . 0.0 109.795 178.498 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.53 ' H ' ' C ' ' A' ' 46' ' ' LEU . 7.8 mtmp? -108.91 172.42 6.86 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 179.086 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.8 t 66.34 -42.32 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.259 -0.901 . . . . 0.0 109.701 -179.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.497 ' OH ' ' SD ' ' A' ' 62' ' ' MET . 44.7 m-85 -96.35 -167.01 1.5 Allowed 'General case' 0 N--CA 1.496 1.872 0 O-C-N 120.971 -1.08 . . . . 0.0 109.586 -179.849 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.55 ' C ' ' H ' ' A' ' 53' ' ' LYS . 5.3 p-10 -142.46 73.17 20.77 Favored Pre-proline 0 N--CA 1.498 1.936 0 O-C-N 121.404 -0.81 . . . . 0.0 109.188 -179.722 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -66.66 15.72 0.11 Allowed 'Trans proline' 0 C--N 1.318 -1.035 0 C-N-CA 121.709 1.606 . . . . 0.0 110.66 -179.354 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.55 ' H ' ' C ' ' A' ' 51' ' ' ASP . 30.3 mmtp -125.7 27.42 6.45 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.467 -0.77 . . . . 0.0 109.436 -179.838 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.414 ' ND2' ' O ' ' A' ' 54' ' ' ASN . 1.0 OUTLIER -171.68 36.96 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.157 -0.965 . . . . 0.0 109.797 179.942 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -156.3 134.19 11.13 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.05 -1.031 . . . . 0.0 109.449 -179.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 75.8 mt-10 -65.91 -174.08 0.21 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.309 -0.869 . . . . 0.0 109.595 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.642 ' O ' ' N ' ' A' ' 59' ' ' MET . 8.4 m-20 58.54 88.85 0.06 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.111 -0.993 . . . . 0.0 109.523 -179.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.532 ' O ' ' N ' ' A' ' 60' ' ' ARG . 16.6 p-10 -42.39 80.2 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.933 0 CA-C-O 121.322 0.582 . . . . 0.0 111.672 -178.669 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.642 ' N ' ' O ' ' A' ' 57' ' ' ASP . 70.6 mtp 45.69 14.8 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.441 -0.787 . . . . 0.0 109.852 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.532 ' N ' ' O ' ' A' ' 58' ' ' ASP . 49.4 ttt180 -52.63 -54.19 36.56 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 179.462 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.567 ' C ' ' H ' ' A' ' 63' ' ' GLU . 0.8 OUTLIER -57.18 165.66 1.32 Allowed 'General case' 0 C--N 1.3 -1.553 0 O-C-N 120.553 -1.342 . . . . 0.0 107.56 178.363 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.497 ' SD ' ' OH ' ' A' ' 50' ' ' TYR . 14.2 tpt 61.57 -13.12 0.05 Allowed 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.236 -0.915 . . . . 0.0 110.544 -179.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.567 ' H ' ' C ' ' A' ' 61' ' ' GLU . 13.8 pt-20 -54.31 -11.37 0.5 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.267 -1.52 . . . . 0.0 108.383 179.373 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.468 ' H ' ' C ' ' A' ' 62' ' ' MET . 63.3 mm-40 -71.42 -62.62 1.34 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.547 -0.72 . . . . 0.0 109.379 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.474 ' OE1' ' NE ' ' A' ' 68' ' ' ARG . 4.1 tp10 -44.57 -38.69 4.39 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.651 -0.656 . . . . 0.0 109.917 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? -46.94 -35.98 7.14 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 179.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 33.4 mt -82.93 -26.54 31.32 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.527 -0.733 . . . . 0.0 109.619 179.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.474 ' NE ' ' OE1' ' A' ' 65' ' ' GLU . 1.3 tmm_? -65.9 -39.0 90.21 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.9 -1.125 . . . . 0.0 109.735 -179.304 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.7 mtt -84.97 -50.37 7.54 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.192 -0.943 . . . . 0.0 109.553 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.509 ' NH1' ' SD ' ' A' ' 74' ' ' MET . 11.0 ttt-85 -54.21 -27.85 37.07 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.759 -1.213 . . . . 0.0 110.21 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -84.27 -51.78 6.74 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 120.801 -1.187 . . . . 0.0 110.75 -179.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -54.28 -38.67 66.12 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.088 -1.007 . . . . 0.0 110.823 -179.472 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 55.3 t -75.09 -54.49 14.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 O-C-N 120.343 -1.473 . . . . 0.0 110.117 -179.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.509 ' SD ' ' NH1' ' A' ' 70' ' ' ARG . 27.5 mtp -62.81 -14.11 41.56 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.227 -0.921 . . . . 0.0 110.291 -179.137 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 42.8 tttm -89.59 -39.45 13.25 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.641 -1.287 . . . . 0.0 110.842 -178.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . 0.66 HD21 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -103.61 -27.58 12.24 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.126 -0.984 . . . . 0.0 112.279 -178.053 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.66 ' H ' HD21 ' A' ' 76' ' ' ASN . 21.6 t -85.21 -29.29 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.233 0 O-C-N 120.144 -1.598 . . . . 0.0 109.118 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.462 ' CG ' ' O ' ' A' ' 74' ' ' MET . 15.2 p-10 -63.28 106.17 0.85 Allowed 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.915 -1.115 . . . . 0.0 108.462 178.52 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' THR . . . . . 0.405 ' C ' HD21 ' A' ' 80' ' ' ASN . 0.0 OUTLIER -86.72 -53.49 4.91 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.107 -1.621 . . . . 0.0 110.73 -178.542 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.499 ' O ' ' N ' ' A' ' 82' ' ' ASP . 2.8 m120 -104.12 24.87 10.75 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.301 -0.874 . . . . 0.0 109.737 -179.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLN . . . . . 0.405 ' C ' ' H ' ' A' ' 83' ' ' ARG . 0.1 OUTLIER 34.31 30.14 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.862 0 O-C-N 122.041 -0.412 . . . . 0.0 111.932 178.362 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.566 ' C ' ' H ' ' A' ' 84' ' ' LEU . 18.5 p-10 -82.08 9.95 7.57 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.637 -1.29 . . . . 0.0 107.667 178.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.508 HH11 ' CG ' ' A' ' 83' ' ' ARG . 4.1 mtt-85 64.34 -4.31 0.43 Allowed 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 -178.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.566 ' H ' ' C ' ' A' ' 82' ' ' ASP . 6.6 mp -118.38 134.37 55.11 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 178.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 94.6 t -112.4 130.45 66.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.047 0 O-C-N 121.564 -0.71 . . . . 0.0 110.336 -178.359 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 16.9 p -105.93 166.41 10.5 Favored 'General case' 0 N--CA 1.499 1.999 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 178.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.9 tp -64.54 -36.63 84.84 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.273 -0.892 . . . . 0.0 109.344 179.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.503 ' H ' ' CD ' ' A' ' 88' ' ' GLU . 8.8 mp0 -61.49 -68.16 0.34 Allowed 'General case' 0 C--N 1.293 -1.874 0 O-C-N 120.751 -1.218 . . . . 0.0 111.806 -177.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . 0.416 ' OE1' ' OD1' ' A' ' 80' ' ' ASN . 1.0 OUTLIER -58.71 -33.66 70.44 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 120.738 -1.226 . . . . 0.0 110.479 -177.91 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -64.34 -51.39 63.6 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.865 -1.147 . . . . 0.0 108.821 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 2.7 mp -48.93 -42.71 38.13 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.99 -61.38 2.0 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.257 -0.902 . . . . 0.0 109.701 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 95.1 p -48.04 -33.05 7.42 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.282 -0.886 . . . . 0.0 110.302 -179.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 14.2 p -98.96 14.63 28.43 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.212 -0.93 . . . . 0.0 109.483 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 4.6 mm100 -138.93 123.24 18.18 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 179.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.525 ' CG ' HH11 ' A' ' 96' ' ' ARG . 0.0 OUTLIER -171.04 -28.41 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.093 -1.005 . . . . 0.0 109.721 -179.786 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.7 pttt -179.09 162.82 1.26 Allowed 'General case' 0 C--N 1.307 -1.27 0 O-C-N 121.448 -0.782 . . . . 0.0 109.593 179.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.428 ' OE2' ' O ' ' A' ' 98' ' ' GLU . 0.4 OUTLIER -170.21 102.92 0.28 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.322 -0.862 . . . . 0.0 109.348 179.808 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 . . . . . 0 N--CA 1.491 1.575 0 CA-C-O 118.004 -0.998 . . . . 0.0 109.59 -179.813 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 . . . . . 0 N--CA 1.493 1.704 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -63.82 -18.69 65.0 Favored 'Trans proline' 0 C--N 1.319 -1.02 0 C-N-CA 121.519 1.479 . . . . 0.0 110.004 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -56.21 -39.61 72.75 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.331 -0.855 . . . . 0.0 111.176 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 71.9 m -70.91 -38.91 72.99 Favored 'General case' 0 C--N 1.308 -1.217 0 O-C-N 120.619 -1.301 . . . . 0.0 110.668 -178.237 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.426 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.04 -34.33 65.78 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 179.94 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.428 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 22.9 t80 -68.79 -35.17 76.7 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.396 -0.815 . . . . 0.0 109.665 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 97.9 mt -69.91 -60.4 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 O-C-N 120.796 -1.19 . . . . 0.0 108.974 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.7 tp -45.86 -38.6 7.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.286 -0.884 . . . . 0.0 110.709 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -78.9 -11.86 60.01 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.298 -1.501 . . . . 0.0 109.974 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.428 ' OD1' ' O ' ' A' ' 22' ' ' PHE . 55.1 m-20 -81.65 92.79 6.63 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.872 -1.142 . . . . 0.0 108.965 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.41 HD13 HG21 ' A' ' 27' ' ' ILE . 26.1 mt -75.74 -51.57 20.26 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.371 0 O-C-N 121.331 -0.856 . . . . 0.0 110.877 -178.869 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 51.5 t-20 -87.94 12.88 12.1 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 120.876 -1.14 . . . . 0.0 110.105 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.0 t 43.27 55.68 4.58 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.255 -0.903 . . . . 0.0 110.533 179.03 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 13.8 p30 -97.92 -6.23 32.7 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.117 -0.99 . . . . 0.0 108.511 179.318 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.85 -3.74 63.61 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 109.664 -1.375 . . . . 0.0 109.664 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -140.93 163.16 22.03 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 O-C-N 121.263 -1.14 . . . . 0.0 108.486 178.855 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 72.3 mt -120.47 121.53 38.68 Favored 'General case' 0 N--CA 1.515 2.819 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 178.183 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -103.89 179.51 4.25 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.108 -0.995 . . . . 0.0 110.18 -179.498 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.1 tm-20 -55.71 -14.55 2.31 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.61 -0.681 . . . . 0.0 111.232 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -82.68 -28.06 30.86 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.283 -1.511 . . . . 0.0 109.679 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.7 mm-40 -81.39 -37.32 28.37 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.743 -1.223 . . . . 0.0 109.411 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.536 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 2.3 mt -73.58 -32.01 63.9 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 120.992 -1.067 . . . . 0.0 108.539 178.788 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -59.94 -47.87 84.03 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 120.909 -1.119 . . . . 0.0 108.874 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.31 -28.92 62.35 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.267 -0.895 . . . . 0.0 110.897 -179.603 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.55 ' O ' HD23 ' A' ' 41' ' ' LEU . 0.8 OUTLIER -72.22 -25.77 61.77 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 120.923 -1.111 . . . . 0.0 110.227 -178.952 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.536 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 38.1 m-85 -81.5 -51.38 8.34 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.538 -1.351 . . . . 0.0 109.275 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 64.3 m . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.147 -0.97 . . . . 0.0 110.32 -179.782 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 36.1 mtm180 . . . . . 0 N--CA 1.492 1.675 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 24.6 mt -67.29 -28.21 67.82 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.124 -0.985 . . . . 0.0 109.691 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.509 ' HG2' HH11 ' A' ' 68' ' ' ARG . 0.0 OUTLIER -63.23 -37.69 88.22 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.189 -0.944 . . . . 0.0 109.552 -179.649 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 7.2 mtt -84.67 -49.72 8.27 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.194 -0.941 . . . . 0.0 109.569 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -52.35 -32.19 37.13 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.857 -1.152 . . . . 0.0 110.427 -179.485 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -84.13 -52.35 6.35 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.086 -1.008 . . . . 0.0 111.004 -178.711 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 16.3 t60 -55.33 -41.77 72.9 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.003 -1.061 . . . . 0.0 110.179 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 71.3 t -70.53 -50.48 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 120.69 -1.256 . . . . 0.0 109.203 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.435 ' O ' ' OD1' ' A' ' 78' ' ' ASP . 6.3 mmt -63.63 -19.87 65.23 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.21 -0.931 . . . . 0.0 110.23 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -99.33 -38.65 8.76 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 120.791 -1.193 . . . . 0.0 111.004 -178.855 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -93.47 -11.75 31.33 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 120.784 -1.198 . . . . 0.0 111.985 -178.264 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 98.1 t -114.64 -33.18 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.495 0 CA-C-N 120.3 1.409 . . . . 0.0 110.313 179.424 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.584 ' OD2' ' NE2' ' A' ' 81' ' ' GLN . 10.4 p-10 -51.33 109.65 0.36 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.598 -1.313 . . . . 0.0 108.821 179.058 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.579 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -87.78 -61.93 1.61 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 120.842 -1.161 . . . . 0.0 110.032 -178.13 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 18.0 p-10 -102.96 18.19 22.22 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.289 -0.882 . . . . 0.0 109.786 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.584 ' NE2' ' OD2' ' A' ' 78' ' ' ASP . 24.7 mm-40 42.58 75.4 0.09 Allowed 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.485 -0.759 . . . . 0.0 111.112 178.091 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.577 ' C ' ' H ' ' A' ' 84' ' ' LEU . 28.3 t70 -131.24 16.38 5.03 Favored 'General case' 0 N--CA 1.499 1.978 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.368 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 35.1 mtm180 60.82 -3.67 0.15 Allowed 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 -178.797 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.577 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.0 mp -124.59 134.57 52.9 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 78.4 t -111.58 125.87 68.93 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.985 0 O-C-N 121.654 -0.654 . . . . 0.0 109.666 -178.823 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 62.2 p -96.88 163.35 13.01 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.188 -0.945 . . . . 0.0 108.98 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.0 tp -66.3 -36.68 83.57 Favored 'General case' 0 N--CA 1.492 1.665 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 74.8 mt-10 -60.27 -68.69 0.27 Allowed 'General case' 0 C--N 1.295 -1.779 0 O-C-N 121.62 -0.675 . . . . 0.0 110.915 -178.287 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.579 ' CB ' HG21 ' A' ' 79' ' ' THR . 29.8 mm-40 -59.74 -30.24 68.7 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.236 -0.915 . . . . 0.0 110.547 -178.614 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -64.82 -50.93 64.78 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.936 -1.103 . . . . 0.0 109.663 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 68.1 mt -49.97 -43.32 50.2 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.156 -0.965 . . . . 0.0 108.998 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -51.78 -60.95 2.59 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.222 -0.923 . . . . 0.0 110.033 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 98.8 p -45.12 -26.32 0.45 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.193 -0.942 . . . . 0.0 110.089 -179.45 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 23.3 p . . . . . 0 N--CA 1.499 1.997 0 O-C-N 121.328 -0.858 . . . . 0.0 109.468 179.634 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 . . . . . 0 N--CA 1.498 1.93 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -57.7 -14.73 18.31 Favored 'Trans proline' 0 C--N 1.323 -0.806 0 C-N-CA 121.034 1.156 . . . . 0.0 110.266 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -55.9 -33.61 64.8 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.373 -0.829 . . . . 0.0 110.493 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 53.0 m -74.4 -41.81 60.28 Favored 'General case' 0 C--N 1.307 -1.268 0 O-C-N 120.89 -1.131 . . . . 0.0 110.385 -178.866 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.617 ' CE2' ' NE2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -55.86 -34.45 65.48 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -69.61 -36.05 75.83 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.392 -0.818 . . . . 0.0 109.791 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.471 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.7 mt -70.7 -60.48 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.232 0 O-C-N 120.711 -1.243 . . . . 0.0 109.056 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.9 tp -45.37 -36.67 4.37 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.245 -0.91 . . . . 0.0 110.692 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.617 ' NE2' ' CE2' ' A' ' 21' ' ' PHE . 0.4 OUTLIER -77.33 -15.67 59.29 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.4 -1.437 . . . . 0.0 109.451 179.787 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.471 ' N ' ' O ' ' A' ' 23' ' ' ILE . 68.6 m-20 -78.8 87.58 4.67 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.119 -0.988 . . . . 0.0 108.92 179.243 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 19.9 mt -71.4 -52.43 26.59 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 O-C-N 121.277 -0.89 . . . . 0.0 110.806 -178.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.428 ' N ' ' OD1' ' A' ' 28' ' ' ASN . 3.2 m-20 -86.38 11.6 12.0 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.826 -1.171 . . . . 0.0 109.84 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 27.6 p 44.42 56.31 5.09 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.201 -0.937 . . . . 0.0 110.245 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.407 ' OD1' ' O ' ' A' ' 32' ' ' VAL . 41.8 p-10 -98.07 -5.94 32.78 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.236 -0.915 . . . . 0.0 108.603 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 79.97 -1.7 78.27 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.914 -1.274 . . . . 0.0 109.914 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.407 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 0.9 OUTLIER -143.59 163.55 15.71 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 121.072 -1.252 . . . . 0.0 108.545 178.412 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.451 HD21 ' OD1' ' A' ' 26' ' ' ASP . 39.7 mt -113.22 125.63 54.53 Favored 'General case' 0 N--CA 1.514 2.734 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 178.292 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.426 ' OD1' ' OE2' ' A' ' 37' ' ' GLU . 42.6 p-10 -103.69 173.85 6.12 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.316 -0.865 . . . . 0.0 109.73 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 61.2 mt-10 -55.8 -8.86 0.46 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.547 -0.72 . . . . 0.0 110.157 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 40.1 mm-40 -83.35 -43.24 16.16 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.86 -1.15 . . . . 0.0 108.786 179.033 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.53 ' N ' ' OE1' ' A' ' 37' ' ' GLU . 0.3 OUTLIER -70.54 -29.26 65.68 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 179.34 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.407 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 10.2 mp -83.1 -39.43 21.13 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.234 -0.916 . . . . 0.0 108.936 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -64.07 -49.58 71.76 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.788 -1.195 . . . . 0.0 108.728 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.97 -28.4 67.42 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.418 -0.801 . . . . 0.0 110.559 -179.557 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 32.5 tp -76.26 -28.52 57.12 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.991 -1.068 . . . . 0.0 110.88 -178.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.407 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 29.6 m-85 -74.46 -49.03 23.9 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 120.058 -1.651 . . . . 0.0 108.442 179.358 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 59.4 m . . . . . 0 N--CA 1.488 1.446 0 O-C-N 121.288 -0.883 . . . . 0.0 110.246 -179.915 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.518 ' CG ' HH11 ' A' ' 66' ' ' ARG . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.304 0.573 . . . . 0.0 109.711 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.63 HD12 ' C ' ' A' ' 67' ' ' LEU . 0.6 OUTLIER -73.58 -27.36 61.27 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.348 -0.845 . . . . 0.0 109.722 -179.525 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? -59.9 -39.88 86.9 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.06 -1.025 . . . . 0.0 109.387 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 10.6 mtt -86.09 -50.1 7.28 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.011 -1.055 . . . . 0.0 109.297 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 62.4 ttt180 -54.65 -46.79 74.05 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.976 -1.078 . . . . 0.0 110.761 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -74.34 -53.0 10.55 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.95 -1.094 . . . . 0.0 111.303 -178.391 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 36.7 t-80 -54.4 -41.15 68.93 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.954 -1.091 . . . . 0.0 110.248 -179.196 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 71.9 t -73.13 -53.45 18.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 120.765 -1.209 . . . . 0.0 109.581 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.428 ' O ' ' CG ' ' A' ' 78' ' ' ASP . 28.7 mtp -64.35 -17.42 63.7 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.121 -0.987 . . . . 0.0 109.916 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 26.2 ttpt -95.73 -37.31 10.83 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 120.783 -1.198 . . . . 0.0 110.385 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -98.01 -10.49 24.33 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.018 -1.051 . . . . 0.0 112.065 -178.458 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 95.1 t -114.93 -32.93 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.595 0 O-C-N 120.407 -1.433 . . . . 0.0 110.337 179.309 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.428 ' CG ' ' O ' ' A' ' 74' ' ' MET . 19.0 p-10 -49.28 111.99 0.57 Allowed 'General case' 0 N--CA 1.498 1.929 0 O-C-N 120.642 -1.286 . . . . 0.0 108.645 178.746 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -90.06 -68.77 0.76 Allowed 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.145 -0.972 . . . . 0.0 110.645 -177.53 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.509 ' O ' ' N ' ' A' ' 82' ' ' ASP . 30.0 m-20 -97.27 25.61 5.43 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.02 -1.05 . . . . 0.0 108.34 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.512 ' N ' ' OE1' ' A' ' 81' ' ' GLN . 0.2 OUTLIER 35.19 29.12 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.087 178.106 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.509 ' N ' ' O ' ' A' ' 80' ' ' ASN . 59.7 t0 -82.81 14.59 3.13 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 178.196 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.518 ' CG ' HH11 ' A' ' 83' ' ' ARG . 4.1 mtt-85 61.87 3.69 0.97 Allowed 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -178.15 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.495 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.7 mp -125.2 134.24 52.44 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 71.6 t -111.69 130.5 65.16 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 O-C-N 121.618 -0.676 . . . . 0.0 109.55 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 60.1 p -103.59 165.16 11.2 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.325 -0.859 . . . . 0.0 108.859 179.057 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.8 tp -66.37 -36.05 81.88 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.246 -0.909 . . . . 0.0 108.624 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -58.05 -69.32 0.18 Allowed 'General case' 0 C--N 1.295 -1.787 0 O-C-N 121.292 -0.88 . . . . 0.0 111.123 -178.349 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -62.73 -30.94 71.8 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.196 -0.94 . . . . 0.0 110.903 -178.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -60.8 -51.04 71.02 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.789 -1.195 . . . . 0.0 109.39 -179.472 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -51.16 -48.64 61.83 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 179.124 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -44.33 -49.3 9.56 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.441 -0.787 . . . . 0.0 110.465 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 46.6 m -60.43 -29.91 69.3 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.065 -1.022 . . . . 0.0 110.558 -178.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 30.3 p . . . . . 0 N--CA 1.501 2.099 0 O-C-N 121.112 -0.992 . . . . 0.0 110.308 -179.506 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 24.5 m120 . . . . . 0 N--CA 1.492 1.628 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -59.23 -11.67 13.85 Favored 'Trans proline' 0 C--N 1.32 -0.926 0 C-N-CA 121.272 1.314 . . . . 0.0 110.252 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.1 ttpm? -57.3 -40.92 78.87 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.285 -0.885 . . . . 0.0 110.718 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 48.6 m -66.33 -39.71 89.42 Favored 'General case' 0 C--N 1.307 -1.261 0 O-C-N 120.863 -1.148 . . . . 0.0 110.248 -178.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -55.96 -34.7 65.95 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -68.77 -35.34 76.95 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.317 -0.864 . . . . 0.0 109.741 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.6 mt -72.58 -61.56 1.65 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 O-C-N 120.764 -1.21 . . . . 0.0 108.865 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.7 tp -46.38 -35.83 5.85 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.198 -0.939 . . . . 0.0 110.765 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.521 ' O ' ' ND1' ' A' ' 25' ' ' HIS . 0.9 OUTLIER -78.88 -14.57 59.16 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.46 -1.4 . . . . 0.0 109.691 -179.971 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.435 ' OD1' HD21 ' A' ' 33' ' ' LEU . 94.5 m-20 -78.97 92.9 5.0 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.98 -1.075 . . . . 0.0 108.875 179.108 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.416 HD13 HG21 ' A' ' 27' ' ' ILE . 23.1 mt -75.09 -52.28 19.24 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.322 0 O-C-N 121.235 -0.916 . . . . 0.0 110.724 -178.783 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 19.0 m-20 -87.42 12.69 11.54 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 120.848 -1.158 . . . . 0.0 110.086 -179.51 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.4 m 43.94 55.92 4.98 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.204 -0.935 . . . . 0.0 110.611 178.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.418 ' OD1' ' O ' ' A' ' 30' ' ' ASP . 12.0 t70 -98.19 -3.09 38.32 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.106 -0.996 . . . . 0.0 108.66 179.357 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 75.65 0.62 63.9 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -179.619 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -143.41 164.53 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.235 -1.156 . . . . 0.0 108.683 178.555 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.435 HD21 ' OD1' ' A' ' 26' ' ' ASP . 66.0 mt -114.63 128.98 56.61 Favored 'General case' 0 N--CA 1.516 2.866 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 178.189 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 40.4 p-10 -107.96 163.88 12.75 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.297 -0.877 . . . . 0.0 109.843 -179.423 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.417 ' OE2' ' O ' ' A' ' 35' ' ' GLU . 0.4 OUTLIER -51.67 -11.36 0.14 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.51 -0.744 . . . . 0.0 110.379 -179.612 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 40.2 mm-40 -82.57 -36.59 26.09 Favored 'General case' 0 C--N 1.297 -1.704 0 O-C-N 120.801 -1.187 . . . . 0.0 109.559 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -72.86 -33.6 66.21 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.086 -1.009 . . . . 0.0 109.234 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.4 mt -82.22 -36.27 27.39 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.16 -0.962 . . . . 0.0 109.249 178.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -60.83 -41.86 96.61 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 120.758 -1.213 . . . . 0.0 108.944 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.81 -29.56 62.23 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.248 -0.908 . . . . 0.0 110.515 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.545 ' O ' HD23 ' A' ' 41' ' ' LEU . 0.8 OUTLIER -76.66 -24.96 53.27 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.026 -1.046 . . . . 0.0 110.18 -179.536 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -78.91 -49.88 12.1 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.592 -1.318 . . . . 0.0 108.934 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 34.5 m . . . . . 0 N--CA 1.49 1.528 0 O-C-N 121.217 -0.927 . . . . 0.0 110.371 -179.845 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 8.2 mtm180 . . . . . 0 N--CA 1.493 1.724 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 54.2 mt -67.33 -28.13 67.72 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.229 -0.92 . . . . 0.0 110.148 -179.253 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 6.3 mmm180 -64.3 -42.64 96.27 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.905 -1.122 . . . . 0.0 109.758 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 4.6 mtt -84.29 -50.1 8.15 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.015 -1.053 . . . . 0.0 109.698 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -55.37 -38.06 68.36 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.064 -1.023 . . . . 0.0 110.846 -179.722 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -82.16 -51.84 7.57 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 120.75 -1.219 . . . . 0.0 110.764 -179.068 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 43.8 t-80 -53.86 -37.28 63.51 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.021 -1.049 . . . . 0.0 110.099 -179.473 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 79.4 t -75.07 -54.0 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 120.703 -1.248 . . . . 0.0 109.677 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.44 ' O ' ' CG ' ' A' ' 78' ' ' ASP . 18.9 mtp -65.92 -13.66 60.11 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.221 -0.924 . . . . 0.0 110.302 -179.44 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -89.37 -38.93 13.77 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.357 -1.464 . . . . 0.0 110.713 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ASN . . . . . 0.466 ' OD1' ' N ' ' A' ' 77' ' ' VAL . 46.7 p-10 -102.66 -22.53 13.95 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.106 -0.996 . . . . 0.0 112.285 -178.187 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.466 ' N ' ' OD1' ' A' ' 76' ' ' ASN . 42.1 t -94.69 -34.65 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 O-C-N 120.308 -1.495 . . . . 0.0 109.485 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.579 ' OD2' ' NE2' ' A' ' 81' ' ' GLN . 17.9 p-10 -48.64 101.7 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.864 -1.148 . . . . 0.0 109.158 178.846 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -76.19 -65.47 0.92 Allowed 'General case' 0 C--N 1.295 -1.781 0 O-C-N 120.975 -1.078 . . . . 0.0 110.703 -178.599 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.465 ' O ' ' N ' ' A' ' 82' ' ' ASP . 63.1 t30 -105.51 25.73 10.36 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 121.185 -0.947 . . . . 0.0 109.357 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.579 ' NE2' ' OD2' ' A' ' 78' ' ' ASP . 20.8 mm-40 37.88 29.01 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 121.17 0.51 . . . . 0.0 111.092 178.929 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.534 ' C ' ' H ' ' A' ' 84' ' ' LEU . 17.3 p-10 -84.02 12.91 5.57 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 178.706 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 15.6 mmt180 65.09 -3.22 0.63 Allowed 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 -178.841 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.534 ' H ' ' C ' ' A' ' 82' ' ' ASP . 6.5 mp -122.03 134.59 54.79 Favored 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 107.289 -1.374 . . . . 0.0 107.289 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 74.5 t -113.69 131.67 64.85 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.109 0 O-C-N 121.643 -0.661 . . . . 0.0 109.691 -178.455 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 64.6 p -99.61 166.12 11.29 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.043 -1.035 . . . . 0.0 109.543 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.9 tp -67.3 -36.78 82.21 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 179.518 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.555 ' H ' ' CD ' ' A' ' 88' ' ' GLU . 13.7 mp0 -56.64 -67.62 0.29 Allowed 'General case' 0 C--N 1.294 -1.835 0 O-C-N 121.434 -0.791 . . . . 0.0 110.642 -178.798 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -62.84 -38.0 89.06 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.268 -0.895 . . . . 0.0 111.347 -178.241 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -57.06 -50.94 71.2 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.476 -1.39 . . . . 0.0 109.572 -178.897 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 80.4 mt -50.11 -47.74 53.78 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.102 -0.999 . . . . 0.0 109.008 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -51.06 -59.61 3.99 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.394 -0.817 . . . . 0.0 109.945 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 46.3 t -45.35 -25.93 0.46 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.138 -0.976 . . . . 0.0 110.428 -179.42 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 43.6 p . . . . . 0 N--CA 1.5 2.072 0 O-C-N 121.133 -0.979 . . . . 0.0 109.866 -179.794 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.671 HD22 ' N ' ' A' ' 17' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -59.37 -16.77 36.69 Favored 'Trans proline' 0 C--N 1.32 -0.937 0 C-N-CA 121.436 1.424 . . . . 0.0 111.228 -178.336 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 51.4 tttm -66.81 -36.53 82.6 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.906 -1.121 . . . . 0.0 111.077 -179.053 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.3 m -74.12 -41.6 61.34 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.617 -1.302 . . . . 0.0 110.367 -178.782 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.417 ' CD2' ' NE2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -55.28 -34.26 63.93 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 179.97 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -68.98 -35.96 77.32 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.347 -0.845 . . . . 0.0 109.686 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 97.2 mt -71.34 -61.07 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.225 0 O-C-N 120.827 -1.171 . . . . 0.0 109.007 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.9 tp -46.63 -38.02 9.06 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.31 -0.869 . . . . 0.0 110.751 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.417 ' NE2' ' CD2' ' A' ' 21' ' ' PHE . 0.4 OUTLIER -74.99 -16.24 60.63 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.327 -1.483 . . . . 0.0 109.712 179.871 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -78.71 91.0 4.63 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.981 -1.074 . . . . 0.0 108.527 179.239 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 87.5 mt -75.75 -43.04 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.35 0 O-C-N 121.421 -0.799 . . . . 0.0 110.869 -178.446 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 51.7 t-20 -95.24 12.66 28.14 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.015 -1.053 . . . . 0.0 110.083 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 49.9 p 43.92 53.05 6.47 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.198 -0.939 . . . . 0.0 110.519 178.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -97.19 -3.78 40.27 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.09 -1.006 . . . . 0.0 108.886 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 76.94 -1.36 63.34 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.1 156.33 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 O-C-N 121.287 -1.125 . . . . 0.0 108.298 178.174 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 31.1 mt -114.42 128.86 56.55 Favored 'General case' 0 N--CA 1.512 2.664 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 178.426 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.434 ' OD1' ' OE2' ' A' ' 37' ' ' GLU . 45.0 p-10 -106.21 174.27 5.96 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.31 -0.869 . . . . 0.0 110.436 -179.029 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -52.08 -11.63 0.18 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.808 -0.557 . . . . 0.0 110.12 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 50.1 mm-40 -83.13 -43.0 16.7 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.884 -1.135 . . . . 0.0 109.048 179.413 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.527 ' N ' ' OE1' ' A' ' 37' ' ' GLU . 0.3 OUTLIER -73.48 -29.93 62.83 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.312 -0.867 . . . . 0.0 108.789 179.377 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.5 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 10.2 mp -82.13 -40.03 22.45 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.545 -0.722 . . . . 0.0 109.435 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -70.23 -37.34 74.97 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 120.831 -1.168 . . . . 0.0 109.725 -179.797 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.62 -28.5 61.83 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.256 -0.903 . . . . 0.0 111.028 -179.069 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 mp -76.13 -27.9 57.23 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.85 -1.156 . . . . 0.0 110.525 -178.533 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.5 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 8.0 m-85 -80.91 -45.38 16.84 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 120.655 -1.278 . . . . 0.0 109.545 -179.281 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 51.4 m . . . . . 0 N--CA 1.491 1.589 0 O-C-N 121.129 -0.982 . . . . 0.0 111.098 -178.983 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.1 ttm180 . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.575 HD12 ' C ' ' A' ' 67' ' ' LEU . 0.7 OUTLIER -81.7 -28.36 33.49 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.114 -0.991 . . . . 0.0 109.873 -179.629 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.8 tmm_? -60.59 -36.74 79.29 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.127 -0.983 . . . . 0.0 109.648 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 36.6 mtt -85.73 -37.47 19.33 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.063 -1.023 . . . . 0.0 109.737 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -61.75 -41.51 97.76 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.012 -1.055 . . . . 0.0 111.115 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.465 ' N ' ' CD ' ' A' ' 71' ' ' GLU . 1.3 mp0 -84.02 -52.46 6.29 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 120.965 -1.084 . . . . 0.0 111.147 -178.332 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 28.0 m170 -53.86 -39.81 65.97 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.894 -1.129 . . . . 0.0 110.121 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 72.9 t -75.12 -51.2 22.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 120.756 -1.215 . . . . 0.0 109.932 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 19.6 mtp -67.82 -14.74 63.2 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.934 -1.103 . . . . 0.0 110.094 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 23.6 ttpp -85.24 -32.55 22.54 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.373 -1.454 . . . . 0.0 110.506 -179.309 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ASN . . . . . 0.467 ' OD1' ' N ' ' A' ' 77' ' ' VAL . 43.5 p-10 -111.96 -23.31 10.6 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.18 -0.95 . . . . 0.0 112.647 -177.92 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.467 ' N ' ' OD1' ' A' ' 76' ' ' ASN . 32.5 t -95.13 -38.25 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.49 0 O-C-N 120.458 -1.401 . . . . 0.0 110.61 -178.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.23 102.57 0.86 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.443 -1.411 . . . . 0.0 107.433 178.713 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.404 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -81.33 -52.8 6.91 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.356 -0.84 . . . . 0.0 111.777 -177.475 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.447 ' O ' ' N ' ' A' ' 82' ' ' ASP . 56.8 t-20 -100.0 23.46 9.82 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.199 -0.938 . . . . 0.0 109.641 -179.485 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.427 ' C ' ' O ' ' A' ' 80' ' ' ASN . 33.3 mm-40 32.68 35.73 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 CA-C-O 121.079 0.466 . . . . 0.0 112.088 178.952 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.542 ' C ' ' H ' ' A' ' 84' ' ' LEU . 48.9 t0 -85.45 12.3 8.69 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 178.473 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.528 HH11 ' HG2' ' A' ' 83' ' ' ARG . 4.3 mtt-85 64.9 -4.29 0.49 Allowed 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 -178.427 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.542 ' H ' ' C ' ' A' ' 82' ' ' ASP . 14.7 mt -120.64 134.85 55.25 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 178.689 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 71.6 t -112.04 129.62 67.18 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.561 -0.712 . . . . 0.0 109.831 -178.47 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 32.5 p -105.63 159.15 16.19 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 178.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.2 tp -59.33 -35.6 74.14 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.41 -0.807 . . . . 0.0 109.397 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.527 ' CD ' ' H ' ' A' ' 88' ' ' GLU . 6.2 mp0 -60.7 -68.34 0.31 Allowed 'General case' 0 C--N 1.296 -1.757 0 O-C-N 121.24 -0.912 . . . . 0.0 111.828 -177.303 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.404 ' CB ' HG21 ' A' ' 79' ' ' THR . 6.3 mm-40 -63.03 -32.0 73.27 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.033 -1.042 . . . . 0.0 110.563 -177.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -61.37 -51.89 66.93 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.892 -1.13 . . . . 0.0 109.753 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 68.2 mt -50.48 -48.57 56.68 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.25 -0.906 . . . . 0.0 109.256 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -46.66 -49.43 19.27 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.304 -0.873 . . . . 0.0 109.963 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 48.3 t -56.76 -27.55 59.67 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.199 -0.938 . . . . 0.0 109.882 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 29.4 p . . . . . 0 N--CA 1.5 2.06 0 O-C-N 121.229 -0.919 . . . . 0.0 109.778 179.994 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -58.76 -15.82 28.21 Favored 'Trans proline' 0 C--N 1.319 -0.994 0 C-N-CA 121.532 1.488 . . . . 0.0 110.33 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 69.0 tttt -57.38 -36.01 70.7 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.36 -0.838 . . . . 0.0 110.824 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 38.9 m -70.27 -39.79 74.74 Favored 'General case' 0 N--CA 1.483 1.2 0 O-C-N 120.58 -1.325 . . . . 0.0 110.083 -178.873 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.524 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.08 -50.38 71.18 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.083 -1.081 . . . . 0.0 108.083 179.767 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.524 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 41.7 t80 -54.11 -35.16 61.85 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.539 -0.725 . . . . 0.0 110.406 -179.767 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.531 ' O ' ' N ' ' A' ' 25' ' ' HIS . 97.2 mt -73.9 -61.99 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.204 0 O-C-N 120.694 -1.254 . . . . 0.0 108.974 -179.714 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.2 tp -46.22 -12.87 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.021 -1.049 . . . . 0.0 110.898 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.531 ' N ' ' O ' ' A' ' 23' ' ' ILE . 0.7 OUTLIER -102.24 -15.77 16.52 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 120.535 -1.353 . . . . 0.0 110.205 179.952 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.492 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 58.5 p30 -75.36 70.03 2.22 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.81 -1.181 . . . . 0.0 109.362 179.48 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 63.7 mt -50.2 -52.34 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 O-C-N 121.297 -0.877 . . . . 0.0 110.897 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.403 ' O ' ' C ' ' A' ' 29' ' ' SER . 11.6 m-20 -87.89 14.35 9.0 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 120.726 -1.234 . . . . 0.0 110.376 -179.297 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.403 ' C ' ' O ' ' A' ' 28' ' ' ASN . 8.5 t 41.37 48.27 3.23 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.217 -0.927 . . . . 0.0 110.616 178.53 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -92.9 0.69 57.46 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.948 -1.095 . . . . 0.0 108.855 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 74.82 -0.26 57.77 Favored Glycine 0 N--CA 1.487 2.046 0 N-CA-C 109.343 -1.503 . . . . 0.0 109.343 -179.621 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -135.97 166.11 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 O-C-N 121.429 -1.042 . . . . 0.0 108.784 178.793 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.41 HD21 ' CG ' ' A' ' 25' ' ' HIS . 0.1 OUTLIER -106.13 117.04 33.0 Favored 'General case' 0 N--CA 1.509 2.515 0 N-CA-C 107.44 -1.319 . . . . 0.0 107.44 177.969 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.413 ' OD1' ' N ' ' A' ' 34' ' ' ASP . 0.3 OUTLIER -90.55 165.18 13.91 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.535 -0.728 . . . . 0.0 110.361 -178.397 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -74.99 -39.84 61.03 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.541 -0.725 . . . . 0.0 110.786 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -63.01 -24.44 67.92 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 120.676 -1.265 . . . . 0.0 108.653 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -84.82 -33.0 23.01 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 178.708 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.8 tp -75.84 -32.13 59.65 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 178.179 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 48.9 tt0 -67.43 -41.47 84.75 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 120.961 -1.087 . . . . 0.0 109.068 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.57 -45.42 53.44 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.271 -0.893 . . . . 0.0 110.769 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.423 HD22 ' CE1' ' A' ' 25' ' ' HIS . 39.7 tp -57.86 -23.26 52.14 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.175 -0.953 . . . . 0.0 109.619 -179.458 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -80.05 -51.22 9.29 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 120.967 -1.083 . . . . 0.0 109.057 -179.378 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 29.5 m . . . . . 0 N--CA 1.49 1.571 0 O-C-N 121.122 -0.986 . . . . 0.0 109.994 -179.658 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 57.9 mtt180 . . . . . 0 N--CA 1.491 1.605 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.401 ' O ' ' OE1' ' A' ' 71' ' ' GLU . 42.1 mt -74.33 -29.86 61.78 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.109 -0.994 . . . . 0.0 110.128 -178.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.7 tpp180 -74.43 -38.29 63.06 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.194 -0.941 . . . . 0.0 110.233 -178.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 30.6 mtt -86.36 -46.82 9.92 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 120.956 -1.09 . . . . 0.0 110.096 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 45.1 ttm180 -60.17 -36.98 78.81 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.858 -1.151 . . . . 0.0 110.386 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.401 ' OE1' ' O ' ' A' ' 67' ' ' LEU . 64.2 mt-10 -74.97 -47.78 27.6 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.758 -1.214 . . . . 0.0 110.32 -179.489 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.513 ' CE1' ' OD1' ' A' ' 76' ' ' ASN . 52.0 t-80 -58.04 -38.81 76.95 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.025 -1.047 . . . . 0.0 110.278 -179.329 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 77.9 t -71.86 -55.27 14.06 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 120.785 -1.197 . . . . 0.0 109.815 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 10.4 mtp -64.08 -21.97 66.74 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.054 -1.029 . . . . 0.0 110.107 -179.429 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -91.03 -32.96 15.71 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.497 -1.377 . . . . 0.0 110.252 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ASN . . . . . 0.513 ' OD1' ' CE1' ' A' ' 72' ' ' HIS . 25.3 m120 -100.78 -9.48 21.69 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.008 -1.057 . . . . 0.0 111.691 -178.801 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 99.4 t -118.62 -33.59 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.515 0 O-C-N 120.667 -1.271 . . . . 0.0 110.698 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -48.94 113.78 0.86 Allowed 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.719 -1.238 . . . . 0.0 108.502 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.403 HG23 ' H ' ' A' ' 79' ' ' THR . 0.4 OUTLIER -91.23 -65.54 1.0 Allowed 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.286 -0.884 . . . . 0.0 112.422 -176.11 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 17.7 p30 -107.16 25.03 11.9 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 120.886 -1.134 . . . . 0.0 110.655 -178.415 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 45.34 78.89 0.06 Allowed 'General case' 0 C--N 1.298 -1.657 0 O-C-N 121.514 -0.741 . . . . 0.0 111.679 177.52 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.558 ' C ' ' H ' ' A' ' 84' ' ' LEU . 26.3 t0 -144.81 19.17 1.64 Allowed 'General case' 0 C--N 1.296 -1.754 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.27 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 47.0 mtm180 58.15 -0.34 0.11 Allowed 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -179.075 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.558 ' H ' ' C ' ' A' ' 82' ' ' ASP . 1.8 mp -125.16 135.57 52.75 Favored 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 107.478 -1.304 . . . . 0.0 107.478 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 60.8 t -113.85 130.45 67.96 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.104 0 O-C-N 121.676 -0.64 . . . . 0.0 109.339 -179.014 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 66.9 p -94.64 163.22 13.47 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.034 -1.041 . . . . 0.0 109.386 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.737 HD13 ' C ' ' A' ' 87' ' ' LEU . 1.2 tm? -68.6 -38.58 80.73 Favored 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 108.002 -1.111 . . . . 0.0 108.002 179.723 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -60.19 -69.49 0.22 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.58 -0.7 . . . . 0.0 111.218 -179.65 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -56.46 -30.56 63.04 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.032 -1.042 . . . . 0.0 110.354 -178.658 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -62.03 -51.21 68.93 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.852 -1.155 . . . . 0.0 110.106 -179.108 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 89.1 mt -52.22 -38.97 59.57 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.963 -1.085 . . . . 0.0 108.963 178.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.445 ' O ' ' N ' ' A' ' 94' ' ' THR . . . -57.05 -62.75 1.53 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.266 -0.896 . . . . 0.0 109.937 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 45.9 t -44.09 -22.46 0.06 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.383 -0.823 . . . . 0.0 110.14 -179.69 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.445 ' N ' ' O ' ' A' ' 92' ' ' ALA . 44.4 p . . . . . 0 N--CA 1.498 1.936 0 O-C-N 121.349 -0.844 . . . . 0.0 109.785 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 33.1 t-20 . . . . . 0 N--CA 1.49 1.54 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -65.29 -17.93 59.41 Favored 'Trans proline' 0 C--N 1.317 -1.081 0 C-N-CA 121.497 1.465 . . . . 0.0 110.09 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.6 tttp -57.3 -34.73 69.01 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.361 -0.837 . . . . 0.0 110.981 -179.505 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 47.9 m -72.17 -41.23 67.29 Favored 'General case' 0 N--CA 1.485 1.282 0 O-C-N 120.695 -1.253 . . . . 0.0 110.226 -178.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.562 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -55.86 -43.88 77.54 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.03 -1.044 . . . . 0.0 108.463 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.562 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 45.3 t80 -61.25 -35.61 77.72 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.45 -0.781 . . . . 0.0 110.355 -179.778 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.401 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.6 mt -73.38 -61.0 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.194 0 O-C-N 120.746 -1.221 . . . . 0.0 109.162 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 22.1 tp -46.33 -34.69 4.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.178 -0.952 . . . . 0.0 110.708 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.45 ' ND1' ' N ' ' A' ' 25' ' ' HIS . 0.3 OUTLIER -79.73 -16.05 56.37 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.314 -1.491 . . . . 0.0 109.705 179.859 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.401 ' N ' ' O ' ' A' ' 23' ' ' ILE . 10.1 t0 -78.42 92.27 4.58 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.036 -1.04 . . . . 0.0 108.798 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 6.4 mt -73.37 -49.66 35.75 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 O-C-N 121.527 -0.733 . . . . 0.0 111.123 -178.488 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 -88.13 8.1 28.49 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.78 -1.2 . . . . 0.0 110.344 -179.445 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.4 p 45.48 60.31 3.14 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.061 -1.024 . . . . 0.0 110.537 179.144 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -101.55 -1.78 32.11 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.286 -0.884 . . . . 0.0 108.891 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 77.59 -1.95 64.88 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.959 -1.256 . . . . 0.0 109.959 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.21 165.41 29.25 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.213 0 O-C-N 121.41 -1.053 . . . . 0.0 108.302 178.303 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.7 tp -116.93 123.17 46.32 Favored 'General case' 0 N--CA 1.513 2.708 0 N-CA-C 107.853 -1.165 . . . . 0.0 107.853 178.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.418 ' OD1' ' OE2' ' A' ' 37' ' ' GLU . 36.2 p-10 -107.77 172.87 6.59 Favored 'General case' 0 N--CA 1.509 2.493 0 CA-C-O 122.179 0.99 . . . . 0.0 111.493 -178.288 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -58.8 -10.59 2.48 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.368 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 41.7 mm-40 -83.03 -48.95 10.07 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.728 -1.232 . . . . 0.0 108.814 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.512 ' N ' ' OE1' ' A' ' 37' ' ' GLU . 0.3 OUTLIER -67.55 -30.26 69.85 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 179.04 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.8 tp -82.09 -33.15 29.91 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.56 -0.712 . . . . 0.0 109.375 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -72.75 -44.21 61.91 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 120.857 -1.152 . . . . 0.0 109.199 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.27 -30.26 62.04 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.266 -0.896 . . . . 0.0 111.011 -178.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 41' ' ' LEU . 40.4 mt -75.56 -21.94 57.45 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 120.836 -1.165 . . . . 0.0 109.464 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -77.48 -50.26 13.02 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.068 -1.02 . . . . 0.0 108.742 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.5 m . . . . . 0 N--CA 1.49 1.532 0 O-C-N 121.427 -0.796 . . . . 0.0 110.575 -179.266 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 29.5 mtm180 . . . . . 0 N--CA 1.491 1.622 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 33.2 mt -81.61 -28.51 33.7 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.312 -0.867 . . . . 0.0 109.636 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -72.58 -37.2 68.26 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.243 -0.91 . . . . 0.0 110.02 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 12.6 mtt -85.63 -35.39 20.99 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 120.99 -1.069 . . . . 0.0 109.567 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 64.4 ttt180 -72.0 -33.55 68.17 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.761 -1.212 . . . . 0.0 109.801 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -78.48 -46.56 19.37 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.884 -1.135 . . . . 0.0 109.923 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 42.2 t-80 -60.28 -34.3 73.56 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.153 -0.967 . . . . 0.0 110.154 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 68.9 t -75.0 -55.91 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 O-C-N 120.614 -1.304 . . . . 0.0 109.894 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 5.7 mtt -64.0 -17.45 63.33 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.953 -1.092 . . . . 0.0 110.542 -179.217 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.5 tptm -82.72 -39.05 22.47 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.2 -1.562 . . . . 0.0 110.436 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ASN . . . . . 0.455 ' OD1' ' N ' ' A' ' 77' ' ' VAL . 45.7 p-10 -103.87 -21.89 13.58 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.101 -1.0 . . . . 0.0 112.483 -177.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.455 ' N ' ' OD1' ' A' ' 76' ' ' ASN . 40.5 t -94.99 -35.48 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.414 0 O-C-N 120.404 -1.435 . . . . 0.0 109.507 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -47.57 106.58 0.09 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.043 -1.035 . . . . 0.0 108.889 178.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.56 -72.52 0.33 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.267 -0.895 . . . . 0.0 113.123 -176.791 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.547 ' ND2' ' OD1' ' A' ' 82' ' ' ASP . 15.3 p-10 -106.81 26.88 9.49 Favored 'General case' 0 N--CA 1.513 2.69 0 O-C-N 120.661 -1.274 . . . . 0.0 110.802 -177.288 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 44.7 71.08 0.28 Allowed 'General case' 0 C--N 1.293 -1.869 0 O-C-N 121.433 -0.792 . . . . 0.0 111.185 178.37 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.549 ' C ' ' H ' ' A' ' 84' ' ' LEU . 1.1 m-20 -136.14 18.86 3.2 Favored 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 106.665 -1.606 . . . . 0.0 106.665 177.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 74.0 mtt180 60.69 -2.37 0.18 Allowed 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -178.769 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.549 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.9 mt -119.96 133.89 55.41 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 53.2 t -109.23 131.66 59.44 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 58.8 p -97.77 157.53 16.02 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 120.926 -1.109 . . . . 0.0 109.732 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.734 ' C ' HD13 ' A' ' 87' ' ' LEU . 0.9 OUTLIER -63.13 -36.62 84.2 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 179.425 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.545 ' H ' ' CD ' ' A' ' 88' ' ' GLU . 20.5 mp0 -58.32 -71.84 0.1 Allowed 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.612 -0.68 . . . . 0.0 112.39 -179.648 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -61.3 -32.49 72.34 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.882 -1.136 . . . . 0.0 110.233 -177.564 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -57.27 -48.71 78.18 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 120.934 -1.104 . . . . 0.0 109.258 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.454 ' O ' ' N ' ' A' ' 94' ' ' THR . 54.7 mt -52.05 -47.83 64.91 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.979 -1.076 . . . . 0.0 108.822 178.894 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.414 ' C ' ' O ' ' A' ' 91' ' ' LEU . . . -41.57 -57.29 2.3 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.62 -0.675 . . . . 0.0 109.923 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 40.8 t -53.08 -33.72 53.37 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.299 -0.875 . . . . 0.0 109.486 179.296 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.454 ' N ' ' O ' ' A' ' 91' ' ' LEU . 11.6 p . . . . . 0 N--CA 1.495 1.815 0 O-C-N 121.441 -0.787 . . . . 0.0 109.296 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.7 p-10 . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -63.55 -20.67 69.97 Favored 'Trans proline' 0 C--N 1.318 -1.031 0 C-N-CA 121.449 1.432 . . . . 0.0 110.006 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -55.28 -33.64 63.4 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.179 -0.95 . . . . 0.0 110.773 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.1 m -74.17 -41.64 61.16 Favored 'General case' 0 N--CA 1.484 1.259 0 O-C-N 120.741 -1.225 . . . . 0.0 110.429 -178.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -55.89 -34.65 65.72 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.906 -1.121 . . . . 0.0 108.301 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -70.32 -34.86 73.18 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.402 -0.811 . . . . 0.0 110.089 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.419 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.7 mt -72.4 -60.84 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 O-C-N 120.827 -1.171 . . . . 0.0 109.261 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.2 tp -45.6 -33.55 2.9 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.196 -0.94 . . . . 0.0 110.932 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -83.75 -14.41 51.59 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 120.261 -1.525 . . . . 0.0 109.66 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 23' ' ' ILE . 91.7 m-20 -75.52 94.79 3.2 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.068 -1.02 . . . . 0.0 108.916 179.143 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.411 HD13 HG21 ' A' ' 27' ' ' ILE . 28.4 mt -76.81 -49.93 22.45 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.308 0 O-C-N 121.406 -0.809 . . . . 0.0 110.955 -178.801 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 51.5 t-20 -89.55 7.12 37.9 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 120.706 -1.246 . . . . 0.0 110.106 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 24.6 p 44.35 51.28 7.7 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.097 -1.002 . . . . 0.0 110.624 178.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -93.19 5.37 51.76 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.081 -1.012 . . . . 0.0 108.423 179.077 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 73.61 2.7 61.0 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.669 -1.372 . . . . 0.0 109.669 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -141.94 166.34 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 O-C-N 121.261 -1.141 . . . . 0.0 108.665 178.59 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.1 tp -113.93 112.36 23.2 Favored 'General case' 0 N--CA 1.512 2.631 0 N-CA-C 107.478 -1.305 . . . . 0.0 107.478 178.074 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.58 178.41 6.79 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.503 -0.748 . . . . 0.0 110.645 -178.129 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -73.53 -42.98 61.04 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.467 -0.77 . . . . 0.0 111.25 -178.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.443 ' NE2' ' CG ' ' A' ' 37' ' ' GLU . 1.5 pp0? -60.41 -24.46 65.18 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 120.513 -1.367 . . . . 0.0 108.591 -179.732 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.443 ' CG ' ' NE2' ' A' ' 36' ' ' GLN . 78.4 mt-10 -85.35 -33.28 22.08 Favored 'General case' 0 N--CA 1.498 1.954 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 178.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.1 tp -71.48 -35.49 70.84 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.55 -0.719 . . . . 0.0 109.336 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -74.3 -51.58 14.8 Favored 'General case' 0 C--N 1.306 -1.32 0 O-C-N 121.163 -0.96 . . . . 0.0 110.825 -179.143 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.8 -33.66 76.38 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.879 -1.138 . . . . 0.0 110.876 -178.704 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 40.1 tp -73.17 -27.83 61.87 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.956 -1.09 . . . . 0.0 110.089 -179.001 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -82.18 -47.9 11.93 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 120.716 -1.24 . . . . 0.0 110.156 -179.347 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 18.4 m . . . . . 0 C--N 1.3 -1.583 0 O-C-N 120.942 -1.099 . . . . 0.0 110.392 -179.216 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? . . . . . 0 N--CA 1.493 1.687 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 38.2 mt -83.37 -27.27 29.79 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.629 -0.669 . . . . 0.0 109.533 179.066 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -68.42 -36.89 79.73 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.928 -1.108 . . . . 0.0 109.682 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.4 mmt -84.57 -50.76 7.41 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.033 -1.042 . . . . 0.0 109.64 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 41.4 ttp180 -54.69 -38.29 66.83 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.878 -1.139 . . . . 0.0 110.309 -179.442 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -78.35 -53.09 7.67 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.978 -1.077 . . . . 0.0 110.508 -179.029 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 27.8 t-80 -56.42 -33.23 65.63 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.019 -1.05 . . . . 0.0 109.506 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 58.4 t -75.04 -54.69 13.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 120.734 -1.228 . . . . 0.0 109.499 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 32.0 mtp -63.58 -16.3 60.47 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.309 -0.869 . . . . 0.0 110.269 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 42.0 tttp -95.56 -38.24 10.5 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.644 -1.285 . . . . 0.0 110.132 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -98.21 -11.12 23.04 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 120.975 -1.078 . . . . 0.0 112.145 -178.015 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 74.0 t -110.32 -34.87 2.53 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.45 0 O-C-N 120.467 -1.396 . . . . 0.0 109.638 179.124 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -59.29 104.13 0.23 Allowed 'General case' 0 N--CA 1.494 1.764 0 O-C-N 120.562 -1.336 . . . . 0.0 107.778 177.656 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.42 HG23 ' H ' ' A' ' 79' ' ' THR . 0.1 OUTLIER -83.16 -53.63 5.64 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.17 -0.956 . . . . 0.0 111.32 -178.22 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -101.87 24.68 9.6 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.24 -0.913 . . . . 0.0 109.666 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 30.7 mm-40 33.08 37.95 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.568 ' C ' ' H ' ' A' ' 84' ' ' LEU . 16.5 p-10 -91.03 14.61 13.5 Favored 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 178.286 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 37.5 mtm180 64.02 -3.88 0.43 Allowed 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.568 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.4 mp -120.52 134.55 55.26 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 179.41 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 82.7 t -112.23 130.12 66.51 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.945 0 O-C-N 121.606 -0.684 . . . . 0.0 109.815 -178.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 26.4 p -103.43 162.35 13.1 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.246 -0.909 . . . . 0.0 108.667 178.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.8 tp -63.35 -35.54 80.73 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.264 -0.898 . . . . 0.0 109.063 179.617 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -60.73 -68.37 0.31 Allowed 'General case' 0 C--N 1.294 -1.824 0 O-C-N 121.128 -0.982 . . . . 0.0 111.623 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -61.46 -30.73 70.77 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.1 -1.0 . . . . 0.0 110.537 -178.095 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -64.58 -51.64 61.69 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.932 -1.105 . . . . 0.0 109.523 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 52.0 mt -48.39 -42.53 32.12 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.297 -0.877 . . . . 0.0 109.421 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -55.19 -57.77 10.43 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.064 -1.022 . . . . 0.0 110.373 -179.581 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 84.8 p -48.08 -61.87 1.76 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.165 -0.959 . . . . 0.0 110.951 -179.119 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.756 0 O-C-N 121.105 -0.997 . . . . 0.0 110.302 -178.697 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 33.7 t-20 . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.738 -0.468 . . . . 0.0 109.738 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -65.34 -23.05 59.32 Favored 'Trans proline' 0 C--N 1.317 -1.13 0 C-N-CA 121.371 1.381 . . . . 0.0 109.761 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 55.7 tttp -56.77 -41.49 77.73 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.401 -0.812 . . . . 0.0 110.803 -179.639 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 29.3 m -64.82 -40.18 94.78 Favored 'General case' 0 N--CA 1.485 1.321 0 O-C-N 120.76 -1.213 . . . . 0.0 110.355 -178.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -55.33 -41.82 72.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.942 -1.099 . . . . 0.0 108.263 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -62.54 -33.13 74.29 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.395 -0.816 . . . . 0.0 110.149 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.411 ' O ' ' N ' ' A' ' 25' ' ' HIS . 96.6 mt -75.84 -62.61 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 O-C-N 120.725 -1.235 . . . . 0.0 109.129 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.9 tp -47.51 -16.2 0.06 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.068 -1.02 . . . . 0.0 111.257 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.54 ' O ' ' ND1' ' A' ' 25' ' ' HIS . 0.7 OUTLIER -100.77 -15.74 17.55 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.479 -1.388 . . . . 0.0 109.833 179.896 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -76.32 89.55 3.17 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.863 -1.148 . . . . 0.0 108.462 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 10.9 mt -71.85 -52.19 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 O-C-N 121.448 -0.782 . . . . 0.0 111.134 -178.384 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 -86.32 4.48 38.95 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.856 -1.153 . . . . 0.0 110.029 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 18.8 p 46.22 57.65 5.13 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.082 -1.011 . . . . 0.0 110.319 179.321 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -99.8 -0.07 40.55 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.274 -0.891 . . . . 0.0 108.737 179.4 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.85 3.76 87.84 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 110.101 -1.2 . . . . 0.0 110.101 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.12 165.35 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.121 0 O-C-N 121.16 -1.2 . . . . 0.0 108.328 178.037 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.405 HD21 ' CD2' ' A' ' 25' ' ' HIS . 4.4 tp -120.43 115.43 23.47 Favored 'General case' 0 N--CA 1.513 2.703 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 178.665 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.442 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 27.6 p-10 -98.29 -174.21 2.78 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.244 -0.91 . . . . 0.0 111.567 -178.1 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -72.16 -21.23 61.48 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -178.067 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -77.06 -25.86 52.89 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 120.008 -1.683 . . . . 0.0 109.349 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -87.82 -31.84 19.36 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.946 -1.096 . . . . 0.0 108.415 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.2 tp -77.73 -33.58 52.92 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.598 -0.689 . . . . 0.0 109.17 179.072 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -71.85 -44.97 62.94 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.033 -1.042 . . . . 0.0 109.557 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.13 -43.45 64.66 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.043 -1.035 . . . . 0.0 111.3 -178.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.405 ' CD2' ' CD2' ' A' ' 25' ' ' HIS . 35.7 tp -62.39 -24.94 67.66 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.747 -1.221 . . . . 0.0 109.243 -179.404 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.53 -36.34 63.17 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 120.982 -1.074 . . . . 0.0 108.822 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 17.6 m . . . . . 0 C--N 1.302 -1.489 0 O-C-N 121.468 -0.77 . . . . 0.0 111.747 -178.436 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 6.4 mmm180 . . . . . 0 N--CA 1.494 1.744 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 27.3 mt -79.28 -26.88 42.28 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.276 -0.89 . . . . 0.0 110.211 -179.301 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.11 -39.67 82.74 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.025 -1.047 . . . . 0.0 110.368 -178.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 9.8 mtt -86.08 -48.7 8.39 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 120.906 -1.121 . . . . 0.0 110.099 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.485 HH11 ' HG2' ' A' ' 70' ' ' ARG . 2.7 ttt-85 -55.0 -36.22 65.19 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.771 -1.206 . . . . 0.0 109.767 179.832 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -71.91 -50.7 26.91 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 120.847 -1.158 . . . . 0.0 110.276 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 45.0 t-80 -56.23 -35.18 67.08 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.045 -1.034 . . . . 0.0 110.529 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 70.2 t -71.54 -55.12 14.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 120.613 -1.304 . . . . 0.0 109.776 -179.69 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.6 mmt -61.53 -22.13 64.87 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.228 -0.92 . . . . 0.0 110.069 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.408 ' HZ2' ' HB3' ' A' ' 75' ' ' LYS . 0.2 OUTLIER -84.34 -37.04 22.08 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.505 -1.372 . . . . 0.0 111.162 -179.141 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ASN . . . . . 0.483 ' OD1' ' N ' ' A' ' 77' ' ' VAL . 32.2 p-10 -102.01 -24.99 13.91 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 120.961 -1.087 . . . . 0.0 112.611 -177.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.483 ' N ' ' OD1' ' A' ' 76' ' ' ASN . 32.6 t -92.86 -33.22 5.27 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.5 0 O-C-N 120.29 -1.506 . . . . 0.0 110.038 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -65.72 99.12 0.43 Allowed 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 178.311 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.407 HG23 ' H ' ' A' ' 79' ' ' THR . 0.1 OUTLIER -82.68 -56.86 3.6 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.077 -1.014 . . . . 0.0 112.324 -177.099 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.541 ' O ' ' N ' ' A' ' 82' ' ' ASP . 18.3 m-20 -98.28 23.83 7.91 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.063 -1.023 . . . . 0.0 109.591 -178.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.469 ' C ' ' H ' ' A' ' 83' ' ' ARG . 20.3 mm-40 35.65 25.83 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.58 0 CA-C-N 116.31 -0.404 . . . . 0.0 112.015 178.662 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.541 ' N ' ' O ' ' A' ' 80' ' ' ASN . 81.6 m-20 -81.54 11.07 4.93 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 106.696 -1.594 . . . . 0.0 106.696 178.11 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.469 ' H ' ' C ' ' A' ' 81' ' ' GLN . 70.0 mtt180 65.72 -5.74 0.48 Allowed 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 115.131 -0.941 . . . . 0.0 108.737 -178.737 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.518 ' H ' ' C ' ' A' ' 82' ' ' ASP . 10.9 mt -114.35 134.04 55.25 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 107.481 -1.303 . . . . 0.0 107.481 178.717 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 70.4 t -112.15 129.8 66.98 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.875 0 O-C-N 121.51 -0.744 . . . . 0.0 109.391 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 17.5 p -106.17 173.88 6.12 Favored 'General case' 0 N--CA 1.5 2.07 0 N-CA-C 108.166 -1.049 . . . . 0.0 108.166 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.6 tp -69.94 -35.22 74.36 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.213 -0.929 . . . . 0.0 109.422 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -61.04 -67.9 0.36 Allowed 'General case' 0 C--N 1.291 -1.952 0 O-C-N 120.897 -1.127 . . . . 0.0 111.578 -177.592 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -63.12 -30.88 71.94 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.183 -0.948 . . . . 0.0 110.713 -178.057 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -59.72 -52.36 65.82 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.887 -1.133 . . . . 0.0 109.551 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 87.2 mt -50.79 -48.0 59.64 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.234 -0.916 . . . . 0.0 108.963 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.89 -55.12 10.6 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.39 -0.819 . . . . 0.0 110.173 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 51.1 m -57.32 -28.53 63.16 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.978 -1.076 . . . . 0.0 110.633 -178.738 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 29.4 p . . . . . 0 N--CA 1.501 2.118 0 O-C-N 120.993 -1.067 . . . . 0.0 109.881 -179.723 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 45.1 t-20 . . . . . 0 N--CA 1.491 1.61 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -60.03 -15.04 31.17 Favored 'Trans proline' 0 C--N 1.318 -1.055 0 C-N-CA 121.352 1.368 . . . . 0.0 110.115 -179.649 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 58.5 tttp -55.7 -42.2 74.9 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.496 -0.752 . . . . 0.0 111.171 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 58.5 m -69.19 -40.65 77.95 Favored 'General case' 0 N--CA 1.484 1.27 0 O-C-N 120.619 -1.301 . . . . 0.0 110.619 -178.304 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.615 ' CE2' ' NE2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -54.68 -33.86 61.46 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 179.883 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -69.68 -34.89 74.58 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.493 -0.755 . . . . 0.0 109.977 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.458 ' O ' ' N ' ' A' ' 26' ' ' ASP . 97.8 mt -69.36 -59.92 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 O-C-N 120.866 -1.146 . . . . 0.0 109.1 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.7 tp -44.75 -36.47 3.2 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.468 -0.77 . . . . 0.0 110.577 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.615 ' NE2' ' CE2' ' A' ' 21' ' ' PHE . 56.1 m-70 -81.25 -11.88 59.26 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.273 -1.517 . . . . 0.0 109.609 179.631 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.458 ' N ' ' O ' ' A' ' 23' ' ' ILE . 73.3 m-20 -79.91 90.68 5.34 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.02 -1.05 . . . . 0.0 108.812 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.417 HD13 HG21 ' A' ' 27' ' ' ILE . 22.2 mt -75.75 -52.61 17.68 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.354 0 O-C-N 121.283 -0.885 . . . . 0.0 110.878 -178.793 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 15.2 m-20 -86.69 11.22 13.49 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.844 -1.16 . . . . 0.0 109.896 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 25.0 p 43.6 52.65 6.11 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.333 -0.855 . . . . 0.0 110.554 179.048 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -95.0 -2.31 50.62 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.08 -1.012 . . . . 0.0 108.332 179.174 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 76.79 -1.87 61.23 Favored Glycine 0 N--CA 1.488 2.166 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.442 ' O ' HD12 ' A' ' 33' ' ' LEU . 0.9 OUTLIER -143.67 164.9 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.106 0 O-C-N 121.274 -1.133 . . . . 0.0 108.605 178.541 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.442 HD12 ' O ' ' A' ' 32' ' ' VAL . 2.6 mp -121.36 125.6 47.38 Favored 'General case' 0 N--CA 1.519 3.006 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 178.04 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -108.03 -176.82 3.16 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.06 -1.025 . . . . 0.0 110.26 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -59.5 -13.21 8.1 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.676 -0.64 . . . . 0.0 111.042 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -81.17 -27.68 35.31 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.53 -1.356 . . . . 0.0 109.25 179.724 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -83.9 -37.46 22.35 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.961 -1.087 . . . . 0.0 109.652 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.537 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 1.5 mt -75.59 -30.7 59.7 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.712 -1.243 . . . . 0.0 108.476 178.883 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -61.73 -45.64 93.05 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 178.697 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.93 -28.42 61.51 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.395 -0.816 . . . . 0.0 110.733 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.405 HD23 ' O ' ' A' ' 41' ' ' LEU . 0.6 OUTLIER -73.96 -27.11 60.83 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 120.874 -1.141 . . . . 0.0 110.313 -178.983 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.537 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 37.9 m-85 -80.98 -49.91 10.35 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.677 -1.265 . . . . 0.0 108.989 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 49.0 m . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.16 -0.963 . . . . 0.0 111.169 -179.302 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.548 ' CG ' HH11 ' A' ' 66' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.525 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 22.8 mt -76.92 -27.4 54.88 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.385 -0.822 . . . . 0.0 109.87 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.524 ' CG ' HH11 ' A' ' 68' ' ' ARG . 0.0 OUTLIER -73.81 -38.1 64.69 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.023 -1.048 . . . . 0.0 109.88 -179.556 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 23.7 mtt -86.47 -41.59 14.27 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 120.673 -1.267 . . . . 0.0 109.182 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -68.3 -39.74 81.96 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.14 -0.975 . . . . 0.0 110.479 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -84.51 -51.52 6.84 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.987 -1.071 . . . . 0.0 111.419 -178.507 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 56.9 t60 -53.76 -40.75 66.47 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.875 -1.141 . . . . 0.0 110.292 -178.689 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 69.2 t -73.94 -47.23 43.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 120.716 -1.24 . . . . 0.0 109.616 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.502 ' SD ' ' OD2' ' A' ' 78' ' ' ASP . 3.4 mmt -69.5 -17.16 63.57 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.126 -0.984 . . . . 0.0 110.275 -179.648 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.495 ' HB3' ' HZ3' ' A' ' 75' ' ' LYS . 6.4 ttpm? -90.64 -34.64 15.36 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.362 -1.461 . . . . 0.0 111.159 -178.733 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ASN . . . . . 0.471 ' OD1' ' N ' ' A' ' 77' ' ' VAL . 33.8 p-10 -106.37 -26.49 11.46 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 120.95 -1.094 . . . . 0.0 113.079 -177.67 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.471 ' N ' ' OD1' ' A' ' 76' ' ' ASN . 40.9 t -94.44 -31.03 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.551 0 O-C-N 120.286 -1.509 . . . . 0.0 110.503 -179.018 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.502 ' OD2' ' SD ' ' A' ' 74' ' ' MET . 1.6 m-20 -69.06 103.53 1.89 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 120.447 -1.408 . . . . 0.0 107.652 178.538 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.429 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -83.23 -53.19 5.95 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.217 -0.927 . . . . 0.0 111.45 -177.829 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.462 ' O ' ' N ' ' A' ' 82' ' ' ASP . 8.7 t-20 -101.16 23.92 10.18 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 121.201 -0.937 . . . . 0.0 109.578 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.411 ' C ' ' O ' ' A' ' 80' ' ' ASN . 33.2 mm-40 31.63 35.97 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 178.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.552 ' C ' ' H ' ' A' ' 84' ' ' LEU . 26.2 t0 -85.27 11.9 9.15 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 178.399 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 36.0 mtm180 65.34 -4.77 0.51 Allowed 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 -178.351 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.552 ' H ' ' C ' ' A' ' 82' ' ' ASP . 4.4 mp -121.08 134.61 55.27 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 179.117 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 76.1 t -113.85 130.17 68.45 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 O-C-N 121.514 -0.741 . . . . 0.0 110.321 -178.383 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 47.4 p -100.04 173.76 6.49 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 178.257 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.1 tp -73.6 -36.91 65.56 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.206 -0.934 . . . . 0.0 109.229 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 -63.6 -60.27 3.55 Favored 'General case' 0 C--N 1.29 -2.013 0 O-C-N 120.823 -1.173 . . . . 0.0 111.678 -177.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.429 ' CB ' HG21 ' A' ' 79' ' ' THR . 13.4 mm-40 -63.66 -32.54 74.06 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.644 -1.285 . . . . 0.0 110.139 -178.253 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -66.01 -52.43 49.41 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.677 -1.265 . . . . 0.0 109.35 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.4 mp -46.85 -45.6 20.35 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.241 -0.912 . . . . 0.0 108.877 179.072 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -52.42 -57.6 9.35 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.199 -0.938 . . . . 0.0 110.214 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 40.6 m -45.09 -27.83 0.64 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.242 -0.911 . . . . 0.0 109.977 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 29.3 p . . . . . 0 N--CA 1.497 1.912 0 O-C-N 121.35 -0.844 . . . . 0.0 108.723 178.866 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 72.3 m-20 . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -62.84 -18.76 66.28 Favored 'Trans proline' 0 C--N 1.318 -1.071 0 C-N-CA 121.573 1.515 . . . . 0.0 110.013 -179.692 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -55.17 -36.84 66.29 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.404 -0.81 . . . . 0.0 110.924 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.5 m -72.21 -40.91 67.47 Favored 'General case' 0 N--CA 1.484 1.266 0 O-C-N 120.802 -1.186 . . . . 0.0 110.523 -178.421 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -56.24 -34.85 66.74 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.9 -1.125 . . . . 0.0 108.038 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -69.68 -33.6 72.79 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.453 -0.779 . . . . 0.0 109.884 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 98.2 mt -72.85 -60.54 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 O-C-N 120.838 -1.164 . . . . 0.0 109.278 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.51 HD13 ' O ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -45.92 -39.26 8.52 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.297 -0.877 . . . . 0.0 110.798 -179.415 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -78.78 -15.86 57.88 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.332 -1.48 . . . . 0.0 110.155 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -78.38 96.42 5.33 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.984 -1.073 . . . . 0.0 108.64 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.402 HD13 HG21 ' A' ' 27' ' ' ILE . 14.9 mt -75.9 -48.36 29.42 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.363 0 O-C-N 121.501 -0.749 . . . . 0.0 111.032 -178.547 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -89.31 8.04 32.53 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.853 -1.154 . . . . 0.0 110.003 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 46.4 p 44.59 54.75 6.28 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.112 -0.993 . . . . 0.0 110.59 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.462 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 21.0 p-10 -94.77 -3.18 49.59 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.054 -1.029 . . . . 0.0 108.71 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 79.41 -5.69 59.58 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -132.43 165.57 31.76 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 178.507 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.1 tp -116.66 123.5 47.42 Favored 'General case' 0 N--CA 1.515 2.82 0 N-CA-C 107.68 -1.229 . . . . 0.0 107.68 178.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 35.4 p-10 -103.94 179.59 4.23 Favored 'General case' 0 N--CA 1.507 2.379 0 CA-C-O 122.06 0.933 . . . . 0.0 111.038 -178.514 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -68.19 -8.2 36.72 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.389 -179.468 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 43.6 mm-40 -85.66 -47.11 10.12 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 120.812 -1.18 . . . . 0.0 109.292 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -73.91 -29.4 62.03 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.333 -0.854 . . . . 0.0 108.814 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.0 tp -79.23 -40.56 30.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.45 -0.781 . . . . 0.0 109.792 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 47.5 mm-40 -74.65 -44.15 51.8 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.598 -1.314 . . . . 0.0 109.59 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.83 -32.57 71.05 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 120.971 -1.081 . . . . 0.0 110.632 -179.241 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 55.6 tp -76.59 -27.67 55.9 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.906 -1.121 . . . . 0.0 110.481 -178.89 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -81.73 -50.25 9.49 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 120.686 -1.259 . . . . 0.0 109.27 -179.594 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 20.7 m . . . . . 0 N--CA 1.489 1.496 0 O-C-N 121.34 -0.85 . . . . 0.0 110.758 -178.971 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 38.7 ttt180 . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.414 ' O ' ' OE1' ' A' ' 71' ' ' GLU . 24.6 mt -81.88 -28.3 33.0 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.038 -1.039 . . . . 0.0 110.043 -179.59 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.9 -40.41 87.73 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.036 -1.04 . . . . 0.0 109.788 -179.309 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.4 mtm -84.75 -50.23 7.77 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.058 -1.026 . . . . 0.0 109.895 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.4 ttp180 -54.04 -27.69 33.79 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.795 -1.191 . . . . 0.0 109.982 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.414 ' OE1' ' O ' ' A' ' 67' ' ' LEU . 37.5 mt-10 -80.23 -51.22 9.2 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.853 -1.154 . . . . 0.0 110.103 -179.763 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -54.59 -34.48 62.03 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.092 -1.005 . . . . 0.0 110.547 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 72.6 t -73.2 -54.02 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 120.665 -1.272 . . . . 0.0 109.938 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.422 ' O ' ' CG ' ' A' ' 78' ' ' ASP . 2.0 mmt -62.41 -17.77 60.01 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.16 -0.962 . . . . 0.0 109.786 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.47 ' HB2' ' HZ3' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -94.29 -38.57 10.94 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.633 -1.292 . . . . 0.0 111.014 -178.926 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 8.9 m-20 -98.06 -9.16 26.42 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.101 -1.0 . . . . 0.0 112.254 -177.707 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 84.6 t -116.1 -34.1 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.579 0 O-C-N 120.614 -1.304 . . . . 0.0 110.42 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.573 ' OD2' ' NE2' ' A' ' 81' ' ' GLN . 14.5 p-10 -48.93 108.0 0.16 Allowed 'General case' 0 N--CA 1.497 1.925 0 O-C-N 120.684 -1.26 . . . . 0.0 109.099 178.889 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -83.15 -66.62 0.87 Allowed 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.015 -1.053 . . . . 0.0 110.791 -178.024 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.53 ' O ' ' N ' ' A' ' 82' ' ' ASP . 53.1 m-20 -104.62 25.2 10.59 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.109 -0.994 . . . . 0.0 109.351 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.573 ' NE2' ' OD2' ' A' ' 78' ' ' ASP . 21.2 mm-40 37.23 26.28 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.176 0.512 . . . . 0.0 111.135 178.937 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.531 ' C ' ' H ' ' A' ' 84' ' ' LEU . 56.4 t0 -81.32 12.84 3.27 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 178.405 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.468 ' H ' ' C ' ' A' ' 81' ' ' GLN . 72.6 mtt180 65.67 -5.29 0.51 Allowed 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 -178.784 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.531 ' H ' ' C ' ' A' ' 82' ' ' ASP . 9.9 mt -116.08 133.71 55.73 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 178.68 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 69.8 t -111.05 130.95 63.57 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.031 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 51.5 p -104.86 159.37 15.85 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.26 -0.9 . . . . 0.0 109.378 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.0 tp -61.3 -36.61 80.57 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -57.02 -68.55 0.21 Allowed 'General case' 0 C--N 1.294 -1.839 0 O-C-N 121.534 -0.728 . . . . 0.0 110.866 -178.23 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.422 ' O ' ' HB3' ' A' ' 92' ' ' ALA . 56.8 mm-40 -63.94 -34.91 79.04 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.193 -0.942 . . . . 0.0 110.938 -178.556 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -58.3 -49.84 75.74 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.589 -1.319 . . . . 0.0 109.102 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 71.1 mt -51.71 -46.13 63.82 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.098 -1.001 . . . . 0.0 108.844 178.799 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.422 ' HB3' ' O ' ' A' ' 89' ' ' GLU . . . -43.94 -51.36 7.71 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.458 -0.776 . . . . 0.0 110.094 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 93.7 p -58.0 -32.19 67.68 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.313 -0.867 . . . . 0.0 110.734 -179.365 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 22.2 p . . . . . 0 N--CA 1.502 2.172 0 O-C-N 120.999 -1.063 . . . . 0.0 110.271 -179.333 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 . . . . . 0 N--CA 1.498 1.927 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -58.98 -8.74 6.54 Favored 'Trans proline' 0 C--N 1.318 -1.07 0 C-N-CA 121.192 1.262 . . . . 0.0 109.877 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.0 tttp -60.87 -37.18 81.25 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.455 -0.778 . . . . 0.0 110.533 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 48.3 m -70.53 -39.14 74.22 Favored 'General case' 0 C--N 1.308 -1.228 0 O-C-N 120.854 -1.154 . . . . 0.0 110.261 -178.678 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.447 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.11 -39.95 72.98 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.972 -1.08 . . . . 0.0 108.264 179.692 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.447 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 35.9 t80 -64.97 -36.76 85.44 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.319 -0.863 . . . . 0.0 110.543 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.442 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.9 mt -71.5 -61.32 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 O-C-N 120.735 -1.228 . . . . 0.0 109.491 -179.226 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.474 ' O ' HD13 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -46.72 -37.42 8.42 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.098 -1.001 . . . . 0.0 110.178 -179.93 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 4.6 m80 -74.69 -14.74 60.78 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.552 -1.342 . . . . 0.0 109.56 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.442 ' N ' ' O ' ' A' ' 23' ' ' ILE . 65.9 m-20 -76.26 93.22 3.38 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.948 -1.095 . . . . 0.0 108.859 179.052 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 33.0 mt -75.1 -53.18 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 O-C-N 121.135 -0.978 . . . . 0.0 110.731 -178.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 8.3 m-20 -86.42 13.86 7.61 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 120.844 -1.16 . . . . 0.0 109.955 -179.681 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.402 ' O ' ' OG ' ' A' ' 29' ' ' SER . 6.7 t 42.54 51.43 4.86 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.416 -0.803 . . . . 0.0 110.516 178.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -94.44 -4.07 48.94 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.11 -0.994 . . . . 0.0 108.33 179.257 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 77.25 -2.11 62.64 Favored Glycine 0 N--CA 1.489 2.167 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.423 ' O ' HD12 ' A' ' 33' ' ' LEU . 0.9 OUTLIER -140.5 164.82 21.39 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.04 0 O-C-N 121.41 -1.053 . . . . 0.0 108.601 178.929 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.423 HD12 ' O ' ' A' ' 32' ' ' VAL . 3.4 mp -118.43 129.77 55.58 Favored 'General case' 0 N--CA 1.52 3.035 0 N-CA-C 107.872 -1.159 . . . . 0.0 107.872 177.758 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.452 ' O ' ' N ' ' A' ' 36' ' ' GLN . 26.2 p-10 -108.01 168.62 9.16 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.3 -0.875 . . . . 0.0 110.325 -179.076 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -50.8 -8.79 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.552 -0.717 . . . . 0.0 110.458 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.452 ' N ' ' O ' ' A' ' 34' ' ' ASP . 45.7 mm-40 -84.09 -38.28 20.98 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 120.973 -1.079 . . . . 0.0 109.026 178.929 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -77.99 -29.61 49.74 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.211 -0.931 . . . . 0.0 109.012 179.518 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.543 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 10.4 mp -78.02 -40.53 38.65 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.107 -0.996 . . . . 0.0 108.368 179.369 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -69.03 -44.64 72.31 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.967 -1.083 . . . . 0.0 109.474 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.88 -27.9 65.19 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.323 -0.86 . . . . 0.0 110.59 -179.406 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 22.4 tp -75.32 -25.77 58.11 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.501 -1.374 . . . . 0.0 110.706 -178.546 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.543 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 11.4 m-85 -82.88 -39.9 20.94 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 120.296 -1.502 . . . . 0.0 110.287 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 84.8 m . . . . . 0 N--CA 1.492 1.646 0 O-C-N 120.717 -1.239 . . . . 0.0 111.406 -178.442 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 33.5 ttp180 . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 121.397 0.617 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.637 HD12 ' C ' ' A' ' 67' ' ' LEU . 0.6 OUTLIER -79.65 -26.73 40.99 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.31 -0.868 . . . . 0.0 109.716 -179.65 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.77 -38.65 85.97 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.886 -1.134 . . . . 0.0 109.664 -179.685 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 25.9 mtt -83.79 -50.41 8.15 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.927 -1.108 . . . . 0.0 109.864 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 52.8 ttt180 -50.43 -26.57 5.19 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 120.6 -1.312 . . . . 0.0 110.496 -179.461 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 -85.16 -51.78 6.39 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.774 -1.203 . . . . 0.0 110.684 -179.16 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.528 ' CE1' ' OD1' ' A' ' 76' ' ' ASN . 59.2 t-80 -54.82 -39.87 68.96 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.963 -1.086 . . . . 0.0 110.337 -179.281 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 68.9 t -73.29 -53.57 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 120.704 -1.248 . . . . 0.0 109.865 -179.657 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.445 ' O ' ' CG ' ' A' ' 78' ' ' ASP . 4.0 mmt -63.99 -22.8 67.08 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.014 -1.053 . . . . 0.0 109.815 -179.304 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.403 ' NZ ' ' CB ' ' A' ' 75' ' ' LYS . 7.3 ttpm? -89.42 -35.9 15.76 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.641 -1.287 . . . . 0.0 110.727 -178.868 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ASN . . . . . 0.528 ' OD1' ' CE1' ' A' ' 72' ' ' HIS . 5.5 m120 -100.15 -8.95 23.05 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.027 -1.046 . . . . 0.0 112.339 -178.263 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 90.1 t -118.4 -31.56 1.74 Allowed 'Isoleucine or valine' 0 N--CA 1.513 2.684 0 O-C-N 120.497 -1.377 . . . . 0.0 111.063 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.593 ' OD2' ' NE2' ' A' ' 81' ' ' GLN . 17.1 p-10 -48.9 103.42 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.928 0 O-C-N 120.499 -1.375 . . . . 0.0 109.158 179.396 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -78.58 -63.55 1.38 Allowed 'General case' 0 C--N 1.298 -1.647 0 O-C-N 120.754 -1.216 . . . . 0.0 110.259 -178.518 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.445 ' O ' ' N ' ' A' ' 82' ' ' ASP . 47.7 t30 -107.98 26.91 9.79 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.142 -0.974 . . . . 0.0 109.745 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.593 ' NE2' ' OD2' ' A' ' 78' ' ' ASP . 22.6 mm-40 36.64 31.32 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.864 0 CA-C-O 121.203 0.525 . . . . 0.0 111.333 178.817 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.553 ' C ' ' H ' ' A' ' 84' ' ' LEU . 89.9 m-20 -87.34 15.66 6.19 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 178.681 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.504 HH11 ' HG2' ' A' ' 83' ' ' ARG . 6.5 mtt-85 63.17 -2.94 0.39 Allowed 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 -178.574 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.553 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.8 mp -122.73 134.12 54.46 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 179.309 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 75.6 t -112.61 129.52 68.04 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.111 0 O-C-N 121.634 -0.666 . . . . 0.0 109.407 -179.023 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 64.5 p -94.57 167.22 11.62 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 120.967 -1.083 . . . . 0.0 109.121 179.187 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.747 HD13 ' C ' ' A' ' 87' ' ' LEU . 1.0 OUTLIER -70.14 -38.36 75.48 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.685 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -58.94 -69.37 0.2 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.415 -0.803 . . . . 0.0 111.431 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.406 ' N ' ' CD ' ' A' ' 89' ' ' GLU . 4.9 mp0 -56.49 -32.28 64.86 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.008 -1.058 . . . . 0.0 110.497 -178.417 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -61.79 -48.93 78.42 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 120.799 -1.188 . . . . 0.0 110.135 -179.146 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 91' ' ' LEU . 87.4 mt -51.32 -48.39 62.38 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.809 -1.182 . . . . 0.0 108.899 179.172 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -46.22 -59.88 2.64 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.4 -0.812 . . . . 0.0 110.295 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 44.1 t -48.88 -28.05 3.5 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.156 -0.965 . . . . 0.0 110.511 -179.03 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 43.9 p . . . . . 0 N--CA 1.499 2.018 0 O-C-N 121.093 -1.004 . . . . 0.0 108.987 179.645 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 62.9 t-20 . . . . . 0 N--CA 1.491 1.587 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -64.65 -23.53 63.51 Favored 'Trans proline' 0 C--N 1.318 -1.045 0 C-N-CA 121.468 1.445 . . . . 0.0 109.751 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 61.1 tttp -59.21 -40.06 84.62 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.365 -0.834 . . . . 0.0 110.937 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 52.5 m -68.3 -41.5 80.8 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 120.767 -1.208 . . . . 0.0 110.525 -178.482 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -55.54 -36.86 67.24 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.026 -1.046 . . . . 0.0 108.371 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -66.87 -35.61 80.42 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.46 -0.775 . . . . 0.0 110.149 -179.644 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 97.5 mt -71.36 -60.99 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 O-C-N 120.702 -1.249 . . . . 0.0 108.985 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 tp -46.21 -37.51 7.23 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.334 -0.854 . . . . 0.0 110.795 -179.847 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.524 ' O ' ' ND1' ' A' ' 25' ' ' HIS . 0.9 OUTLIER -76.28 -16.22 59.83 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.517 -1.364 . . . . 0.0 109.548 -179.943 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -79.54 94.82 5.69 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.17 -0.956 . . . . 0.0 108.891 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 18.5 mt -75.93 -52.21 18.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 O-C-N 121.322 -0.861 . . . . 0.0 110.819 -178.688 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.55 ' ND2' ' OD2' ' A' ' 30' ' ' ASP . 6.7 p30 -84.57 -2.52 57.51 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.969 -1.082 . . . . 0.0 110.032 -179.615 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.4 m 57.2 53.16 8.04 Favored 'General case' 0 C--N 1.294 -1.828 0 O-C-N 121.19 -0.944 . . . . 0.0 110.345 178.81 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.55 ' OD2' ' ND2' ' A' ' 28' ' ' ASN . 58.1 m-20 -96.21 -1.07 48.99 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.163 -0.961 . . . . 0.0 108.468 179.145 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 76.45 -0.09 65.45 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.46 160.35 16.94 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 O-C-N 121.262 -1.14 . . . . 0.0 108.578 178.064 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 80.3 mt -107.85 128.6 54.75 Favored 'General case' 0 N--CA 1.511 2.616 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 178.384 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.415 ' C ' ' H ' ' A' ' 36' ' ' GLN . 39.2 p-10 -106.58 165.02 11.59 Favored 'General case' 0 N--CA 1.501 2.086 0 CA-C-O 121.757 0.789 . . . . 0.0 110.175 -179.279 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.414 ' O ' ' OE2' ' A' ' 39' ' ' GLU . 62.6 mt-10 -52.76 -8.56 0.09 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.771 -0.581 . . . . 0.0 110.325 -179.614 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.415 ' H ' ' C ' ' A' ' 34' ' ' ASP . 45.6 mm-40 -86.33 -48.88 8.1 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.812 -1.18 . . . . 0.0 109.707 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 59.3 mt-10 -71.12 -29.19 64.94 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.277 -0.889 . . . . 0.0 109.18 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.4 tp -77.83 -39.04 44.92 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.506 -0.746 . . . . 0.0 109.885 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.53 ' N ' ' OE1' ' A' ' 39' ' ' GLU . 0.2 OUTLIER -74.68 -40.37 61.43 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.847 -1.158 . . . . 0.0 109.916 179.993 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.65 -39.31 73.71 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.075 -1.016 . . . . 0.0 111.686 -178.187 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 41.3 tp -73.07 -25.53 60.94 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 120.833 -1.167 . . . . 0.0 110.214 -178.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 1.4 m-30 -84.82 -49.65 8.24 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 120.853 -1.154 . . . . 0.0 109.388 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 16.2 m . . . . . 0 N--CA 1.49 1.56 0 O-C-N 120.994 -1.066 . . . . 0.0 110.054 -179.498 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 43.5 mtm180 . . . . . 0 N--CA 1.493 1.706 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 72.3 mt -57.85 -41.78 83.08 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.097 -1.002 . . . . 0.0 110.124 -178.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -70.21 -37.24 75.01 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.286 -0.884 . . . . 0.0 109.867 -179.378 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -82.52 -32.29 28.77 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.144 -0.972 . . . . 0.0 108.87 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 40.7 ttp180 -73.85 -49.74 23.63 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.02 -1.05 . . . . 0.0 109.915 179.329 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -60.58 -49.43 77.58 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.925 -1.11 . . . . 0.0 110.182 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 13.3 t-160 -54.58 -36.41 64.37 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.169 -0.957 . . . . 0.0 110.259 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 69.5 t -75.5 -54.94 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 120.611 -1.306 . . . . 0.0 109.916 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.414 ' O ' ' CG ' ' A' ' 78' ' ' ASP . 4.1 mmt -63.32 -19.03 64.26 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.032 -1.043 . . . . 0.0 110.188 -179.163 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 72.7 tttt -93.43 -39.72 10.75 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.903 -1.123 . . . . 0.0 111.215 -178.384 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -101.46 -9.47 21.05 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 121.081 -1.012 . . . . 0.0 112.33 -177.706 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 87.1 t -110.62 -35.38 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.471 0 O-C-N 120.475 -1.391 . . . . 0.0 109.692 179.237 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.574 ' OD2' ' NE2' ' A' ' 81' ' ' GLN . 11.9 p-10 -49.1 109.12 0.23 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.763 -1.211 . . . . 0.0 108.649 178.577 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.593 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -85.3 -62.54 1.51 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 120.914 -1.116 . . . . 0.0 110.397 -177.661 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.413 ' N ' ' OG1' ' A' ' 79' ' ' THR . 52.8 t-20 -104.46 17.43 24.14 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.238 -0.914 . . . . 0.0 109.805 -179.557 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.574 ' NE2' ' OD2' ' A' ' 78' ' ' ASP . 25.4 mm-40 43.79 75.01 0.1 Allowed 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.414 -0.804 . . . . 0.0 111.013 177.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.583 ' C ' ' H ' ' A' ' 84' ' ' LEU . 45.8 t0 -132.33 19.44 4.4 Favored 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 107.899 -1.149 . . . . 0.0 107.899 178.525 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.525 HH11 ' CG ' ' A' ' 83' ' ' ARG . 5.1 mtt-85 59.62 -3.51 0.11 Allowed 'General case' 0 N--CA 1.491 1.621 0 CA-C-O 121.478 0.656 . . . . 0.0 109.236 -178.844 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.583 ' H ' ' C ' ' A' ' 82' ' ' ASP . 11.2 mt -123.39 134.96 53.93 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 179.569 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 74.4 t -110.4 128.43 66.68 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.036 0 O-C-N 121.493 -0.754 . . . . 0.0 109.124 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 60.9 p -102.37 156.54 17.52 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.264 -0.898 . . . . 0.0 109.346 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.1 tp -59.06 -39.27 81.55 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.484 -0.76 . . . . 0.0 108.955 179.426 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -58.8 -68.57 0.25 Allowed 'General case' 0 C--N 1.295 -1.803 0 O-C-N 121.607 -0.683 . . . . 0.0 110.993 -177.739 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.593 ' CB ' HG21 ' A' ' 79' ' ' THR . 34.6 mm-40 -61.52 -30.28 70.53 Favored 'General case' 0 C--N 1.299 -1.618 0 O-C-N 121.233 -0.917 . . . . 0.0 110.717 -178.497 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -63.13 -51.68 65.53 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.902 -1.124 . . . . 0.0 109.68 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 78.7 mt -50.33 -45.07 54.58 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.263 -0.898 . . . . 0.0 109.376 179.466 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -51.52 -57.79 8.08 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.236 -0.915 . . . . 0.0 110.162 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 37.7 t -46.34 -34.34 4.5 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.24 -0.913 . . . . 0.0 110.518 -179.414 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 44.0 p . . . . . 0 N--CA 1.495 1.797 0 O-C-N 121.003 -1.06 . . . . 0.0 109.063 179.845 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 . . . . . 0 N--CA 1.489 1.5 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -59.48 -11.76 14.95 Favored 'Trans proline' 0 C--N 1.319 -1.006 0 C-N-CA 121.445 1.43 . . . . 0.0 110.274 -179.364 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 48.4 tttm -56.05 -48.22 76.43 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.337 -0.852 . . . . 0.0 110.495 179.685 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 46.2 m -59.66 -37.98 80.19 Favored 'General case' 0 C--N 1.306 -1.296 0 O-C-N 120.963 -1.086 . . . . 0.0 110.444 -178.625 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.401 ' CD2' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.35 -47.71 78.27 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.915 -1.116 . . . . 0.0 108.126 179.717 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.401 ' N ' ' CD2' ' A' ' 21' ' ' PHE . 20.7 t80 -54.51 -32.7 58.56 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.527 -0.733 . . . . 0.0 109.896 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.48 ' O ' ' N ' ' A' ' 25' ' ' HIS . 96.5 mt -75.04 -61.94 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.223 0 O-C-N 120.814 -1.179 . . . . 0.0 109.676 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 24' ' ' LEU . 20.5 mt -47.74 -13.23 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.785 -1.197 . . . . 0.0 110.742 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.503 ' O ' ' ND1' ' A' ' 25' ' ' HIS . 1.0 OUTLIER -104.62 -14.02 15.76 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.526 -1.359 . . . . 0.0 110.582 -179.417 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.472 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 20.6 p-10 -79.59 70.33 6.05 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 120.827 -1.17 . . . . 0.0 109.238 179.662 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.414 HD12 ' OE2' ' A' ' 37' ' ' GLU . 8.1 mt -50.1 -53.18 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 O-C-N 121.041 -1.037 . . . . 0.0 111.127 -179.13 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.463 ' OD1' ' N ' ' A' ' 28' ' ' ASN . 5.0 p30 -85.85 -1.85 57.67 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.891 -1.131 . . . . 0.0 110.095 -179.412 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.9 p 53.34 50.82 16.69 Favored 'General case' 0 C--N 1.292 -1.895 0 O-C-N 121.289 -0.882 . . . . 0.0 110.49 178.69 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -95.11 3.41 54.79 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 74.47 1.13 60.31 Favored Glycine 0 N--CA 1.489 2.213 0 N-CA-C 109.776 -1.329 . . . . 0.0 109.776 -179.815 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.67 163.39 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.093 0 O-C-N 121.131 -1.217 . . . . 0.0 108.931 178.371 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 68.4 mt -113.7 124.83 53.24 Favored 'General case' 0 N--CA 1.513 2.709 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 178.112 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -105.61 163.0 13.01 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.614 -0.679 . . . . 0.0 109.931 -179.3 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -49.23 -32.29 10.34 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.418 -0.801 . . . . 0.0 111.625 -178.192 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 46.5 mm-40 -64.61 -33.06 75.05 Favored 'General case' 0 C--N 1.293 -1.877 0 O-C-N 120.558 -1.339 . . . . 0.0 109.244 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.414 ' OE2' HD12 ' A' ' 27' ' ' ILE . 33.8 mm-40 -74.34 -38.14 63.34 Favored 'General case' 0 N--CA 1.496 1.852 0 C-N-CA 119.269 -0.972 . . . . 0.0 108.831 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.9 mt -81.58 -39.18 24.96 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.141 -0.975 . . . . 0.0 109.264 178.785 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -59.97 -39.93 87.33 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 120.628 -1.295 . . . . 0.0 108.775 179.096 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.21 -29.39 62.77 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.295 -0.878 . . . . 0.0 110.369 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.524 ' O ' HD23 ' A' ' 41' ' ' LEU . 0.8 OUTLIER -76.45 -24.3 53.89 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.195 -0.941 . . . . 0.0 110.289 -179.173 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -82.7 -50.5 8.65 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.672 -1.267 . . . . 0.0 109.646 -179.454 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 31.3 m . . . . . 0 N--CA 1.491 1.606 0 O-C-N 121.368 -0.833 . . . . 0.0 111.233 -179.036 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 5.9 mtm180 . . . . . 0 N--CA 1.493 1.681 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 64.8 mt -75.05 -28.81 60.55 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.163 -0.961 . . . . 0.0 109.422 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.51 ' HG2' HH11 ' A' ' 68' ' ' ARG . 0.0 OUTLIER -64.67 -40.69 95.85 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.112 -0.992 . . . . 0.0 109.498 -179.683 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 9.1 mtm -86.07 -50.3 7.14 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 120.988 -1.07 . . . . 0.0 109.367 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 24.8 ttt-85 -58.51 -41.71 86.05 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.915 -1.116 . . . . 0.0 110.576 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -74.9 -52.18 11.93 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 120.808 -1.183 . . . . 0.0 110.671 -179.064 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 17.6 t60 -54.32 -41.13 68.65 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.942 -1.099 . . . . 0.0 110.294 -179.487 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 75.3 t -71.34 -49.07 50.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 120.689 -1.257 . . . . 0.0 109.522 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 16.9 mtp -67.81 -19.85 65.12 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.201 -0.937 . . . . 0.0 110.877 -179.296 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 35.1 pttt -88.11 -32.2 18.81 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 120.302 -1.499 . . . . 0.0 110.721 -179.531 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ASN . . . . . 0.476 ' OD1' ' N ' ' A' ' 77' ' ' VAL . 27.6 p-10 -104.91 -27.07 11.93 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.104 -0.997 . . . . 0.0 112.587 -178.09 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.476 ' N ' ' OD1' ' A' ' 76' ' ' ASN . 40.2 t -92.61 -33.7 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 O-C-N 120.253 -1.53 . . . . 0.0 110.236 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -66.04 105.24 1.3 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.467 -1.396 . . . . 0.0 108.001 178.57 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.475 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -83.48 -54.16 5.17 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.298 -0.876 . . . . 0.0 111.417 -178.176 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.427 ' O ' ' C ' ' A' ' 81' ' ' GLN . 30.7 m-20 -100.12 24.84 8.12 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.287 -0.883 . . . . 0.0 109.642 -179.438 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.427 ' C ' ' O ' ' A' ' 80' ' ' ASN . 31.2 mm-40 32.45 37.05 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.569 ' C ' ' H ' ' A' ' 84' ' ' LEU . 26.0 t0 -88.69 13.73 11.66 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 178.414 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 40.8 mtp180 61.93 -2.52 0.29 Allowed 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 -178.476 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.569 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.5 mp -122.92 134.53 54.36 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 106.695 -1.594 . . . . 0.0 106.695 178.916 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 69.0 t -112.84 129.98 67.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.049 0 O-C-N 121.687 -0.633 . . . . 0.0 110.21 -178.207 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 30.1 p -101.78 173.9 6.2 Favored 'General case' 0 N--CA 1.499 1.999 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.568 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.9 tp -73.14 -34.76 66.27 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.164 -0.96 . . . . 0.0 109.236 179.848 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -61.32 -68.24 0.33 Allowed 'General case' 0 C--N 1.293 -1.852 0 O-C-N 121.034 -1.041 . . . . 0.0 111.379 -177.991 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.475 ' CB ' HG21 ' A' ' 79' ' ' THR . 6.4 mm-40 -60.01 -31.36 69.86 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.242 -0.911 . . . . 0.0 110.719 -178.325 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -64.26 -52.37 59.0 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.912 -1.118 . . . . 0.0 110.136 -179.361 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 77.5 mt -49.97 -42.49 48.91 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.124 -0.985 . . . . 0.0 109.301 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -53.39 -57.64 9.92 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.297 -0.877 . . . . 0.0 110.304 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 42.9 t -48.31 -28.9 3.4 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.122 -0.986 . . . . 0.0 109.992 -179.158 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 33.2 p . . . . . 0 N--CA 1.5 2.026 0 O-C-N 121.242 -0.911 . . . . 0.0 108.993 179.677 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.677 HD22 ' N ' ' A' ' 17' ' ' ASN . 0.6 OUTLIER . . . . . 0 N--CA 1.493 1.68 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -68.3 -20.33 42.88 Favored 'Trans proline' 0 C--N 1.318 -1.066 0 C-N-CA 121.585 1.523 . . . . 0.0 110.54 -179.416 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -68.32 -49.42 60.48 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.176 -0.953 . . . . 0.0 111.362 -178.244 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.1 m -63.89 -41.34 97.74 Favored 'General case' 0 N--CA 1.485 1.283 0 O-C-N 120.723 -1.236 . . . . 0.0 110.53 -178.575 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.47 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.05 -39.56 72.21 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.948 -1.095 . . . . 0.0 108.357 -179.803 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.47 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 53.1 t80 -63.35 -34.0 76.76 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.188 -0.945 . . . . 0.0 110.074 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.47 ' O ' ' N ' ' A' ' 26' ' ' ASP . 97.0 mt -69.92 -59.83 3.11 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 O-C-N 120.714 -1.241 . . . . 0.0 109.099 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.7 tp -45.15 -38.91 5.6 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.325 -0.859 . . . . 0.0 110.377 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.405 ' ND1' HD21 ' A' ' 41' ' ' LEU . 13.7 m-70 -75.15 -17.01 60.49 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 120.428 -1.42 . . . . 0.0 109.402 179.488 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.47 ' N ' ' O ' ' A' ' 23' ' ' ILE . 75.7 m-20 -80.02 92.25 5.57 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.094 -1.004 . . . . 0.0 109.066 179.624 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.1 mt -76.3 -45.17 35.36 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.429 0 O-C-N 121.318 -0.863 . . . . 0.0 110.635 -178.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 50.9 t-20 -94.04 8.21 42.28 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.788 -1.195 . . . . 0.0 110.12 -179.626 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 54.3 p 44.67 64.16 1.45 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.152 -0.967 . . . . 0.0 110.749 178.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -104.39 4.93 33.93 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.257 -0.902 . . . . 0.0 108.914 179.294 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 70.93 -0.05 31.53 Favored Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.388 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -139.2 165.32 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.033 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 177.907 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.437 HD12 ' HA ' ' A' ' 33' ' ' LEU . 6.2 tp -106.76 110.16 22.26 Favored 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 178.27 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -80.55 147.87 30.61 Favored 'General case' 0 N--CA 1.498 1.93 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.305 -178.477 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -52.32 -38.52 58.78 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.45 -0.781 . . . . 0.0 110.406 -179.281 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 51.0 mm-40 -64.02 -34.21 77.49 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 120.927 -1.108 . . . . 0.0 108.605 179.544 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -73.46 -33.86 65.08 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 179.161 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.2 tp -76.5 -37.22 57.12 Favored 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.155 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -72.63 -49.7 30.16 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.957 -1.089 . . . . 0.0 110.119 -179.756 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.17 -50.46 61.04 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.895 -1.128 . . . . 0.0 110.902 -178.88 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.405 HD21 ' ND1' ' A' ' 25' ' ' HIS . 40.2 tp -56.16 -26.03 48.92 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.075 -1.015 . . . . 0.0 110.035 -178.702 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -83.13 -49.3 9.64 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 120.896 -1.127 . . . . 0.0 109.379 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 30.1 m . . . . . 0 C--N 1.301 -1.537 0 O-C-N 120.943 -1.098 . . . . 0.0 110.22 -179.303 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 24.9 ttp180 . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 121.272 0.558 . . . . 0.0 109.649 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.644 HD12 ' C ' ' A' ' 67' ' ' LEU . 0.5 OUTLIER -78.83 -26.85 44.22 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.19 -0.944 . . . . 0.0 109.948 -179.622 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.515 ' HG2' HH11 ' A' ' 68' ' ' ARG . 0.0 OUTLIER -65.55 -38.76 90.54 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 120.959 -1.088 . . . . 0.0 109.889 -179.452 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 9.0 mtt -85.05 -29.56 24.83 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.121 -0.987 . . . . 0.0 109.857 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -72.95 -40.86 65.03 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.861 -1.149 . . . . 0.0 110.29 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -73.02 -47.28 46.34 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 120.793 -1.192 . . . . 0.0 110.501 -179.248 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 35.4 t-80 -55.75 -40.87 73.13 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.147 -0.971 . . . . 0.0 110.863 -179.449 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 66.0 t -72.6 -54.18 16.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 120.551 -1.343 . . . . 0.0 110.126 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.7 mmt -61.11 -19.72 61.81 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.141 -0.975 . . . . 0.0 110.018 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 43.4 tttp -82.64 -40.05 21.27 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.662 -1.273 . . . . 0.0 111.399 -178.634 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ASN . . . . . 0.445 ' OD1' ' N ' ' A' ' 77' ' ' VAL . 48.2 p-10 -102.91 -20.77 14.14 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 120.983 -1.073 . . . . 0.0 112.35 -177.842 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.445 ' N ' ' OD1' ' A' ' 76' ' ' ASN . 31.3 t -97.83 -32.02 3.91 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.391 0 O-C-N 120.455 -1.403 . . . . 0.0 110.025 -179.723 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -53.28 107.76 0.27 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.724 -1.235 . . . . 0.0 109.302 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -81.18 -69.11 0.63 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.339 -0.85 . . . . 0.0 112.815 -177.711 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.466 ' O ' ' N ' ' A' ' 82' ' ' ASP . 59.5 m-20 -107.88 27.8 8.86 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 120.879 -1.138 . . . . 0.0 110.748 -177.425 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.481 ' C ' ' H ' ' A' ' 83' ' ' ARG . 22.7 mm-40 42.13 23.24 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.751 0 O-C-N 121.58 -0.7 . . . . 0.0 111.245 178.794 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.504 ' C ' ' H ' ' A' ' 84' ' ' LEU . 37.3 t0 -82.78 13.97 3.51 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 177.881 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.481 ' H ' ' C ' ' A' ' 81' ' ' GLN . 44.0 mtm180 64.05 -2.25 0.59 Allowed 'General case' 0 N--CA 1.486 1.363 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.797 -179.036 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.504 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.3 mt -115.46 133.57 55.9 Favored 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 179.013 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 78.1 t -109.58 130.98 61.7 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 53.8 p -107.03 153.27 22.85 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.138 -0.976 . . . . 0.0 109.81 -179.624 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.4 tp -55.36 -34.62 64.43 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 179.32 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -57.09 -69.42 0.16 Allowed 'General case' 0 C--N 1.296 -1.743 0 O-C-N 121.43 -0.794 . . . . 0.0 111.862 -178.095 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -68.97 -33.24 73.37 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.862 -1.149 . . . . 0.0 110.895 -177.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -56.38 -50.93 70.13 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 120.765 -1.21 . . . . 0.0 108.777 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 52.9 mt -51.65 -49.72 61.77 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.187 -0.945 . . . . 0.0 109.337 179.152 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -44.48 -46.07 9.53 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.415 -0.803 . . . . 0.0 109.85 -179.686 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 53.5 p -57.27 -34.97 69.19 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.363 -0.836 . . . . 0.0 109.712 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 22.2 p . . . . . 0 N--CA 1.497 1.915 0 O-C-N 121.199 -0.938 . . . . 0.0 109.222 179.68 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -63.9 -21.97 68.81 Favored 'Trans proline' 0 C--N 1.318 -1.051 0 C-N-CA 121.402 1.401 . . . . 0.0 109.895 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -58.26 -37.38 74.83 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.165 -0.959 . . . . 0.0 110.801 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 52.7 m -71.52 -40.98 69.75 Favored 'General case' 0 C--N 1.307 -1.263 0 O-C-N 120.742 -1.224 . . . . 0.0 110.565 -178.568 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -55.85 -35.16 66.12 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.88 -1.137 . . . . 0.0 107.969 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -68.2 -33.3 74.18 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.423 -0.798 . . . . 0.0 109.268 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.505 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 96.7 mt -73.13 -61.51 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.217 0 O-C-N 120.882 -1.136 . . . . 0.0 108.992 179.603 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.515 ' O ' HD13 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -44.37 -27.69 0.46 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.889 -1.132 . . . . 0.0 110.725 -179.644 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.528 ' N ' ' ND1' ' A' ' 25' ' ' HIS . 0.2 OUTLIER -90.21 -13.73 34.91 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.142 -1.599 . . . . 0.0 110.31 179.887 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.505 ' OD1' ' O ' ' A' ' 23' ' ' ILE . 20.3 p-10 -74.45 62.37 0.99 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.779 -1.2 . . . . 0.0 109.553 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 64.4 mt -48.83 -52.06 10.48 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 O-C-N 120.929 -1.107 . . . . 0.0 110.977 -179.198 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.402 ' O ' ' C ' ' A' ' 29' ' ' SER . 52.0 t-20 -90.1 12.47 17.71 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.818 -1.176 . . . . 0.0 110.056 -179.459 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.402 ' C ' ' O ' ' A' ' 28' ' ' ASN . 26.5 p 42.23 50.91 4.55 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.261 -0.9 . . . . 0.0 110.699 178.683 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.408 ' OD1' ' O ' ' A' ' 30' ' ' ASP . 10.9 t70 -95.04 -3.89 47.45 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.03 -1.044 . . . . 0.0 108.53 179.365 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.61 4.51 87.72 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 -179.643 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.78 164.19 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 O-C-N 121.177 -1.19 . . . . 0.0 108.876 178.521 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.0 mp -115.43 121.06 41.61 Favored 'General case' 0 N--CA 1.518 2.934 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 177.255 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.544 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 0.2 OUTLIER -105.68 172.91 6.55 Favored 'General case' 0 N--CA 1.505 2.286 0 CA-C-O 121.766 0.794 . . . . 0.0 111.108 -177.82 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -53.92 -40.6 66.84 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.493 -0.755 . . . . 0.0 112.156 -178.635 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.3 pp0? -61.88 -24.45 66.94 Favored 'General case' 0 C--N 1.295 -1.764 0 O-C-N 120.161 -1.587 . . . . 0.0 108.717 -179.799 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -81.09 -40.89 23.41 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.12 -0.987 . . . . 0.0 109.653 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.49 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 6.4 mt -75.81 -30.41 59.02 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.885 -1.134 . . . . 0.0 108.716 178.544 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -60.72 -46.2 91.32 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 120.887 -1.133 . . . . 0.0 108.699 178.825 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.44 -29.58 62.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.455 -0.778 . . . . 0.0 110.706 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -72.67 -25.76 61.38 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.057 -1.027 . . . . 0.0 110.248 -178.919 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.49 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 38.1 m-85 -80.67 -49.27 11.45 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 120.862 -1.149 . . . . 0.0 109.732 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 28.2 m . . . . . 0 N--CA 1.49 1.573 0 O-C-N 121.142 -0.974 . . . . 0.0 111.266 -178.963 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 37.4 mtm180 . . . . . 0 N--CA 1.492 1.636 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 30.1 mt -68.92 -27.67 65.97 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.203 -0.936 . . . . 0.0 109.586 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.3 -41.04 94.5 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.289 -0.882 . . . . 0.0 109.526 -179.62 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.9 mtt -85.8 -50.11 7.4 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.944 -1.098 . . . . 0.0 109.382 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.547 HH11 ' CG ' ' A' ' 70' ' ' ARG . 0.9 OUTLIER -56.1 -45.16 79.55 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.027 -1.045 . . . . 0.0 110.669 -179.703 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -75.55 -52.36 10.8 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.0 -1.063 . . . . 0.0 111.146 -178.683 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 13.8 t60 -55.49 -39.77 70.86 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.062 -1.024 . . . . 0.0 110.455 -179.249 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 72.1 t -71.87 -53.79 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 120.654 -1.279 . . . . 0.0 109.782 -179.687 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.439 ' O ' ' OD1' ' A' ' 78' ' ' ASP . 3.0 mmt -64.67 -15.5 61.41 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.242 -0.911 . . . . 0.0 110.335 -179.694 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -93.86 -38.78 11.05 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.719 -1.238 . . . . 0.0 111.084 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ASN . . . . . 0.466 ' OD1' ' N ' ' A' ' 77' ' ' VAL . 29.7 p-10 -100.61 -26.24 13.89 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 120.947 -1.096 . . . . 0.0 112.039 -178.178 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.466 ' N ' ' OD1' ' A' ' 76' ' ' ASN . 40.3 t -90.63 -36.14 7.97 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.279 0 O-C-N 120.268 -1.52 . . . . 0.0 109.197 179.637 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.576 ' OD2' ' NE2' ' A' ' 81' ' ' GLN . 10.0 p-10 -49.27 109.49 0.27 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.808 -1.182 . . . . 0.0 108.659 178.534 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.603 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -86.94 -64.18 1.19 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.994 -1.066 . . . . 0.0 110.318 -177.567 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.427 ' N ' ' OG1' ' A' ' 79' ' ' THR . 17.9 p-10 -102.41 16.28 26.73 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.244 -0.91 . . . . 0.0 109.574 -179.651 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.576 ' NE2' ' OD2' ' A' ' 78' ' ' ASP . 26.5 mm-40 42.96 74.0 0.13 Allowed 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.495 -0.753 . . . . 0.0 111.09 178.127 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.581 ' C ' ' H ' ' A' ' 84' ' ' LEU . 38.9 t0 -129.45 18.36 5.84 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 178.313 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 78.2 mtt180 61.88 -4.71 0.18 Allowed 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 -178.79 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.581 ' H ' ' C ' ' A' ' 82' ' ' ASP . 9.8 mt -124.26 134.45 53.23 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 75.0 t -109.91 129.42 64.87 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.529 -0.732 . . . . 0.0 109.083 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 65.4 p -101.79 162.15 13.13 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.195 -0.941 . . . . 0.0 109.187 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.8 tp -63.8 -37.64 88.12 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.561 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -58.33 -68.72 0.23 Allowed 'General case' 0 C--N 1.293 -1.872 0 O-C-N 121.468 -0.77 . . . . 0.0 110.894 -178.124 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.603 ' CB ' HG21 ' A' ' 79' ' ' THR . 8.3 mm-40 -61.95 -30.55 70.99 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.324 -0.86 . . . . 0.0 110.863 -178.368 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -64.26 -51.6 62.8 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.763 -1.21 . . . . 0.0 109.539 -179.681 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 67.4 mt -49.12 -44.31 42.26 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.224 -0.923 . . . . 0.0 109.224 179.399 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -51.16 -58.81 5.15 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.326 -0.859 . . . . 0.0 110.054 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 43.2 t -45.61 -29.99 1.38 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.135 -0.978 . . . . 0.0 109.968 -179.481 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 29.9 p . . . . . 0 N--CA 1.497 1.914 0 O-C-N 121.241 -0.912 . . . . 0.0 108.856 179.323 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 25.4 p30 . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -64.82 -17.19 58.74 Favored 'Trans proline' 0 C--N 1.318 -1.066 0 C-N-CA 121.535 1.49 . . . . 0.0 110.299 -179.451 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 43.4 tttm -57.48 -36.84 71.98 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.247 -0.908 . . . . 0.0 110.767 -179.269 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.4 m -69.13 -39.37 78.92 Favored 'General case' 0 C--N 1.306 -1.291 0 O-C-N 120.804 -1.185 . . . . 0.0 110.091 -179.125 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.419 ' CE2' ' CD2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -56.72 -40.5 75.78 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.091 -1.006 . . . . 0.0 108.508 -179.951 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -64.11 -36.28 83.51 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.358 -0.839 . . . . 0.0 110.583 -179.318 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.415 ' O ' ' N ' ' A' ' 26' ' ' ASP . 84.0 mt -73.96 -61.33 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.247 0 O-C-N 120.71 -1.244 . . . . 0.0 109.323 -179.586 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 34.9 tp -46.31 -30.78 2.2 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.098 -1.001 . . . . 0.0 110.743 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.419 ' CD2' ' CE2' ' A' ' 21' ' ' PHE . 1.1 m80 -84.75 -14.73 47.38 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.27 -1.519 . . . . 0.0 109.424 179.537 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.415 ' N ' ' O ' ' A' ' 23' ' ' ILE . 95.0 m-20 -74.81 94.18 2.73 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.151 -0.968 . . . . 0.0 108.895 179.131 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.413 HD13 HG21 ' A' ' 27' ' ' ILE . 25.7 mt -76.64 -51.6 18.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.346 0 O-C-N 121.414 -0.804 . . . . 0.0 110.964 -178.736 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 50.6 t-20 -87.65 7.91 27.81 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 120.753 -1.217 . . . . 0.0 110.03 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 24.8 p 44.03 48.88 7.41 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.165 -0.959 . . . . 0.0 110.528 178.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.511 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 19.6 p-10 -91.98 0.01 57.48 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.128 -0.982 . . . . 0.0 108.489 179.1 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 79.28 -2.77 69.51 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 109.791 -1.324 . . . . 0.0 109.791 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -138.61 164.16 26.83 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 O-C-N 121.286 -1.126 . . . . 0.0 108.673 178.374 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.7 tp -113.92 110.04 19.46 Favored 'General case' 0 N--CA 1.511 2.576 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 177.549 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.72 -176.09 5.13 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.472 -0.768 . . . . 0.0 110.751 -177.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -73.46 -44.49 57.96 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.523 -0.736 . . . . 0.0 111.372 -178.761 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.449 ' NE2' ' CG ' ' A' ' 37' ' ' GLU . 1.5 pp0? -59.29 -25.0 63.75 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 120.455 -1.403 . . . . 0.0 108.323 -179.768 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.449 ' CG ' ' NE2' ' A' ' 36' ' ' GLN . 49.5 mt-10 -85.02 -33.68 22.47 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 179.126 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.4 tp -74.65 -32.27 62.22 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.42 -0.8 . . . . 0.0 109.283 179.108 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.24 -46.51 60.9 Favored 'General case' 0 C--N 1.305 -1.342 0 O-C-N 121.28 -0.888 . . . . 0.0 109.733 -179.524 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.53 -35.51 73.2 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.103 -0.998 . . . . 0.0 110.514 -179.305 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.6 mt -69.3 -25.76 64.39 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.938 -1.101 . . . . 0.0 109.325 -179.758 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.412 ' CZ ' ' SD ' ' A' ' 69' ' ' MET . 0.1 OUTLIER -81.58 -51.81 7.86 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 120.881 -1.137 . . . . 0.0 109.781 -179.13 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 68.6 m . . . . . 0 C--N 1.301 -1.538 0 O-C-N 121.218 -0.926 . . . . 0.0 111.345 -178.392 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ARG . . . . . 0.422 ' CG ' HH11 ' A' ' 66' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 121.21 0.529 . . . . 0.0 109.915 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.633 HD12 ' C ' ' A' ' 67' ' ' LEU . 0.6 OUTLIER -79.68 -27.34 40.78 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.228 -0.92 . . . . 0.0 110.037 -179.149 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -62.05 -39.27 91.8 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.98 -1.075 . . . . 0.0 109.883 -179.347 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' MET . . . . . 0.412 ' SD ' ' CZ ' ' A' ' 42' ' ' PHE . 17.8 ttm -86.11 -33.02 21.02 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.05 -1.031 . . . . 0.0 109.859 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 66.4 ttt180 -65.07 -30.33 71.28 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.593 -1.317 . . . . 0.0 109.363 179.17 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 67.0 mt-10 -77.81 -48.18 17.14 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.205 -0.934 . . . . 0.0 109.975 -179.588 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.519 ' CD2' ' OD1' ' A' ' 76' ' ' ASN . 29.4 t60 -59.63 -35.15 73.81 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.16 -0.962 . . . . 0.0 110.007 -179.488 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 69.6 t -74.47 -54.17 15.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 120.708 -1.245 . . . . 0.0 109.381 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.486 ' SD ' ' OD2' ' A' ' 78' ' ' ASP . 2.7 mmt -58.78 -22.41 58.15 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.087 -1.008 . . . . 0.0 109.298 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.8 ttpt -94.4 -27.66 15.93 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.801 -1.187 . . . . 0.0 110.759 -179.237 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ASN . . . . . 0.519 ' OD1' ' CD2' ' A' ' 72' ' ' HIS . 12.9 m120 -105.95 -12.1 15.94 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.159 -0.963 . . . . 0.0 112.643 -177.897 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 57.3 t -118.13 -34.86 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.533 0 O-C-N 120.372 -1.455 . . . . 0.0 111.397 -178.896 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.486 ' OD2' ' SD ' ' A' ' 74' ' ' MET . 0.9 OUTLIER -67.15 99.48 0.68 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.241 -1.537 . . . . 0.0 107.574 178.929 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.417 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -80.77 -52.25 7.73 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.213 -0.93 . . . . 0.0 111.891 -177.476 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.529 ' O ' ' N ' ' A' ' 82' ' ' ASP . 9.5 t-20 -99.63 24.1 8.69 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.061 -1.024 . . . . 0.0 109.532 -179.406 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.443 ' C ' ' H ' ' A' ' 83' ' ' ARG . 31.2 mm-40 32.95 30.51 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.754 0 CA-C-O 120.985 0.421 . . . . 0.0 112.062 178.697 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.545 ' C ' ' H ' ' A' ' 84' ' ' LEU . 87.0 m-20 -81.03 10.6 4.95 Favored 'General case' 0 C--N 1.299 -1.613 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 178.406 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.443 ' H ' ' C ' ' A' ' 81' ' ' GLN . 25.3 mtp180 65.12 -4.03 0.55 Allowed 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 -178.391 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.545 ' H ' ' C ' ' A' ' 82' ' ' ASP . 4.6 mp -118.48 134.47 55.05 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 178.834 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 88.9 t -112.3 129.39 67.91 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.076 0 O-C-N 121.617 -0.677 . . . . 0.0 109.541 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 22.0 p -103.36 167.22 9.95 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.262 -0.898 . . . . 0.0 108.722 178.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.726 HD13 ' C ' ' A' ' 87' ' ' LEU . 1.2 tm? -65.15 -35.47 81.21 Favored 'General case' 0 C--N 1.297 -1.705 0 O-C-N 121.383 -0.823 . . . . 0.0 108.782 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -61.75 -70.06 0.21 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.946 -1.096 . . . . 0.0 112.811 -178.738 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.417 ' CB ' HG21 ' A' ' 79' ' ' THR . 1.7 mt-10 -59.37 -32.66 70.33 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.773 -1.204 . . . . 0.0 110.914 -177.289 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -58.83 -50.92 72.16 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.92 -1.113 . . . . 0.0 109.901 -179.366 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 78.7 mt -52.78 -48.94 66.49 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 120.924 -1.11 . . . . 0.0 109.602 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -46.66 -44.69 18.7 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.27 -0.894 . . . . 0.0 110.077 -179.52 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 46.5 m -62.41 -30.66 71.38 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.279 -0.888 . . . . 0.0 110.266 -179.309 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 44.6 p . . . . . 0 N--CA 1.498 1.956 0 O-C-N 121.018 -1.051 . . . . 0.0 109.081 179.644 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 63.6 t-20 . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -65.93 -21.92 56.44 Favored 'Trans proline' 0 C--N 1.319 -0.975 0 C-N-CA 121.588 1.525 . . . . 0.0 110.033 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 69.7 tttt -57.3 -35.85 70.35 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.216 -0.928 . . . . 0.0 110.887 -179.283 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.4 m -71.01 -41.24 71.15 Favored 'General case' 0 C--N 1.306 -1.303 0 O-C-N 120.785 -1.197 . . . . 0.0 110.272 -178.67 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.482 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.37 -36.91 69.36 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.042 -1.036 . . . . 0.0 108.487 -179.835 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.482 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 36.4 t80 -67.15 -34.81 78.37 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.335 -0.853 . . . . 0.0 110.135 -179.614 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.1 mt -74.54 -61.18 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.241 0 O-C-N 120.731 -1.23 . . . . 0.0 109.39 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.3 tp -46.57 -37.57 8.24 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.066 -1.021 . . . . 0.0 110.811 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.408 ' N ' ' ND1' ' A' ' 25' ' ' HIS . 0.6 OUTLIER -75.99 -18.26 59.37 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.367 -1.458 . . . . 0.0 109.709 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -75.98 90.67 3.01 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.131 -0.981 . . . . 0.0 108.783 179.323 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.41 HD13 HG21 ' A' ' 27' ' ' ILE . 13.9 mt -71.23 -52.26 28.28 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 O-C-N 121.319 -0.863 . . . . 0.0 110.801 -178.64 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 12.5 m-20 -84.08 11.6 7.72 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.831 -1.168 . . . . 0.0 109.83 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.0 t 43.88 43.76 5.41 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.222 -0.924 . . . . 0.0 110.373 178.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -87.35 -3.41 59.03 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.009 -1.057 . . . . 0.0 108.819 179.611 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.38 -0.34 75.42 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -142.42 161.5 19.2 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 O-C-N 121.196 -1.179 . . . . 0.0 108.783 178.621 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.6 mp -113.12 131.74 55.72 Favored 'General case' 0 N--CA 1.517 2.91 0 N-CA-C 107.764 -1.198 . . . . 0.0 107.764 177.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 39.8 p-10 -106.51 174.2 5.99 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 121.371 -0.831 . . . . 0.0 109.934 -179.22 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -59.63 -7.69 1.63 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.431 -0.793 . . . . 0.0 110.088 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 44.7 mm-40 -85.29 -40.22 16.83 Favored 'General case' 0 C--N 1.297 -1.706 0 O-C-N 121.052 -1.03 . . . . 0.0 109.845 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -67.79 -33.03 74.01 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.157 -0.964 . . . . 0.0 109.56 -179.644 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.459 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 1.4 mt -80.45 -38.48 29.95 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.958 -1.089 . . . . 0.0 109.38 179.192 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.49 ' N ' ' OE1' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -59.76 -41.81 91.88 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.882 -1.137 . . . . 0.0 108.794 179.481 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.07 -29.21 61.76 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.236 -0.915 . . . . 0.0 111.142 -179.204 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.49 ' O ' HD23 ' A' ' 41' ' ' LEU . 0.8 OUTLIER -76.76 -26.63 54.75 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 120.896 -1.127 . . . . 0.0 110.819 -178.654 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.459 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 28.9 m-85 -80.49 -49.19 11.71 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 120.42 -1.425 . . . . 0.0 108.929 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 53.5 m . . . . . 0 N--CA 1.488 1.447 0 O-C-N 121.245 -0.909 . . . . 0.0 110.277 -179.858 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.488 1.455 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 25.0 mt -79.45 -28.72 41.62 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.459 -0.776 . . . . 0.0 109.303 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -65.42 -37.24 86.36 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.211 -0.93 . . . . 0.0 109.677 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 13.7 mtt -85.34 -37.93 19.36 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.922 -1.111 . . . . 0.0 109.677 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.536 HH11 ' CG ' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -66.25 -51.88 53.17 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.022 -1.049 . . . . 0.0 110.393 -179.386 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -69.85 -51.55 32.43 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.152 -0.967 . . . . 0.0 110.934 -178.805 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.491 ' CE1' ' OD1' ' A' ' 76' ' ' ASN . 62.0 t-80 -55.73 -42.03 74.77 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.921 -1.112 . . . . 0.0 110.516 -178.792 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 77.4 t -73.05 -54.21 16.37 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 120.645 -1.285 . . . . 0.0 109.804 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.462 ' SD ' ' NH1' ' A' ' 70' ' ' ARG . 37.2 mtp -65.36 -19.67 66.05 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.971 -1.081 . . . . 0.0 110.264 -179.098 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.5 ttpp -94.79 -32.66 13.2 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.727 -1.233 . . . . 0.0 110.237 -179.535 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ASN . . . . . 0.491 ' OD1' ' CE1' ' A' ' 72' ' ' HIS . 6.3 m120 -100.57 -8.79 22.64 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.203 -0.936 . . . . 0.0 111.792 -178.464 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 85.5 t -117.13 -38.04 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.539 0 O-C-N 120.593 -1.317 . . . . 0.0 110.376 179.253 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.401 ' OD2' ' O ' ' A' ' 74' ' ' MET . 83.9 m-20 -49.47 112.38 0.63 Allowed 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.606 -1.309 . . . . 0.0 108.983 178.97 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.59 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -87.58 -59.24 2.3 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.284 -0.885 . . . . 0.0 110.41 -177.903 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.403 ' O ' ' C ' ' A' ' 81' ' ' GLN . 46.8 t30 -103.43 25.53 9.51 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.309 -0.869 . . . . 0.0 109.447 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.403 ' C ' ' O ' ' A' ' 80' ' ' ASN . 33.3 mm-40 34.63 48.22 0.29 Allowed 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.054 0.454 . . . . 0.0 112.146 178.363 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.578 ' C ' ' H ' ' A' ' 84' ' ' LEU . 12.8 p-10 -99.72 15.33 27.16 Favored 'General case' 0 N--CA 1.495 1.809 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 178.463 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.449 HH11 ' HG3' ' A' ' 83' ' ' ARG . 10.5 mtm-85 63.06 -2.83 0.38 Allowed 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 -178.345 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.578 ' H ' ' C ' ' A' ' 82' ' ' ASP . 4.8 mp -125.62 135.3 52.03 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 179.524 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 70.2 t -112.81 129.71 67.94 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.083 0 O-C-N 121.552 -0.718 . . . . 0.0 109.615 -178.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 68.8 p -98.1 163.01 12.93 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.225 -0.922 . . . . 0.0 109.13 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.733 HD13 ' C ' ' A' ' 87' ' ' LEU . 1.4 tm? -66.04 -38.61 88.81 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 179.823 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -59.38 -69.71 0.19 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.344 -0.848 . . . . 0.0 111.456 -179.607 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.59 ' CB ' HG21 ' A' ' 79' ' ' THR . 33.5 mm-40 -57.24 -30.07 64.31 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.101 -0.999 . . . . 0.0 110.36 -178.495 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -61.5 -51.22 69.56 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.024 -1.048 . . . . 0.0 110.076 -179.437 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 92.4 mt -52.81 -44.98 67.03 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.984 -1.073 . . . . 0.0 109.354 179.294 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -46.9 -49.68 20.0 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.185 -0.947 . . . . 0.0 109.911 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 41.9 m -60.5 -26.27 66.7 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.249 -0.907 . . . . 0.0 110.179 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 26.4 p . . . . . 0 N--CA 1.499 1.992 0 O-C-N 121.213 -0.929 . . . . 0.0 110.047 -179.544 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 50.8 t-20 . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -65.35 -22.44 59.94 Favored 'Trans proline' 0 C--N 1.319 -1.009 0 C-N-CA 121.509 1.473 . . . . 0.0 109.698 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -56.24 -36.07 68.09 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.352 -0.842 . . . . 0.0 110.991 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 69.9 m -73.17 -41.64 63.65 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 120.687 -1.258 . . . . 0.0 110.617 -178.595 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -56.39 -35.02 67.27 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.919 -1.113 . . . . 0.0 108.184 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -69.25 -34.96 75.6 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.323 -0.861 . . . . 0.0 109.836 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.485 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.9 mt -69.89 -59.69 3.25 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.157 0 O-C-N 120.798 -1.189 . . . . 0.0 109.006 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 tp -44.49 -36.39 2.92 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.353 -0.842 . . . . 0.0 110.735 -179.777 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.509 ' ND1' ' N ' ' A' ' 25' ' ' HIS . 0.3 OUTLIER -80.57 -14.19 58.42 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.391 -1.443 . . . . 0.0 109.536 179.758 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.485 ' N ' ' O ' ' A' ' 23' ' ' ILE . 82.1 m-20 -78.34 93.29 4.65 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.174 -0.954 . . . . 0.0 109.236 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 75.5 mt -77.3 -51.8 17.78 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.437 0 O-C-N 121.407 -0.808 . . . . 0.0 110.65 -178.923 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.528 ' ND2' ' OD2' ' A' ' 30' ' ' ASP . 10.1 p30 -88.18 -3.12 58.92 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.917 -1.115 . . . . 0.0 110.234 -179.41 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.442 ' O ' ' OG ' ' A' ' 29' ' ' SER . 4.5 t 52.86 57.83 5.96 Favored 'General case' 0 C--N 1.295 -1.796 0 O-C-N 121.263 -0.898 . . . . 0.0 110.402 179.111 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.528 ' OD2' ' ND2' ' A' ' 28' ' ' ASN . 79.9 m-20 -99.9 7.17 45.08 Favored 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.956 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 72.88 5.47 64.93 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.876 -1.29 . . . . 0.0 109.876 -179.54 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -144.18 164.85 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.985 0 O-C-N 121.196 -1.179 . . . . 0.0 108.565 177.658 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 tp -112.81 128.6 56.48 Favored 'General case' 0 N--CA 1.512 2.643 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 178.61 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 40.0 p-10 -104.91 163.04 12.82 Favored 'General case' 0 N--CA 1.504 2.265 0 CA-C-O 121.896 0.855 . . . . 0.0 110.606 -178.432 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.596 ' CD ' ' H ' ' A' ' 35' ' ' GLU . 1.7 mp0 -57.73 -8.95 1.03 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.911 -0.493 . . . . 0.0 111.069 -179.216 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 41.1 mm-40 -85.12 -36.64 20.98 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.765 -1.209 . . . . 0.0 109.548 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -81.12 -34.9 32.22 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 179.404 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.4 tp -72.75 -42.02 64.51 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.614 -0.679 . . . . 0.0 110.029 179.494 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -71.85 -34.03 68.93 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.553 -1.342 . . . . 0.0 108.892 179.401 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.3 -28.63 62.2 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.256 -0.902 . . . . 0.0 110.285 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.428 ' O ' HD23 ' A' ' 41' ' ' LEU . 0.7 OUTLIER -70.63 -31.2 68.07 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.913 -1.117 . . . . 0.0 109.855 -179.111 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -77.8 -47.98 17.63 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 120.509 -1.37 . . . . 0.0 109.812 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 54.3 m . . . . . 0 N--CA 1.492 1.657 0 O-C-N 121.069 -1.02 . . . . 0.0 111.321 -178.769 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 47.8 mtt180 . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.901 ' O ' HD12 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -82.68 -33.09 27.78 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.024 -1.048 . . . . 0.0 109.832 -178.936 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.4 tpp180 -63.8 -38.82 92.53 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.111 -0.993 . . . . 0.0 110.009 -179.101 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 4.0 mtt -83.65 -51.12 7.55 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.068 -1.02 . . . . 0.0 109.272 179.841 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 29.1 ttp180 -51.07 -41.05 59.67 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.842 -1.161 . . . . 0.0 109.79 179.175 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -74.91 -52.52 11.05 Favored 'General case' 0 C--N 1.305 -1.343 0 O-C-N 120.841 -1.162 . . . . 0.0 111.166 -178.276 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.457 ' CD2' ' OD1' ' A' ' 76' ' ' ASN . 23.5 t60 -55.95 -36.85 68.24 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.92 -1.112 . . . . 0.0 110.059 -179.587 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 78.9 t -75.56 -55.32 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 120.68 -1.263 . . . . 0.0 109.798 -179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 35.7 mtp -62.48 -18.06 61.01 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.304 -0.872 . . . . 0.0 109.889 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 43.3 tttp -94.01 -37.66 11.55 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.656 -1.277 . . . . 0.0 109.929 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ASN . . . . . 0.457 ' OD1' ' CD2' ' A' ' 72' ' ' HIS . 11.9 m120 -98.23 -11.05 23.09 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.146 -0.971 . . . . 0.0 112.05 -178.15 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 64.5 t -111.26 -35.76 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.559 0 O-C-N 120.458 -1.401 . . . . 0.0 109.911 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -57.88 109.46 0.73 Allowed 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.477 -1.39 . . . . 0.0 108.123 177.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.543 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -85.06 -55.15 4.2 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.173 -0.955 . . . . 0.0 111.102 -178.158 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.527 ' O ' ' N ' ' A' ' 82' ' ' ASP . 23.9 m120 -101.95 25.15 9.02 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.231 -0.918 . . . . 0.0 109.687 -179.442 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.419 ' C ' ' H ' ' A' ' 83' ' ' ARG . 27.4 mm-40 33.83 29.37 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 178.609 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.527 ' N ' ' O ' ' A' ' 80' ' ' ASN . 19.8 p-10 -81.36 9.98 6.36 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 178.428 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.454 ' HG3' HH11 ' A' ' 83' ' ' ARG . 8.4 mtm-85 66.86 -5.43 0.66 Allowed 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 -178.731 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.523 ' H ' ' C ' ' A' ' 82' ' ' ASP . 13.6 mt -116.81 134.89 54.23 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 107.583 -1.265 . . . . 0.0 107.583 178.661 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 82.0 t -111.49 129.92 65.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.976 0 O-C-N 121.576 -0.703 . . . . 0.0 109.948 -178.732 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 31.9 p -105.53 159.87 15.61 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.695 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.6 tp -60.92 -36.78 80.18 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.382 -0.824 . . . . 0.0 109.223 179.645 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -60.18 -69.56 0.21 Allowed 'General case' 0 C--N 1.295 -1.788 0 O-C-N 121.254 -0.904 . . . . 0.0 111.495 -177.91 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.543 ' CB ' HG21 ' A' ' 79' ' ' THR . 14.3 mm-40 -60.42 -30.31 69.53 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.161 -0.962 . . . . 0.0 110.334 -178.396 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -64.91 -51.95 59.12 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.874 -1.142 . . . . 0.0 109.893 -179.708 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 57.3 mt -48.25 -44.87 33.78 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.142 -0.974 . . . . 0.0 109.294 179.651 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -54.69 -60.3 3.54 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.403 -0.811 . . . . 0.0 110.497 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.0 t -42.44 -35.17 0.97 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.445 -0.784 . . . . 0.0 111.349 -178.273 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 50.7 p . . . . . 0 N--CA 1.496 1.85 0 O-C-N 120.671 -1.268 . . . . 0.0 108.767 179.93 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 . . . . . 0 N--CA 1.492 1.633 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -63.95 -21.37 68.7 Favored 'Trans proline' 0 C--N 1.317 -1.081 0 C-N-CA 121.354 1.37 . . . . 0.0 109.862 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 55.8 tttp -55.41 -38.64 69.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.434 -0.791 . . . . 0.0 111.15 -179.493 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 49.4 m -70.78 -41.9 71.06 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 120.477 -1.389 . . . . 0.0 110.37 -178.683 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.514 ' CE2' ' NE2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -54.46 -44.88 72.93 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 179.761 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.421 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 20.9 t80 -57.67 -34.0 68.92 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.468 -0.77 . . . . 0.0 109.548 179.524 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.52 ' O ' ' N ' ' A' ' 25' ' ' HIS . 92.8 mt -72.41 -61.64 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 O-C-N 120.819 -1.175 . . . . 0.0 108.559 179.403 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 tp -45.48 -14.32 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.072 -1.018 . . . . 0.0 110.846 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.52 ' N ' ' O ' ' A' ' 23' ' ' ILE . 0.6 OUTLIER -104.21 -12.69 16.53 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 120.644 -1.285 . . . . 0.0 110.215 179.909 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.477 ' OD1' ' O ' ' A' ' 23' ' ' ILE . 33.7 p-10 -78.64 67.3 4.36 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.87 -1.144 . . . . 0.0 109.446 179.746 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 69.1 mt -50.53 -51.91 17.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 O-C-N 121.191 -0.943 . . . . 0.0 110.993 -179.3 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.408 ' O ' ' C ' ' A' ' 29' ' ' SER . 51.7 t-20 -89.38 12.44 16.28 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 120.721 -1.237 . . . . 0.0 110.128 -179.454 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.419 ' O ' ' OG ' ' A' ' 29' ' ' SER . 6.9 t 41.71 51.78 4.0 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.355 -0.841 . . . . 0.0 110.774 178.661 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -95.28 1.66 54.56 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.987 -1.071 . . . . 0.0 108.395 179.252 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 74.22 -0.17 54.69 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 109.453 -1.459 . . . . 0.0 109.453 -179.659 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -143.84 162.46 15.68 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 O-C-N 121.289 -1.124 . . . . 0.0 108.905 178.666 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 73.0 mt -107.94 110.76 22.58 Favored 'General case' 0 N--CA 1.513 2.715 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 177.377 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -86.17 -178.33 6.48 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.481 -0.762 . . . . 0.0 110.127 -179.2 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -73.3 -43.06 61.6 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.292 -0.88 . . . . 0.0 111.468 -178.817 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.439 ' NE2' ' CG ' ' A' ' 37' ' ' GLU . 1.5 pp0? -61.86 -24.57 67.0 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 120.36 -1.463 . . . . 0.0 108.589 -179.885 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.439 ' CG ' ' NE2' ' A' ' 36' ' ' GLN . 64.3 mt-10 -86.51 -32.42 20.76 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.375 -0.828 . . . . 0.0 109.069 179.312 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.0 tp -72.38 -34.96 68.33 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.343 -0.848 . . . . 0.0 109.554 179.524 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -74.71 -51.18 14.97 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.315 -0.866 . . . . 0.0 110.73 -179.207 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.24 -32.99 74.8 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.924 -1.11 . . . . 0.0 110.713 -178.831 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 39.0 tp -74.1 -31.01 62.62 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.85 -1.156 . . . . 0.0 109.942 -179.127 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -84.01 -50.71 7.75 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 120.46 -1.4 . . . . 0.0 109.823 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 43.1 m . . . . . 0 N--CA 1.491 1.594 0 O-C-N 121.066 -1.022 . . . . 0.0 110.447 -179.155 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 25.0 mtm180 . . . . . 0 N--CA 1.494 1.768 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.636 HD12 ' C ' ' A' ' 67' ' ' LEU . 0.7 OUTLIER -74.5 -27.62 60.63 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.276 -0.89 . . . . 0.0 110.075 -179.518 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.475 ' O ' ' NE ' ' A' ' 68' ' ' ARG . 8.7 tpm_? -65.71 -37.96 87.87 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.841 -1.162 . . . . 0.0 109.37 -179.697 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.6 mtt -84.16 -50.69 7.68 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.224 -0.922 . . . . 0.0 109.131 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.496 HH11 ' HG2' ' A' ' 70' ' ' ARG . 7.1 ttt-85 -52.14 -32.75 37.08 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.979 -1.076 . . . . 0.0 110.02 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 -86.42 -53.48 4.97 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 120.921 -1.112 . . . . 0.0 110.814 -178.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 11.2 t-80 -54.88 -34.6 63.17 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.911 -1.118 . . . . 0.0 110.006 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 54.6 t -74.52 -53.88 15.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 120.672 -1.267 . . . . 0.0 109.738 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.452 ' SD ' ' NH1' ' A' ' 70' ' ' ARG . 29.8 mtp -65.41 -15.67 62.84 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.065 -1.022 . . . . 0.0 110.225 -179.702 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 42.4 tttp -85.23 -37.98 19.46 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.453 -1.404 . . . . 0.0 110.526 -179.633 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ASN . . . . . 0.478 ' OD1' ' N ' ' A' ' 77' ' ' VAL . 41.4 p-10 -105.18 -24.3 12.77 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.123 -0.985 . . . . 0.0 112.558 -178.027 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.478 ' N ' ' OD1' ' A' ' 76' ' ' ASN . 34.1 t -91.18 -36.75 8.39 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.422 0 O-C-N 120.235 -1.541 . . . . 0.0 110.032 -179.362 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -66.7 105.06 1.45 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.411 -1.431 . . . . 0.0 107.606 178.098 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.41 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -83.5 -53.49 5.65 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.327 -0.858 . . . . 0.0 111.587 -177.733 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.471 ' O ' ' N ' ' A' ' 82' ' ' ASP . 43.6 m-20 -98.59 23.91 8.08 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.15 -0.968 . . . . 0.0 109.46 -179.345 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.429 ' C ' ' O ' ' A' ' 80' ' ' ASN . 33.4 mm-40 31.37 35.07 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 178.786 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.548 ' C ' ' H ' ' A' ' 84' ' ' LEU . 81.3 m-20 -84.99 12.54 7.38 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 178.532 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.531 ' CG ' HH11 ' A' ' 83' ' ' ARG . 3.9 mtt-85 65.03 -4.13 0.53 Allowed 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 -178.485 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.548 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.6 mp -119.31 133.9 55.49 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 179.157 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 92.9 t -112.85 129.54 68.29 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 O-C-N 121.643 -0.66 . . . . 0.0 110.143 -178.73 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 25.6 p -102.02 174.8 5.77 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 178.161 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -75.07 -32.8 61.57 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.999 -1.063 . . . . 0.0 109.192 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -64.05 -66.51 0.53 Allowed 'General case' 0 C--N 1.294 -1.818 0 O-C-N 120.922 -1.111 . . . . 0.0 111.514 -178.693 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.423 ' HG2' ' H ' ' A' ' 89' ' ' GLU . 4.2 mm-40 -59.27 -33.64 71.3 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.909 -1.12 . . . . 0.0 110.435 -177.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -66.29 -50.84 62.31 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 120.736 -1.228 . . . . 0.0 109.404 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.9 mp -46.74 -46.39 20.33 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.308 -0.87 . . . . 0.0 108.853 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -52.93 -58.31 7.37 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.221 -0.925 . . . . 0.0 110.277 -179.734 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 25.4 m -44.31 -27.47 0.43 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.239 -0.913 . . . . 0.0 109.952 -179.402 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 31.8 p . . . . . 0 N--CA 1.497 1.879 0 O-C-N 121.314 -0.866 . . . . 0.0 108.741 179.096 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 . . . . . 0 N--CA 1.494 1.761 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -62.96 -20.49 71.66 Favored 'Trans proline' 0 C--N 1.319 -1.001 0 C-N-CA 121.545 1.496 . . . . 0.0 110.269 -179.415 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -55.81 -36.64 67.66 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.312 -0.868 . . . . 0.0 111.135 -179.598 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 58.4 m -74.04 -43.27 58.46 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 120.679 -1.263 . . . . 0.0 110.562 -178.539 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.502 ' CE2' ' CD2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -54.85 -33.97 62.37 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 179.909 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -69.76 -34.52 73.9 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.422 -0.799 . . . . 0.0 109.816 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 97.4 mt -71.87 -60.68 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 O-C-N 120.832 -1.167 . . . . 0.0 108.907 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 tp -46.01 -37.93 7.2 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.313 -0.867 . . . . 0.0 111.048 -179.715 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.502 ' CD2' ' CE2' ' A' ' 21' ' ' PHE . 0.3 OUTLIER -79.17 -15.11 58.57 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.433 -1.417 . . . . 0.0 110.082 -179.526 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -79.84 96.27 6.28 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.02 -1.05 . . . . 0.0 108.717 179.347 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.3 mt -74.55 -51.98 21.06 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 O-C-N 121.455 -0.778 . . . . 0.0 110.736 -178.634 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 13.0 m-20 -86.78 8.57 22.16 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.787 -1.195 . . . . 0.0 109.948 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.443 ' O ' ' OG ' ' A' ' 29' ' ' SER . 5.2 t 44.32 57.47 4.31 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.166 -0.959 . . . . 0.0 110.496 178.955 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -100.31 0.2 39.66 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.079 -1.013 . . . . 0.0 108.654 179.461 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.67 -2.51 67.71 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -144.31 160.22 15.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.052 -1.263 . . . . 0.0 108.621 178.052 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 17.6 mt -110.89 128.96 55.98 Favored 'General case' 0 N--CA 1.512 2.626 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.446 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.448 ' C ' ' H ' ' A' ' 36' ' ' GLN . 24.6 p-10 -105.12 166.83 10.12 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.504 -0.748 . . . . 0.0 109.643 -179.544 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -52.27 -6.34 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.578 -0.701 . . . . 0.0 110.79 -179.663 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.448 ' H ' ' C ' ' A' ' 34' ' ' ASP . 40.8 mm-40 -85.77 -42.66 14.0 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.807 -1.183 . . . . 0.0 109.862 -179.819 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -80.71 -31.18 36.23 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.0 tp -76.37 -36.82 57.95 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.43 -0.794 . . . . 0.0 109.281 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -74.62 -51.35 14.73 Favored 'General case' 0 N--CA 1.484 1.275 0 O-C-N 120.935 -1.103 . . . . 0.0 109.429 179.385 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.21 -29.53 69.87 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.325 -0.859 . . . . 0.0 110.33 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 41.6 tp -76.71 -27.7 55.57 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.167 -0.958 . . . . 0.0 110.542 -178.926 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -82.88 -40.06 20.75 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 120.354 -1.466 . . . . 0.0 110.006 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 17.7 m . . . . . 0 N--CA 1.489 1.515 0 O-C-N 120.78 -1.2 . . . . 0.0 109.842 -179.55 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? . . . . . 0 N--CA 1.493 1.678 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 33.4 mt -82.93 -26.54 31.32 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.527 -0.733 . . . . 0.0 109.619 179.302 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.3 tmm_? -65.9 -39.0 90.21 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.9 -1.125 . . . . 0.0 109.735 -179.304 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.7 mtt -84.97 -50.37 7.54 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.192 -0.943 . . . . 0.0 109.553 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.509 ' NH1' ' SD ' ' A' ' 74' ' ' MET . 11.0 ttt-85 -54.21 -27.85 37.07 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.759 -1.213 . . . . 0.0 110.21 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -84.27 -51.78 6.74 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 120.801 -1.187 . . . . 0.0 110.75 -179.367 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -54.28 -38.67 66.12 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.088 -1.007 . . . . 0.0 110.823 -179.472 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 55.3 t -75.09 -54.49 14.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 O-C-N 120.343 -1.473 . . . . 0.0 110.117 -179.522 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.509 ' SD ' ' NH1' ' A' ' 70' ' ' ARG . 27.5 mtp -62.81 -14.11 41.56 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.227 -0.921 . . . . 0.0 110.291 -179.137 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 42.8 tttm -89.59 -39.45 13.25 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.641 -1.287 . . . . 0.0 110.842 -178.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ASN . . . . . 0.477 ' OD1' ' N ' ' A' ' 77' ' ' VAL . 36.9 p-10 -103.61 -27.58 12.24 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.126 -0.984 . . . . 0.0 112.279 -178.053 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.477 ' N ' ' OD1' ' A' ' 76' ' ' ASN . 21.6 t -85.21 -29.29 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.233 0 O-C-N 120.144 -1.598 . . . . 0.0 109.118 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.497 ' OD2' ' NE2' ' A' ' 81' ' ' GLN . 15.2 p-10 -63.28 106.17 0.85 Allowed 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.915 -1.115 . . . . 0.0 108.462 178.52 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' THR . . . . . 0.502 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -86.72 -53.49 4.91 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.107 -1.621 . . . . 0.0 110.73 -178.542 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.577 ' ND2' ' OE1' ' A' ' 89' ' ' GLU . 31.8 m-20 -104.12 24.87 10.75 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.301 -0.874 . . . . 0.0 109.737 -179.71 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' GLN . . . . . 0.497 ' NE2' ' OD2' ' A' ' 78' ' ' ASP . 18.3 mm-40 34.31 30.14 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.862 0 O-C-N 122.041 -0.412 . . . . 0.0 111.932 178.362 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.552 ' C ' ' H ' ' A' ' 84' ' ' LEU . 18.5 p-10 -82.08 9.95 7.57 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.637 -1.29 . . . . 0.0 107.667 178.882 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.517 ' CG ' HH11 ' A' ' 83' ' ' ARG . 4.1 mtt-85 64.34 -4.31 0.43 Allowed 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 -178.751 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.552 ' H ' ' C ' ' A' ' 82' ' ' ASP . 6.6 mp -118.38 134.37 55.11 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 178.951 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 94.6 t -112.4 130.45 66.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.047 0 O-C-N 121.564 -0.71 . . . . 0.0 110.336 -178.359 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 16.9 p -105.93 166.41 10.5 Favored 'General case' 0 N--CA 1.499 1.999 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 178.327 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.9 tp -64.54 -36.63 84.84 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.273 -0.892 . . . . 0.0 109.344 179.675 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.536 ' CD ' ' H ' ' A' ' 88' ' ' GLU . 8.8 mp0 -61.49 -68.16 0.34 Allowed 'General case' 0 C--N 1.293 -1.874 0 O-C-N 120.751 -1.218 . . . . 0.0 111.806 -177.88 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLU . . . . . 0.577 ' OE1' ' ND2' ' A' ' 80' ' ' ASN . 1.0 OUTLIER -58.71 -33.66 70.44 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 120.738 -1.226 . . . . 0.0 110.479 -177.91 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -64.34 -51.39 63.6 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.865 -1.147 . . . . 0.0 108.821 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 2.7 mp -48.93 -42.71 38.13 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.789 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 89' ' ' GLU . . . -47.99 -61.38 2.0 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.257 -0.902 . . . . 0.0 109.701 179.616 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 95.1 p -48.04 -33.05 7.42 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.282 -0.886 . . . . 0.0 110.302 -179.693 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.5 2.04 0 O-C-N 121.212 -0.93 . . . . 0.0 109.483 -179.879 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 14.2 mt . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -95.35 95.61 8.58 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.152 -0.968 . . . . 0.0 109.175 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.436 ' O ' ' O ' ' A' ' 4' ' ' VAL . 54.4 tt0 -62.26 -62.31 1.86 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.251 -0.905 . . . . 0.0 109.689 -179.712 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.436 ' O ' ' O ' ' A' ' 3' ' ' GLU . 4.2 t 59.78 148.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.513 -0.742 . . . . 0.0 109.585 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 53.6 m95 -74.44 104.88 5.34 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.101 -0.999 . . . . 0.0 109.544 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -61.74 167.39 3.64 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.266 -0.896 . . . . 0.0 109.358 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -164.63 90.57 0.55 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.24 -0.913 . . . . 0.0 109.579 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 17.9 mt -66.17 155.73 36.11 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.215 -0.928 . . . . 0.0 109.3 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.532 ' C ' ' H ' ' A' ' 11' ' ' LEU . 34.9 t70 -140.31 152.23 45.68 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.333 -0.854 . . . . 0.0 108.962 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.406 ' O ' ' CB ' ' A' ' 11' ' ' LEU . . . 64.37 -11.36 0.23 Allowed Glycine 0 N--CA 1.492 2.408 0 O-C-N 120.834 -1.166 . . . . 0.0 110.257 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.532 ' H ' ' C ' ' A' ' 9' ' ' ASP . 5.8 tp 76.66 101.44 0.07 Allowed 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 -178.613 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.538 ' C ' ' H ' ' A' ' 14' ' ' ASN . 8.7 p30 -46.31 150.13 1.2 Allowed Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.364 -0.835 . . . . 0.0 109.398 -179.139 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -65.01 14.07 0.09 OUTLIER 'Trans proline' 0 C--N 1.323 -0.783 0 C-N-CA 121.242 1.295 . . . . 0.0 110.116 179.285 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.538 ' H ' ' C ' ' A' ' 12' ' ' ASP . 27.0 t-20 -80.47 63.14 4.82 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.007 -1.058 . . . . 0.0 109.621 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.525 HH11 ' CG ' ' A' ' 15' ' ' ARG . 0.3 OUTLIER -46.96 169.55 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.3 -0.875 . . . . 0.0 109.705 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.412 ' O ' ' O ' ' A' ' 15' ' ' ARG . 35.0 m-85 -53.78 -173.78 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.262 -0.899 . . . . 0.0 109.568 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -156.66 66.97 4.24 Favored Pre-proline 0 N--CA 1.493 1.704 0 O-C-N 121.303 -0.873 . . . . 0.0 109.713 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -63.82 -18.69 65.0 Favored 'Trans proline' 0 C--N 1.319 -1.02 0 C-N-CA 121.519 1.479 . . . . 0.0 110.004 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -56.21 -39.61 72.75 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.331 -0.855 . . . . 0.0 111.176 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 71.9 m -70.91 -38.91 72.99 Favored 'General case' 0 C--N 1.308 -1.217 0 O-C-N 120.619 -1.301 . . . . 0.0 110.668 -178.237 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.426 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.04 -34.33 65.78 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 179.94 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.428 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 22.9 t80 -68.79 -35.17 76.7 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.396 -0.815 . . . . 0.0 109.665 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 97.9 mt -69.91 -60.4 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 O-C-N 120.796 -1.19 . . . . 0.0 108.974 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.7 tp -45.86 -38.6 7.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.286 -0.884 . . . . 0.0 110.709 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -78.9 -11.86 60.01 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.298 -1.501 . . . . 0.0 109.974 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.428 ' OD1' ' O ' ' A' ' 22' ' ' PHE . 55.1 m-20 -81.65 92.79 6.63 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.872 -1.142 . . . . 0.0 108.965 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.41 HD13 HG21 ' A' ' 27' ' ' ILE . 26.1 mt -75.74 -51.57 20.26 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.371 0 O-C-N 121.331 -0.856 . . . . 0.0 110.877 -178.869 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 51.5 t-20 -87.94 12.88 12.1 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 120.876 -1.14 . . . . 0.0 110.105 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.0 t 43.27 55.68 4.58 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.255 -0.903 . . . . 0.0 110.533 179.03 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 13.8 p30 -97.92 -6.23 32.7 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.117 -0.99 . . . . 0.0 108.511 179.318 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.85 -3.74 63.61 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 109.664 -1.375 . . . . 0.0 109.664 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -140.93 163.16 22.03 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 O-C-N 121.263 -1.14 . . . . 0.0 108.486 178.855 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 72.3 mt -120.47 121.53 38.68 Favored 'General case' 0 N--CA 1.515 2.819 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 178.183 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -103.89 179.51 4.25 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.108 -0.995 . . . . 0.0 110.18 -179.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.1 tm-20 -55.71 -14.55 2.31 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.61 -0.681 . . . . 0.0 111.232 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -82.68 -28.06 30.86 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.283 -1.511 . . . . 0.0 109.679 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.7 mm-40 -81.39 -37.32 28.37 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.743 -1.223 . . . . 0.0 109.411 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.536 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 2.3 mt -73.58 -32.01 63.9 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 120.992 -1.067 . . . . 0.0 108.539 178.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -59.94 -47.87 84.03 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 120.909 -1.119 . . . . 0.0 108.874 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.31 -28.92 62.35 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.267 -0.895 . . . . 0.0 110.897 -179.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.55 ' O ' HD23 ' A' ' 41' ' ' LEU . 0.8 OUTLIER -72.22 -25.77 61.77 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 120.923 -1.111 . . . . 0.0 110.227 -178.952 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.536 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 38.1 m-85 -81.5 -51.38 8.34 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.538 -1.351 . . . . 0.0 109.275 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 64.3 m -59.8 -33.32 71.57 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.147 -0.97 . . . . 0.0 110.32 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.3 ttmt -73.9 -36.85 64.78 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.236 -0.915 . . . . 0.0 110.592 -179.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -56.15 -34.5 66.21 Favored 'General case' 0 C--N 1.298 -1.658 0 O-C-N 120.487 -1.383 . . . . 0.0 108.023 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 12.6 mt -67.62 -24.11 65.43 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 119.38 -0.928 . . . . 0.0 108.966 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -70.9 -29.96 66.17 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.276 -0.89 . . . . 0.0 109.273 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.8 mttt -91.25 13.78 16.22 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.247 -0.908 . . . . 0.0 110.233 -179.256 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 38.6 t -147.51 -58.53 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.893 0 O-C-N 120.97 -1.081 . . . . 0.0 109.544 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.405 ' HB3' ' H ' ' A' ' 51' ' ' ASP . 14.6 m-85 -72.57 -151.32 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.21 -0.931 . . . . 0.0 108.571 179.734 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.405 ' H ' ' HB3' ' A' ' 50' ' ' TYR . 9.2 t70 -173.42 72.28 0.38 Allowed Pre-proline 0 N--CA 1.5 2.036 0 O-C-N 120.735 -1.228 . . . . 0.0 108.77 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -65.69 174.34 5.62 Favored 'Trans proline' 0 C--N 1.318 -1.035 0 C-N-CA 121.71 1.607 . . . . 0.0 110.468 -179.004 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.596 ' CG ' ' H ' ' A' ' 54' ' ' ASN . 0.0 OUTLIER -165.85 -90.66 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 179.57 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.596 ' H ' ' CG ' ' A' ' 53' ' ' LYS . 23.3 p-10 -147.87 34.09 0.84 Allowed 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.511 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.468 ' CD ' ' H ' ' A' ' 56' ' ' GLU . 12.8 tp10 -115.35 161.56 18.34 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 -179.617 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.468 ' H ' ' CD ' ' A' ' 55' ' ' GLU . 14.2 mp0 -133.45 87.46 2.39 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.322 -0.861 . . . . 0.0 109.07 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -171.32 -67.71 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.268 -0.895 . . . . 0.0 109.935 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 38.7 m-20 -56.95 -20.66 24.83 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.215 -0.928 . . . . 0.0 110.122 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 78.2 mmm -97.18 44.03 1.06 Allowed 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.274 -0.891 . . . . 0.0 109.403 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -143.2 -55.3 0.4 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.336 -0.853 . . . . 0.0 109.183 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -59.37 -41.12 88.59 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.984 -1.073 . . . . 0.0 109.588 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.557 ' O ' ' N ' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -70.71 -14.18 62.35 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.214 -0.929 . . . . 0.0 110.32 -179.548 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.416 ' C ' ' O ' ' A' ' 62' ' ' MET . 12.9 pt-20 -37.89 -24.75 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.794 -0.566 . . . . 0.0 110.543 -179.28 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.557 ' N ' ' O ' ' A' ' 62' ' ' MET . 25.4 mm-40 -57.78 -24.08 55.43 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.24 -0.913 . . . . 0.0 109.609 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -76.0 -46.1 31.26 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.248 -0.907 . . . . 0.0 110.013 -179.596 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 36.1 mtm180 -53.74 -47.48 70.59 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.127 -0.983 . . . . 0.0 109.038 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 24.6 mt -67.29 -28.21 67.82 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.124 -0.985 . . . . 0.0 109.691 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.509 HH11 ' HG2' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -63.23 -37.69 88.22 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.189 -0.944 . . . . 0.0 109.552 -179.649 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 7.2 mtt -84.67 -49.72 8.27 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.194 -0.941 . . . . 0.0 109.569 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -52.35 -32.19 37.13 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.857 -1.152 . . . . 0.0 110.427 -179.485 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -84.13 -52.35 6.35 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.086 -1.008 . . . . 0.0 111.004 -178.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 16.3 t60 -55.33 -41.77 72.9 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.003 -1.061 . . . . 0.0 110.179 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 71.3 t -70.53 -50.48 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 120.69 -1.256 . . . . 0.0 109.203 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.435 ' O ' ' OD1' ' A' ' 78' ' ' ASP . 6.3 mmt -63.63 -19.87 65.23 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.21 -0.931 . . . . 0.0 110.23 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -99.33 -38.65 8.76 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 120.791 -1.193 . . . . 0.0 111.004 -178.855 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -93.47 -11.75 31.33 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 120.784 -1.198 . . . . 0.0 111.985 -178.264 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 98.1 t -114.64 -33.18 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.495 0 CA-C-N 120.3 1.409 . . . . 0.0 110.313 179.424 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.584 ' OD2' ' NE2' ' A' ' 81' ' ' GLN . 10.4 p-10 -51.33 109.65 0.36 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.598 -1.313 . . . . 0.0 108.821 179.058 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.579 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -87.78 -61.93 1.61 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 120.842 -1.161 . . . . 0.0 110.032 -178.13 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 18.0 p-10 -102.96 18.19 22.22 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.289 -0.882 . . . . 0.0 109.786 -179.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.584 ' NE2' ' OD2' ' A' ' 78' ' ' ASP . 24.7 mm-40 42.58 75.4 0.09 Allowed 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.485 -0.759 . . . . 0.0 111.112 178.091 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.577 ' C ' ' H ' ' A' ' 84' ' ' LEU . 28.3 t70 -131.24 16.38 5.03 Favored 'General case' 0 N--CA 1.499 1.978 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.368 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 35.1 mtm180 60.82 -3.67 0.15 Allowed 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 -178.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.577 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.0 mp -124.59 134.57 52.9 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 78.4 t -111.58 125.87 68.93 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.985 0 O-C-N 121.654 -0.654 . . . . 0.0 109.666 -178.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 62.2 p -96.88 163.35 13.01 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.188 -0.945 . . . . 0.0 108.98 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.0 tp -66.3 -36.68 83.57 Favored 'General case' 0 N--CA 1.492 1.665 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 74.8 mt-10 -60.27 -68.69 0.27 Allowed 'General case' 0 C--N 1.295 -1.779 0 O-C-N 121.62 -0.675 . . . . 0.0 110.915 -178.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.579 ' CB ' HG21 ' A' ' 79' ' ' THR . 29.8 mm-40 -59.74 -30.24 68.7 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.236 -0.915 . . . . 0.0 110.547 -178.614 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -64.82 -50.93 64.78 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.936 -1.103 . . . . 0.0 109.663 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.537 ' O ' ' N ' ' A' ' 95' ' ' GLN . 68.1 mt -49.97 -43.32 50.2 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.156 -0.965 . . . . 0.0 108.998 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -51.78 -60.95 2.59 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.222 -0.923 . . . . 0.0 110.033 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 98.8 p -45.12 -26.32 0.45 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.193 -0.942 . . . . 0.0 110.089 -179.45 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.438 ' OG1' ' N ' ' A' ' 95' ' ' GLN . 23.3 p -100.64 -63.36 1.14 Allowed 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.328 -0.858 . . . . 0.0 109.468 179.634 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.537 ' N ' ' O ' ' A' ' 91' ' ' LEU . 87.5 mt-30 -42.39 -50.77 5.08 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.457 -0.777 . . . . 0.0 110.672 -179.625 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 18.6 mmt180 -59.49 85.03 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.878 -1.139 . . . . 0.0 109.439 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.478 ' N ' ' O ' ' A' ' 95' ' ' GLN . 87.3 tttt -48.92 -52.04 26.82 Favored 'General case' 0 C--N 1.305 -1.355 0 O-C-N 121.266 -0.896 . . . . 0.0 109.713 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.546 ' CD ' ' H ' ' A' ' 98' ' ' GLU . 17.2 mp0 -60.65 87.02 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.345 -0.847 . . . . 0.0 109.548 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.403 ' N ' ' O ' ' A' ' 97' ' ' LYS . 79.3 t80 . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 117.963 -1.018 . . . . 0.0 109.37 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 51.6 tp . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.466 ' N ' ' CD ' ' A' ' 2' ' ' LYS . 3.6 mptp? -79.9 172.09 14.24 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.271 -0.893 . . . . 0.0 109.268 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.417 ' O ' ' O ' ' A' ' 2' ' ' LYS . 34.9 tt0 52.88 98.75 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.312 -0.867 . . . . 0.0 109.47 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.469 HG22 ' H ' ' A' ' 6' ' ' GLU . 12.0 p -73.46 141.45 16.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.328 -0.858 . . . . 0.0 109.385 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 5.2 m0 -63.98 -39.01 93.16 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.22 -0.925 . . . . 0.0 109.691 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.469 ' H ' HG22 ' A' ' 4' ' ' VAL . 41.0 tt0 -140.2 -75.7 0.34 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.269 -0.894 . . . . 0.0 109.373 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.502 ' C ' HD12 ' A' ' 8' ' ' LEU . 40.0 tt0 -167.84 -38.57 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.146 -0.971 . . . . 0.0 109.645 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.502 HD12 ' C ' ' A' ' 7' ' ' GLU . 8.8 mp -117.67 111.48 19.21 Favored 'General case' 0 N--CA 1.506 2.34 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.056 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 63.0 t0 -76.3 31.93 0.12 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.388 -0.82 . . . . 0.0 109.444 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.445 ' H ' ' C ' ' A' ' 8' ' ' LEU . . . 66.5 60.41 6.28 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.469 -1.452 . . . . 0.0 109.469 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 19.7 mt -61.69 -56.94 14.3 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.261 -1.14 . . . . 0.0 109.454 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.455 ' C ' ' H ' ' A' ' 14' ' ' ASN . 21.0 p30 -151.71 68.86 7.74 Favored Pre-proline 0 N--CA 1.494 1.749 0 O-C-N 121.246 -0.909 . . . . 0.0 109.339 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.545 ' O ' ' N ' ' A' ' 15' ' ' ARG . 3.4 Cg_exo -61.97 0.4 1.25 Allowed 'Trans proline' 0 C--N 1.318 -1.051 0 C-N-CA 121.45 1.433 . . . . 0.0 109.795 -179.61 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.455 ' H ' ' C ' ' A' ' 12' ' ' ASP . 1.9 m-20 -64.69 64.01 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.461 -0.774 . . . . 0.0 109.809 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.545 ' N ' ' O ' ' A' ' 13' ' ' PRO . 67.2 ttt180 -172.5 121.48 0.42 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.336 -0.853 . . . . 0.0 109.047 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.52 ' CE2' ' O ' ' A' ' 13' ' ' PRO . 66.5 m-85 -158.01 -164.4 1.51 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.087 -1.008 . . . . 0.0 109.849 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -115.81 91.61 31.2 Favored Pre-proline 0 N--CA 1.498 1.93 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -57.7 -14.73 18.31 Favored 'Trans proline' 0 C--N 1.323 -0.806 0 C-N-CA 121.034 1.156 . . . . 0.0 110.266 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -55.9 -33.61 64.8 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.373 -0.829 . . . . 0.0 110.493 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 53.0 m -74.4 -41.81 60.28 Favored 'General case' 0 C--N 1.307 -1.268 0 O-C-N 120.89 -1.131 . . . . 0.0 110.385 -178.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.617 ' CE2' ' NE2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -55.86 -34.45 65.48 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -69.61 -36.05 75.83 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.392 -0.818 . . . . 0.0 109.791 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.471 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.7 mt -70.7 -60.48 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.232 0 O-C-N 120.711 -1.243 . . . . 0.0 109.056 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.9 tp -45.37 -36.67 4.37 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.245 -0.91 . . . . 0.0 110.692 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.617 ' NE2' ' CE2' ' A' ' 21' ' ' PHE . 0.4 OUTLIER -77.33 -15.67 59.29 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.4 -1.437 . . . . 0.0 109.451 179.787 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.471 ' N ' ' O ' ' A' ' 23' ' ' ILE . 68.6 m-20 -78.8 87.58 4.67 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.119 -0.988 . . . . 0.0 108.92 179.243 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 19.9 mt -71.4 -52.43 26.59 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 O-C-N 121.277 -0.89 . . . . 0.0 110.806 -178.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.428 ' N ' ' OD1' ' A' ' 28' ' ' ASN . 3.2 m-20 -86.38 11.6 12.0 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.826 -1.171 . . . . 0.0 109.84 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 27.6 p 44.42 56.31 5.09 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.201 -0.937 . . . . 0.0 110.245 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.407 ' OD1' ' O ' ' A' ' 32' ' ' VAL . 41.8 p-10 -98.07 -5.94 32.78 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.236 -0.915 . . . . 0.0 108.603 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 79.97 -1.7 78.27 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.914 -1.274 . . . . 0.0 109.914 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.407 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 0.9 OUTLIER -143.59 163.55 15.71 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 121.072 -1.252 . . . . 0.0 108.545 178.412 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.451 HD21 ' OD1' ' A' ' 26' ' ' ASP . 39.7 mt -113.22 125.63 54.53 Favored 'General case' 0 N--CA 1.514 2.734 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 178.292 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.426 ' OD1' ' OE2' ' A' ' 37' ' ' GLU . 42.6 p-10 -103.69 173.85 6.12 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.316 -0.865 . . . . 0.0 109.73 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 61.2 mt-10 -55.8 -8.86 0.46 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.547 -0.72 . . . . 0.0 110.157 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 40.1 mm-40 -83.35 -43.24 16.16 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.86 -1.15 . . . . 0.0 108.786 179.033 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.53 ' N ' ' OE1' ' A' ' 37' ' ' GLU . 0.3 OUTLIER -70.54 -29.26 65.68 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 179.34 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.407 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 10.2 mp -83.1 -39.43 21.13 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.234 -0.916 . . . . 0.0 108.936 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -64.07 -49.58 71.76 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.788 -1.195 . . . . 0.0 108.728 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.97 -28.4 67.42 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.418 -0.801 . . . . 0.0 110.559 -179.557 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 32.5 tp -76.26 -28.52 57.12 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.991 -1.068 . . . . 0.0 110.88 -178.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.407 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 29.6 m-85 -74.46 -49.03 23.9 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 120.058 -1.651 . . . . 0.0 108.442 179.358 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 59.4 m -58.0 -35.58 71.42 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.288 -0.883 . . . . 0.0 110.246 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 24.9 ttmt -74.98 -45.45 41.98 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.274 -0.891 . . . . 0.0 111.814 -178.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -53.26 -27.79 24.29 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.144 -1.598 . . . . 0.0 108.564 -179.046 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.4 mt -83.33 -26.95 30.09 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.211 -0.931 . . . . 0.0 109.879 179.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -53.99 -37.58 64.15 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.087 -1.008 . . . . 0.0 109.698 -179.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.7 pttp -84.55 22.21 1.34 Allowed 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.058 -1.026 . . . . 0.0 110.293 -179.368 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 20.3 t -133.36 -57.84 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 O-C-N 121.278 -0.889 . . . . 0.0 109.534 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -102.38 -159.86 0.75 Allowed 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.255 -0.903 . . . . 0.0 109.191 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -142.01 70.92 23.67 Favored Pre-proline 0 N--CA 1.497 1.895 0 O-C-N 121.15 -0.969 . . . . 0.0 109.24 -179.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -61.93 174.42 2.42 Favored 'Trans proline' 0 C--N 1.317 -1.121 0 C-N-CA 121.456 1.438 . . . . 0.0 110.065 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 13.0 mmtp -111.21 42.74 1.59 Allowed 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.4 m-20 55.87 19.25 3.43 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.301 -0.875 . . . . 0.0 109.427 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -147.56 130.78 16.47 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.306 -0.871 . . . . 0.0 109.396 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.485 ' O ' ' N ' ' A' ' 58' ' ' ASP . 64.2 mt-10 -68.2 -19.33 64.75 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.227 -0.92 . . . . 0.0 109.493 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 34.1 p30 -67.36 43.73 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.255 -0.903 . . . . 0.0 109.699 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.485 ' N ' ' O ' ' A' ' 56' ' ' GLU . 16.2 t70 -171.4 -12.14 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.144 -0.972 . . . . 0.0 109.805 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.409 ' H ' ' H ' ' A' ' 58' ' ' ASP . 60.0 mmm -85.0 -7.85 58.97 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.958 -1.089 . . . . 0.0 109.614 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 57.9 mtp180 -60.29 104.52 0.33 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.092 -1.005 . . . . 0.0 109.256 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -174.15 -71.74 0.01 OUTLIER 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.552 ' O ' ' N ' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -93.39 17.79 10.79 Favored 'General case' 0 N--CA 1.492 1.668 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 178.474 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -41.05 -20.36 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.826 0 CA-C-O 121.441 0.639 . . . . 0.0 109.711 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.552 ' N ' ' O ' ' A' ' 62' ' ' MET . 52.7 mt-10 -54.88 -38.64 67.8 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.36 -0.838 . . . . 0.0 109.466 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.52 ' OE2' ' NE ' ' A' ' 68' ' ' ARG . 38.1 tp10 -72.46 -34.92 68.09 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.247 -0.908 . . . . 0.0 109.282 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.518 ' CG ' HH11 ' A' ' 66' ' ' ARG . 0.2 OUTLIER -50.85 -48.64 59.98 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.542 -0.724 . . . . 0.0 109.711 -179.893 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.63 HD12 ' C ' ' A' ' 67' ' ' LEU . 0.6 OUTLIER -73.58 -27.36 61.27 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.348 -0.845 . . . . 0.0 109.722 -179.525 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.52 ' NE ' ' OE2' ' A' ' 65' ' ' GLU . 6.8 tmm_? -59.9 -39.88 86.9 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.06 -1.025 . . . . 0.0 109.387 -179.596 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 10.6 mtt -86.09 -50.1 7.28 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.011 -1.055 . . . . 0.0 109.297 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 62.4 ttt180 -54.65 -46.79 74.05 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.976 -1.078 . . . . 0.0 110.761 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -74.34 -53.0 10.55 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.95 -1.094 . . . . 0.0 111.303 -178.391 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 36.7 t-80 -54.4 -41.15 68.93 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.954 -1.091 . . . . 0.0 110.248 -179.196 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 71.9 t -73.13 -53.45 18.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 120.765 -1.209 . . . . 0.0 109.581 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.428 ' O ' ' CG ' ' A' ' 78' ' ' ASP . 28.7 mtp -64.35 -17.42 63.7 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.121 -0.987 . . . . 0.0 109.916 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 26.2 ttpt -95.73 -37.31 10.83 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 120.783 -1.198 . . . . 0.0 110.385 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -98.01 -10.49 24.33 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.018 -1.051 . . . . 0.0 112.065 -178.458 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 95.1 t -114.93 -32.93 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.595 0 O-C-N 120.407 -1.433 . . . . 0.0 110.337 179.309 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.428 ' CG ' ' O ' ' A' ' 74' ' ' MET . 19.0 p-10 -49.28 111.99 0.57 Allowed 'General case' 0 N--CA 1.498 1.929 0 O-C-N 120.642 -1.286 . . . . 0.0 108.645 178.746 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -90.06 -68.77 0.76 Allowed 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.145 -0.972 . . . . 0.0 110.645 -177.53 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.509 ' O ' ' N ' ' A' ' 82' ' ' ASP . 30.0 m-20 -97.27 25.61 5.43 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.02 -1.05 . . . . 0.0 108.34 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.512 ' N ' ' OE1' ' A' ' 81' ' ' GLN . 0.2 OUTLIER 35.19 29.12 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.087 178.106 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.509 ' N ' ' O ' ' A' ' 80' ' ' ASN . 59.7 t0 -82.81 14.59 3.13 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 178.196 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.518 ' CG ' HH11 ' A' ' 83' ' ' ARG . 4.1 mtt-85 61.87 3.69 0.97 Allowed 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -178.15 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.495 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.7 mp -125.2 134.24 52.44 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 71.6 t -111.69 130.5 65.16 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 O-C-N 121.618 -0.676 . . . . 0.0 109.55 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 60.1 p -103.59 165.16 11.2 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.325 -0.859 . . . . 0.0 108.859 179.057 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.8 tp -66.37 -36.05 81.88 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.246 -0.909 . . . . 0.0 108.624 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -58.05 -69.32 0.18 Allowed 'General case' 0 C--N 1.295 -1.787 0 O-C-N 121.292 -0.88 . . . . 0.0 111.123 -178.349 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -62.73 -30.94 71.8 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.196 -0.94 . . . . 0.0 110.903 -178.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -60.8 -51.04 71.02 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.789 -1.195 . . . . 0.0 109.39 -179.472 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -51.16 -48.64 61.83 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 179.124 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -44.33 -49.3 9.56 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.441 -0.787 . . . . 0.0 110.465 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 46.6 m -60.43 -29.91 69.3 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.065 -1.022 . . . . 0.0 110.558 -178.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.405 ' O ' ' C ' ' A' ' 95' ' ' GLN . 30.3 p -98.68 -3.13 36.67 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.112 -0.992 . . . . 0.0 110.308 -179.506 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.405 ' C ' ' O ' ' A' ' 94' ' ' THR . 10.6 tt0 -42.42 -48.08 5.1 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.181 -0.95 . . . . 0.0 110.749 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.538 ' O ' ' N ' ' A' ' 98' ' ' GLU . 16.2 tpt180 -141.04 -28.92 0.67 Allowed 'General case' 0 N--CA 1.497 1.877 0 O-C-N 120.923 -1.111 . . . . 0.0 109.778 -179.657 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 56.9 tttm -52.41 86.42 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.308 0 O-C-N 121.189 -0.944 . . . . 0.0 110.109 -179.444 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.538 ' N ' ' O ' ' A' ' 96' ' ' ARG . 1.5 pp20? -167.19 129.27 1.66 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.154 -0.966 . . . . 0.0 109.438 179.78 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.475 ' OXT' ' CD2' ' A' ' 99' ' ' PHE . 58.2 t80 . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 117.958 -1.02 . . . . 0.0 109.457 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.576 HD22 ' N ' ' A' ' 1' ' ' LEU . 3.5 mm? . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -61.63 107.47 0.81 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.22 -0.925 . . . . 0.0 109.508 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -169.67 162.87 9.93 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.265 -0.897 . . . . 0.0 109.43 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.0 m -149.79 135.09 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.251 -0.906 . . . . 0.0 109.444 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.443 ' CZ3' ' O ' ' A' ' 6' ' ' GLU . 5.8 p-90 -80.8 12.2 3.38 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.317 -0.864 . . . . 0.0 109.454 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.443 ' O ' ' CZ3' ' A' ' 5' ' ' TRP . 25.7 tp10 49.52 -102.37 0.1 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.285 -0.885 . . . . 0.0 109.436 179.816 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -165.43 -31.46 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.022 -1.048 . . . . 0.0 109.595 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.5 pp -165.08 137.04 4.27 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.215 -0.928 . . . . 0.0 109.536 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -99.4 24.99 7.4 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.321 -0.862 . . . . 0.0 109.53 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -83.01 8.75 62.26 Favored Glycine 0 N--CA 1.494 2.516 0 N-CA-C 109.345 -1.502 . . . . 0.0 109.345 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.622 HD22 ' N ' ' A' ' 11' ' ' LEU . 3.3 mm? 56.28 32.04 19.66 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.727 -0.866 . . . . 0.0 110.121 -179.293 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.489 ' C ' ' H ' ' A' ' 14' ' ' ASN . 6.3 m-20 43.36 76.94 0.48 Allowed Pre-proline 0 N--CA 1.503 2.224 0 O-C-N 121.112 -0.993 . . . . 0.0 110.601 178.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_endo -70.2 9.57 0.65 Allowed 'Trans proline' 0 C--N 1.319 -0.998 0 C-N-CA 121.528 1.485 . . . . 0.0 108.895 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.524 ' O ' ' N ' ' A' ' 16' ' ' PHE . 17.3 m120 -98.21 93.22 6.12 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.532 ' NE ' ' O ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -44.14 -18.19 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 179.921 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.524 ' N ' ' O ' ' A' ' 14' ' ' ASN . 6.9 t80 78.39 60.43 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.638 -0.664 . . . . 0.0 110.272 179.442 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 24.5 m120 47.53 83.78 0.21 Allowed Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.182 -0.949 . . . . 0.0 110.035 178.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -59.23 -11.67 13.85 Favored 'Trans proline' 0 C--N 1.32 -0.926 0 C-N-CA 121.272 1.314 . . . . 0.0 110.252 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.1 ttpm? -57.3 -40.92 78.87 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.285 -0.885 . . . . 0.0 110.718 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 48.6 m -66.33 -39.71 89.42 Favored 'General case' 0 C--N 1.307 -1.261 0 O-C-N 120.863 -1.148 . . . . 0.0 110.248 -178.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -55.96 -34.7 65.95 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -68.77 -35.34 76.95 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.317 -0.864 . . . . 0.0 109.741 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.6 mt -72.58 -61.56 1.65 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 O-C-N 120.764 -1.21 . . . . 0.0 108.865 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.7 tp -46.38 -35.83 5.85 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.198 -0.939 . . . . 0.0 110.765 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.521 ' O ' ' ND1' ' A' ' 25' ' ' HIS . 0.9 OUTLIER -78.88 -14.57 59.16 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.46 -1.4 . . . . 0.0 109.691 -179.971 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.435 ' OD1' HD21 ' A' ' 33' ' ' LEU . 94.5 m-20 -78.97 92.9 5.0 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.98 -1.075 . . . . 0.0 108.875 179.108 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.416 HD13 HG21 ' A' ' 27' ' ' ILE . 23.1 mt -75.09 -52.28 19.24 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.322 0 O-C-N 121.235 -0.916 . . . . 0.0 110.724 -178.783 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 19.0 m-20 -87.42 12.69 11.54 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 120.848 -1.158 . . . . 0.0 110.086 -179.51 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.4 m 43.94 55.92 4.98 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.204 -0.935 . . . . 0.0 110.611 178.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.418 ' OD1' ' O ' ' A' ' 30' ' ' ASP . 12.0 t70 -98.19 -3.09 38.32 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.106 -0.996 . . . . 0.0 108.66 179.357 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 75.65 0.62 63.9 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -179.619 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -143.41 164.53 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.235 -1.156 . . . . 0.0 108.683 178.555 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.435 HD21 ' OD1' ' A' ' 26' ' ' ASP . 66.0 mt -114.63 128.98 56.61 Favored 'General case' 0 N--CA 1.516 2.866 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 178.189 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 40.4 p-10 -107.96 163.88 12.75 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.297 -0.877 . . . . 0.0 109.843 -179.423 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.417 ' O ' ' OE2' ' A' ' 35' ' ' GLU . 0.4 OUTLIER -51.67 -11.36 0.14 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.51 -0.744 . . . . 0.0 110.379 -179.612 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 40.2 mm-40 -82.57 -36.59 26.09 Favored 'General case' 0 C--N 1.297 -1.704 0 O-C-N 120.801 -1.187 . . . . 0.0 109.559 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -72.86 -33.6 66.21 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.086 -1.009 . . . . 0.0 109.234 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.4 mt -82.22 -36.27 27.39 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.16 -0.962 . . . . 0.0 109.249 178.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -60.83 -41.86 96.61 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 120.758 -1.213 . . . . 0.0 108.944 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.81 -29.56 62.23 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.248 -0.908 . . . . 0.0 110.515 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.545 ' O ' HD23 ' A' ' 41' ' ' LEU . 0.8 OUTLIER -76.66 -24.96 53.27 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.026 -1.046 . . . . 0.0 110.18 -179.536 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -78.91 -49.88 12.1 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.592 -1.318 . . . . 0.0 108.934 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 34.5 m -63.37 -40.73 98.06 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.217 -0.927 . . . . 0.0 110.371 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 27.3 ttpt -73.84 -47.5 38.03 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.175 -0.953 . . . . 0.0 111.213 -178.359 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -54.24 -27.73 36.73 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.764 -1.21 . . . . 0.0 110.073 -178.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 28.0 mt -77.18 -25.38 51.8 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.981 -1.075 . . . . 0.0 110.702 -179.242 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.421 ' OE2' ' O ' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -67.52 0.91 2.66 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.688 -1.257 . . . . 0.0 109.866 -179.19 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -108.36 24.01 13.65 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.215 -0.928 . . . . 0.0 109.616 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 41.8 t -148.06 -57.16 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 O-C-N 121.094 -1.004 . . . . 0.0 109.75 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.589 ' CZ ' ' SD ' ' A' ' 62' ' ' MET . 78.6 m-85 -81.12 -163.44 0.6 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.14 -0.975 . . . . 0.0 109.835 -179.594 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -152.16 80.1 6.02 Favored Pre-proline 0 N--CA 1.495 1.779 0 O-C-N 121.285 -0.885 . . . . 0.0 109.35 -179.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -57.22 179.17 0.13 Allowed 'Trans proline' 0 C--N 1.319 -0.978 0 C-N-CA 121.372 1.382 . . . . 0.0 110.112 -179.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 85.6 mttt 55.24 72.62 0.47 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.443 -0.786 . . . . 0.0 109.243 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 22.5 p-10 -172.88 -36.83 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.461 -0.774 . . . . 0.0 110.124 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.491 ' C ' ' H ' ' A' ' 57' ' ' ASP . 69.9 mm-40 -136.02 135.03 39.12 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.487 -0.758 . . . . 0.0 109.772 -179.762 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -58.72 -4.0 0.38 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.284 -0.885 . . . . 0.0 109.127 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.491 ' H ' ' C ' ' A' ' 55' ' ' GLU . 37.6 t0 -143.07 85.21 1.86 Allowed 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.497 ' C ' ' H ' ' A' ' 60' ' ' ARG . 26.6 t0 -125.51 158.14 35.27 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.599 -0.688 . . . . 0.0 109.734 -179.403 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 37.6 mtp 61.83 -3.02 0.25 Allowed 'General case' 0 N--CA 1.488 1.444 0 CA-C-O 121.18 0.514 . . . . 0.0 109.718 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.533 ' O ' ' N ' ' A' ' 62' ' ' MET . 66.2 ttt180 -80.85 -60.24 2.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.986 -1.071 . . . . 0.0 109.054 179.415 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -48.38 -9.26 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.215 -0.928 . . . . 0.0 110.418 -179.47 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.589 ' SD ' ' CZ ' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -124.31 -2.29 8.06 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.255 -0.903 . . . . 0.0 109.87 -179.929 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.404 ' C ' ' O ' ' A' ' 62' ' ' MET . 4.2 mt-10 -40.64 -20.83 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.179 0 CA-C-O 121.368 0.604 . . . . 0.0 109.57 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.564 ' N ' ' O ' ' A' ' 62' ' ' MET . 51.5 mt-10 -65.27 -23.3 67.01 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.224 -0.923 . . . . 0.0 109.775 179.383 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -69.85 -43.05 72.72 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.264 -0.898 . . . . 0.0 109.944 -179.417 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 8.2 mtm180 -56.38 -46.48 80.08 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.137 -0.977 . . . . 0.0 109.38 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 54.2 mt -67.33 -28.13 67.72 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.229 -0.92 . . . . 0.0 110.148 -179.253 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 6.3 mmm180 -64.3 -42.64 96.27 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.905 -1.122 . . . . 0.0 109.758 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 4.6 mtt -84.29 -50.1 8.15 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.015 -1.053 . . . . 0.0 109.698 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -55.37 -38.06 68.36 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.064 -1.023 . . . . 0.0 110.846 -179.722 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -82.16 -51.84 7.57 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 120.75 -1.219 . . . . 0.0 110.764 -179.068 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 43.8 t-80 -53.86 -37.28 63.51 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.021 -1.049 . . . . 0.0 110.099 -179.473 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 79.4 t -75.07 -54.0 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 120.703 -1.248 . . . . 0.0 109.677 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.44 ' O ' ' CG ' ' A' ' 78' ' ' ASP . 18.9 mtp -65.92 -13.66 60.11 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.221 -0.924 . . . . 0.0 110.302 -179.44 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -89.37 -38.93 13.77 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.357 -1.464 . . . . 0.0 110.713 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ASN . . . . . 0.466 ' OD1' ' N ' ' A' ' 77' ' ' VAL . 46.7 p-10 -102.66 -22.53 13.95 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.106 -0.996 . . . . 0.0 112.285 -178.187 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.466 ' N ' ' OD1' ' A' ' 76' ' ' ASN . 42.1 t -94.69 -34.65 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 O-C-N 120.308 -1.495 . . . . 0.0 109.485 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.579 ' OD2' ' NE2' ' A' ' 81' ' ' GLN . 17.9 p-10 -48.64 101.7 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.864 -1.148 . . . . 0.0 109.158 178.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -76.19 -65.47 0.92 Allowed 'General case' 0 C--N 1.295 -1.781 0 O-C-N 120.975 -1.078 . . . . 0.0 110.703 -178.599 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.465 ' O ' ' N ' ' A' ' 82' ' ' ASP . 63.1 t30 -105.51 25.73 10.36 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 121.185 -0.947 . . . . 0.0 109.357 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.579 ' NE2' ' OD2' ' A' ' 78' ' ' ASP . 20.8 mm-40 37.88 29.01 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 121.17 0.51 . . . . 0.0 111.092 178.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.534 ' C ' ' H ' ' A' ' 84' ' ' LEU . 17.3 p-10 -84.02 12.91 5.57 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 178.706 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 15.6 mmt180 65.09 -3.22 0.63 Allowed 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 -178.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.534 ' H ' ' C ' ' A' ' 82' ' ' ASP . 6.5 mp -122.03 134.59 54.79 Favored 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 107.289 -1.374 . . . . 0.0 107.289 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 74.5 t -113.69 131.67 64.85 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.109 0 O-C-N 121.643 -0.661 . . . . 0.0 109.691 -178.455 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 64.6 p -99.61 166.12 11.29 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.043 -1.035 . . . . 0.0 109.543 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.9 tp -67.3 -36.78 82.21 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 179.518 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.555 ' CD ' ' H ' ' A' ' 88' ' ' GLU . 13.7 mp0 -56.64 -67.62 0.29 Allowed 'General case' 0 C--N 1.294 -1.835 0 O-C-N 121.434 -0.791 . . . . 0.0 110.642 -178.798 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -62.84 -38.0 89.06 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.268 -0.895 . . . . 0.0 111.347 -178.241 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -57.06 -50.94 71.2 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.476 -1.39 . . . . 0.0 109.572 -178.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 80.4 mt -50.11 -47.74 53.78 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.102 -0.999 . . . . 0.0 109.008 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -51.06 -59.61 3.99 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.394 -0.817 . . . . 0.0 109.945 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 46.3 t -45.35 -25.93 0.46 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.138 -0.976 . . . . 0.0 110.428 -179.42 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 43.6 p -97.82 -2.94 39.85 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.133 -0.979 . . . . 0.0 109.866 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -73.64 52.04 0.38 Allowed 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 107.888 -1.152 . . . . 0.0 107.888 178.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.458 ' C ' ' H ' ' A' ' 98' ' ' GLU . 3.9 tpt180 176.55 -35.09 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.965 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 179.129 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 3.0 tppt? -59.93 -1.71 0.32 Allowed 'General case' 0 C--N 1.308 -1.235 0 O-C-N 121.139 -0.975 . . . . 0.0 109.825 -179.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.458 ' H ' ' C ' ' A' ' 96' ' ' ARG . 48.0 mm-40 -61.22 89.41 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.268 -0.895 . . . . 0.0 109.221 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 49.2 t80 . . . . . 0 N--CA 1.493 1.686 0 CA-C-O 117.989 -1.005 . . . . 0.0 109.462 179.992 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.487 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm 44.58 -159.28 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.412 -0.805 . . . . 0.0 109.765 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.504 ' C ' ' H ' ' A' ' 5' ' ' TRP . 39.7 tt0 -71.32 77.13 0.74 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.183 -0.948 . . . . 0.0 109.379 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.419 ' O ' ' O ' ' A' ' 5' ' ' TRP . 3.6 t 58.55 0.59 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.366 -0.834 . . . . 0.0 109.698 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.504 ' H ' ' C ' ' A' ' 3' ' ' GLU . 30.6 t90 50.41 97.76 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.15 -0.969 . . . . 0.0 109.808 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.436 ' O ' ' O ' ' A' ' 7' ' ' GLU . 13.3 pt-20 -155.53 -26.17 0.11 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.17 -0.956 . . . . 0.0 109.51 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.436 ' O ' ' O ' ' A' ' 6' ' ' GLU . 35.4 tt0 60.09 129.02 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.54 -0.725 . . . . 0.0 109.947 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.5 tt -163.53 63.81 0.17 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.156 -0.965 . . . . 0.0 108.954 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -50.09 -45.7 52.82 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.211 -0.931 . . . . 0.0 109.436 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 165.81 55.52 0.03 OUTLIER Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.137 -1.585 . . . . 0.0 109.137 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 62.6 mt -135.9 -167.06 1.97 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.487 -1.008 . . . . 0.0 108.887 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 59.5 t0 45.81 68.79 3.05 Favored Pre-proline 0 N--CA 1.501 2.088 0 O-C-N 121.274 -0.891 . . . . 0.0 109.982 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.439 ' O ' ' O ' ' A' ' 14' ' ' ASN . 1.9 Cg_endo -67.58 -2.34 8.23 Favored 'Trans proline' 0 C--N 1.321 -0.903 0 C-N-CA 121.773 1.649 . . . . 0.0 109.515 178.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.439 ' O ' ' O ' ' A' ' 13' ' ' PRO . 43.1 t-20 42.09 94.93 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.416 -0.802 . . . . 0.0 110.663 179.227 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.591 HH11 ' CG ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -161.64 150.84 16.08 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.918 -1.114 . . . . 0.0 110.229 179.91 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 7.9 t80 57.79 -163.79 0.19 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.551 -0.718 . . . . 0.0 109.794 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.9 p-10 -171.83 78.04 0.49 Allowed Pre-proline 0 N--CA 1.49 1.543 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 -179.528 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -59.37 -16.77 36.69 Favored 'Trans proline' 0 C--N 1.32 -0.937 0 C-N-CA 121.436 1.424 . . . . 0.0 111.228 -178.336 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 51.4 tttm -66.81 -36.53 82.6 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.906 -1.121 . . . . 0.0 111.077 -179.053 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.3 m -74.12 -41.6 61.34 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.617 -1.302 . . . . 0.0 110.367 -178.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.417 ' CD2' ' NE2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -55.28 -34.26 63.93 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 179.97 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -68.98 -35.96 77.32 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.347 -0.845 . . . . 0.0 109.686 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 97.2 mt -71.34 -61.07 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.225 0 O-C-N 120.827 -1.171 . . . . 0.0 109.007 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.9 tp -46.63 -38.02 9.06 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.31 -0.869 . . . . 0.0 110.751 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.417 ' NE2' ' CD2' ' A' ' 21' ' ' PHE . 0.4 OUTLIER -74.99 -16.24 60.63 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.327 -1.483 . . . . 0.0 109.712 179.871 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -78.71 91.0 4.63 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.981 -1.074 . . . . 0.0 108.527 179.239 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 87.5 mt -75.75 -43.04 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.35 0 O-C-N 121.421 -0.799 . . . . 0.0 110.869 -178.446 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 51.7 t-20 -95.24 12.66 28.14 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.015 -1.053 . . . . 0.0 110.083 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 49.9 p 43.92 53.05 6.47 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.198 -0.939 . . . . 0.0 110.519 178.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -97.19 -3.78 40.27 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.09 -1.006 . . . . 0.0 108.886 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 76.94 -1.36 63.34 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.1 156.33 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 O-C-N 121.287 -1.125 . . . . 0.0 108.298 178.174 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 31.1 mt -114.42 128.86 56.55 Favored 'General case' 0 N--CA 1.512 2.664 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 178.426 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.434 ' OD1' ' OE2' ' A' ' 37' ' ' GLU . 45.0 p-10 -106.21 174.27 5.96 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.31 -0.869 . . . . 0.0 110.436 -179.029 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -52.08 -11.63 0.18 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.808 -0.557 . . . . 0.0 110.12 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 50.1 mm-40 -83.13 -43.0 16.7 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.884 -1.135 . . . . 0.0 109.048 179.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.527 ' N ' ' OE1' ' A' ' 37' ' ' GLU . 0.3 OUTLIER -73.48 -29.93 62.83 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.312 -0.867 . . . . 0.0 108.789 179.377 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.5 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 10.2 mp -82.13 -40.03 22.45 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.545 -0.722 . . . . 0.0 109.435 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -70.23 -37.34 74.97 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 120.831 -1.168 . . . . 0.0 109.725 -179.797 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.62 -28.5 61.83 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.256 -0.903 . . . . 0.0 111.028 -179.069 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 mp -76.13 -27.9 57.23 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.85 -1.156 . . . . 0.0 110.525 -178.533 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.5 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 8.0 m-85 -80.91 -45.38 16.84 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 120.655 -1.278 . . . . 0.0 109.545 -179.281 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 51.4 m -63.96 -51.36 64.75 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.129 -0.982 . . . . 0.0 111.098 -178.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.439 ' CG ' ' N ' ' A' ' 45' ' ' GLU . 13.7 ptmt -66.96 -47.15 72.51 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.877 -1.139 . . . . 0.0 111.709 -177.764 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.439 ' N ' ' CG ' ' A' ' 44' ' ' LYS . 28.1 mt-10 -54.31 -27.31 34.67 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 120.309 -1.494 . . . . 0.0 108.444 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 8.1 tp -76.55 -24.14 53.59 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.463 -0.773 . . . . 0.0 109.37 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -63.53 -36.27 83.24 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.435 -0.791 . . . . 0.0 110.206 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.9 pttt -90.33 39.37 0.97 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.832 -1.167 . . . . 0.0 110.541 -179.177 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 21.7 t -146.97 -58.48 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 120.938 -1.101 . . . . 0.0 110.068 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.568 ' CZ ' ' SD ' ' A' ' 62' ' ' MET . 30.2 m-85 -85.38 -10.19 56.59 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.017 -1.052 . . . . 0.0 109.903 -179.499 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.541 ' C ' ' H ' ' A' ' 53' ' ' LYS . 7.9 m-20 50.4 88.64 0.11 Allowed Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 120.943 -1.098 . . . . 0.0 109.511 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -63.35 10.65 0.1 OUTLIER 'Trans proline' 0 C--N 1.322 -0.833 0 C-N-CA 121.317 1.345 . . . . 0.0 110.791 -179.443 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.541 ' H ' ' C ' ' A' ' 51' ' ' ASP . 94.9 mttt -112.2 30.94 6.64 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.465 -0.772 . . . . 0.0 109.68 -179.817 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 40.2 t30 -135.51 5.18 3.17 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.398 -0.814 . . . . 0.0 110.101 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -171.11 143.49 1.95 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.895 -1.128 . . . . 0.0 109.68 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.519 ' CD ' ' H ' ' A' ' 56' ' ' GLU . 5.8 mp0 -81.87 5.86 17.58 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.214 -0.929 . . . . 0.0 109.408 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.419 ' OD1' ' O ' ' A' ' 57' ' ' ASP . 40.9 t0 -54.64 -5.27 0.08 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.356 -0.84 . . . . 0.0 109.875 -179.5 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.466 ' O ' ' N ' ' A' ' 60' ' ' ARG . 36.9 m-20 51.58 28.24 4.51 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.133 -0.979 . . . . 0.0 109.573 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 61.9 mtp 48.93 14.15 0.07 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.261 -0.899 . . . . 0.0 109.532 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.466 ' N ' ' O ' ' A' ' 58' ' ' ASP . 40.1 ttp180 -69.3 -53.92 17.22 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.245 -0.909 . . . . 0.0 109.762 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -60.19 -41.61 93.3 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.094 -1.004 . . . . 0.0 110.186 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.568 ' SD ' ' CZ ' ' A' ' 50' ' ' TYR . 9.7 tpt -71.35 -9.36 58.02 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.139 -0.976 . . . . 0.0 109.76 -179.305 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.457 ' CG ' ' O ' ' A' ' 60' ' ' ARG . 0.5 OUTLIER -50.14 -7.75 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.954 -1.092 . . . . 0.0 109.967 179.812 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.528 ' N ' ' O ' ' A' ' 62' ' ' MET . 54.9 mt-10 -54.12 -45.56 71.95 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.065 -1.022 . . . . 0.0 110.039 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -67.45 -26.23 66.29 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.999 -1.063 . . . . 0.0 109.288 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.1 ttm180 -57.2 -41.73 79.95 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.224 -0.923 . . . . 0.0 109.519 -179.563 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.575 HD12 ' C ' ' A' ' 67' ' ' LEU . 0.7 OUTLIER -81.7 -28.36 33.49 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.114 -0.991 . . . . 0.0 109.873 -179.629 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.8 tmm_? -60.59 -36.74 79.29 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.127 -0.983 . . . . 0.0 109.648 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 36.6 mtt -85.73 -37.47 19.33 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.063 -1.023 . . . . 0.0 109.737 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -61.75 -41.51 97.76 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.012 -1.055 . . . . 0.0 111.115 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.465 ' N ' ' CD ' ' A' ' 71' ' ' GLU . 1.3 mp0 -84.02 -52.46 6.29 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 120.965 -1.084 . . . . 0.0 111.147 -178.332 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 28.0 m170 -53.86 -39.81 65.97 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.894 -1.129 . . . . 0.0 110.121 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 72.9 t -75.12 -51.2 22.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 120.756 -1.215 . . . . 0.0 109.932 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 19.6 mtp -67.82 -14.74 63.2 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.934 -1.103 . . . . 0.0 110.094 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 23.6 ttpp -85.24 -32.55 22.54 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.373 -1.454 . . . . 0.0 110.506 -179.309 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ASN . . . . . 0.467 ' OD1' ' N ' ' A' ' 77' ' ' VAL . 43.5 p-10 -111.96 -23.31 10.6 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.18 -0.95 . . . . 0.0 112.647 -177.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.467 ' N ' ' OD1' ' A' ' 76' ' ' ASN . 32.5 t -95.13 -38.25 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.49 0 O-C-N 120.458 -1.401 . . . . 0.0 110.61 -178.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.23 102.57 0.86 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.443 -1.411 . . . . 0.0 107.433 178.713 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.404 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -81.33 -52.8 6.91 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.356 -0.84 . . . . 0.0 111.777 -177.475 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.447 ' O ' ' N ' ' A' ' 82' ' ' ASP . 56.8 t-20 -100.0 23.46 9.82 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.199 -0.938 . . . . 0.0 109.641 -179.485 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.427 ' C ' ' O ' ' A' ' 80' ' ' ASN . 33.3 mm-40 32.68 35.73 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 CA-C-O 121.079 0.466 . . . . 0.0 112.088 178.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.542 ' C ' ' H ' ' A' ' 84' ' ' LEU . 48.9 t0 -85.45 12.3 8.69 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 178.473 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.528 HH11 ' HG2' ' A' ' 83' ' ' ARG . 4.3 mtt-85 64.9 -4.29 0.49 Allowed 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 -178.427 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.542 ' H ' ' C ' ' A' ' 82' ' ' ASP . 14.7 mt -120.64 134.85 55.25 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 178.689 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 71.6 t -112.04 129.62 67.18 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.561 -0.712 . . . . 0.0 109.831 -178.47 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 32.5 p -105.63 159.15 16.19 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 178.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.2 tp -59.33 -35.6 74.14 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.41 -0.807 . . . . 0.0 109.397 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.527 ' CD ' ' H ' ' A' ' 88' ' ' GLU . 6.2 mp0 -60.7 -68.34 0.31 Allowed 'General case' 0 C--N 1.296 -1.757 0 O-C-N 121.24 -0.912 . . . . 0.0 111.828 -177.303 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.404 ' CB ' HG21 ' A' ' 79' ' ' THR . 6.3 mm-40 -63.03 -32.0 73.27 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.033 -1.042 . . . . 0.0 110.563 -177.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -61.37 -51.89 66.93 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.892 -1.13 . . . . 0.0 109.753 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 68.2 mt -50.48 -48.57 56.68 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.25 -0.906 . . . . 0.0 109.256 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -46.66 -49.43 19.27 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.304 -0.873 . . . . 0.0 109.963 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 48.3 t -56.76 -27.55 59.67 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.199 -0.938 . . . . 0.0 109.882 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 29.4 p -99.24 -7.11 26.93 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.229 -0.919 . . . . 0.0 109.778 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.507 ' C ' ' H ' ' A' ' 97' ' ' LYS . 63.3 mt-30 -65.81 141.41 58.3 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.971 -1.081 . . . . 0.0 108.869 179.447 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.544 ' C ' ' H ' ' A' ' 98' ' ' GLU . 22.1 mmm180 55.65 3.61 0.09 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.434 -0.791 . . . . 0.0 109.545 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.507 ' H ' ' C ' ' A' ' 95' ' ' GLN . 79.0 mttt 66.79 -20.38 0.11 Allowed 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.681 -0.637 . . . . 0.0 110.082 -179.384 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.544 ' H ' ' C ' ' A' ' 96' ' ' ARG . 31.1 tp10 50.62 64.18 1.92 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.042 -1.037 . . . . 0.0 109.758 179.683 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 67.2 t80 . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 117.978 -1.01 . . . . 0.0 109.497 179.973 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.562 HD12 ' N ' ' A' ' 1' ' ' LEU . 9.6 mp . . . . . 0 N--CA 1.491 1.586 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 52.3 mttp -148.12 -17.67 0.34 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.238 -0.914 . . . . 0.0 109.264 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 53.59 64.6 1.78 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.326 -0.859 . . . . 0.0 109.571 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 33.6 m -65.13 -147.14 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.213 -0.929 . . . . 0.0 109.369 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 49.5 p90 -153.62 -157.23 0.76 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.125 -0.985 . . . . 0.0 109.383 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.526 ' O ' ' N ' ' A' ' 8' ' ' LEU . 14.0 pt-20 -157.85 -22.18 0.08 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.201 -0.937 . . . . 0.0 109.545 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 65.73 -62.31 0.24 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.446 -0.784 . . . . 0.0 109.568 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.526 ' N ' ' O ' ' A' ' 6' ' ' GLU . 6.3 tp -168.96 39.06 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.218 -0.926 . . . . 0.0 109.487 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.438 ' O ' ' O ' ' A' ' 8' ' ' LEU . 26.3 t0 55.67 165.35 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.476 -0.765 . . . . 0.0 109.702 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -84.59 25.18 5.89 Favored Glycine 0 N--CA 1.492 2.424 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 28.6 tp -58.97 -83.43 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.187 -1.184 . . . . 0.0 108.923 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -171.06 68.23 0.48 Allowed Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.198 -0.939 . . . . 0.0 109.498 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.407 ' O ' ' C ' ' A' ' 14' ' ' ASN . 1.8 Cg_endo -63.1 -45.35 12.71 Favored 'Trans proline' 0 C--N 1.318 -1.032 0 C-N-CA 121.465 1.443 . . . . 0.0 109.864 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.407 ' C ' ' O ' ' A' ' 13' ' ' PRO . 55.5 t-20 41.82 67.95 0.51 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.528 -0.733 . . . . 0.0 110.275 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 58.7 mtp180 -65.18 112.96 3.65 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.319 -0.863 . . . . 0.0 109.459 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -168.15 119.65 0.83 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.323 -0.861 . . . . 0.0 109.243 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -162.93 73.12 2.03 Favored Pre-proline 0 N--CA 1.49 1.535 0 O-C-N 121.212 -0.93 . . . . 0.0 109.828 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -58.76 -15.82 28.21 Favored 'Trans proline' 0 C--N 1.319 -0.994 0 C-N-CA 121.532 1.488 . . . . 0.0 110.33 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 69.0 tttt -57.38 -36.01 70.7 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.36 -0.838 . . . . 0.0 110.824 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 38.9 m -70.27 -39.79 74.74 Favored 'General case' 0 N--CA 1.483 1.2 0 O-C-N 120.58 -1.325 . . . . 0.0 110.083 -178.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.524 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.08 -50.38 71.18 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.083 -1.081 . . . . 0.0 108.083 179.767 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.524 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 41.7 t80 -54.11 -35.16 61.85 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.539 -0.725 . . . . 0.0 110.406 -179.767 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.531 ' O ' ' N ' ' A' ' 25' ' ' HIS . 97.2 mt -73.9 -61.99 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.204 0 O-C-N 120.694 -1.254 . . . . 0.0 108.974 -179.714 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.2 tp -46.22 -12.87 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.021 -1.049 . . . . 0.0 110.898 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.531 ' N ' ' O ' ' A' ' 23' ' ' ILE . 0.7 OUTLIER -102.24 -15.77 16.52 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 120.535 -1.353 . . . . 0.0 110.205 179.952 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.492 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 58.5 p30 -75.36 70.03 2.22 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.81 -1.181 . . . . 0.0 109.362 179.48 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 63.7 mt -50.2 -52.34 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 O-C-N 121.297 -0.877 . . . . 0.0 110.897 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.403 ' O ' ' C ' ' A' ' 29' ' ' SER . 11.6 m-20 -87.89 14.35 9.0 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 120.726 -1.234 . . . . 0.0 110.376 -179.297 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.403 ' C ' ' O ' ' A' ' 28' ' ' ASN . 8.5 t 41.37 48.27 3.23 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.217 -0.927 . . . . 0.0 110.616 178.53 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -92.9 0.69 57.46 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.948 -1.095 . . . . 0.0 108.855 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 74.82 -0.26 57.77 Favored Glycine 0 N--CA 1.487 2.046 0 N-CA-C 109.343 -1.503 . . . . 0.0 109.343 -179.621 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -135.97 166.11 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 O-C-N 121.429 -1.042 . . . . 0.0 108.784 178.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.41 HD21 ' CG ' ' A' ' 25' ' ' HIS . 0.1 OUTLIER -106.13 117.04 33.0 Favored 'General case' 0 N--CA 1.509 2.515 0 N-CA-C 107.44 -1.319 . . . . 0.0 107.44 177.969 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.413 ' OD1' ' N ' ' A' ' 34' ' ' ASP . 0.3 OUTLIER -90.55 165.18 13.91 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.535 -0.728 . . . . 0.0 110.361 -178.397 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -74.99 -39.84 61.03 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.541 -0.725 . . . . 0.0 110.786 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -63.01 -24.44 67.92 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 120.676 -1.265 . . . . 0.0 108.653 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -84.82 -33.0 23.01 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 178.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.8 tp -75.84 -32.13 59.65 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 178.179 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 48.9 tt0 -67.43 -41.47 84.75 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 120.961 -1.087 . . . . 0.0 109.068 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.57 -45.42 53.44 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.271 -0.893 . . . . 0.0 110.769 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.423 HD22 ' CE1' ' A' ' 25' ' ' HIS . 39.7 tp -57.86 -23.26 52.14 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.175 -0.953 . . . . 0.0 109.619 -179.458 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -80.05 -51.22 9.29 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 120.967 -1.083 . . . . 0.0 109.057 -179.378 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 29.5 m -63.37 -34.38 77.59 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.122 -0.986 . . . . 0.0 109.994 -179.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -73.99 -46.98 40.39 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.113 -0.992 . . . . 0.0 110.51 -179.021 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -53.78 -27.54 29.63 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 120.751 -1.218 . . . . 0.0 109.377 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.492 ' C ' ' H ' ' A' ' 48' ' ' LYS . 18.9 mt -84.87 -25.76 27.79 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.292 -0.88 . . . . 0.0 110.58 -179.509 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.74 4.5 0.11 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.809 -1.182 . . . . 0.0 110.346 -179.084 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.492 ' H ' ' C ' ' A' ' 46' ' ' LEU . 40.6 pttt -135.37 41.32 2.78 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.143 -0.973 . . . . 0.0 109.819 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 58.5 t -147.27 -57.15 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 121.27 -0.894 . . . . 0.0 109.262 179.346 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -89.84 -139.57 0.14 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.131 -0.981 . . . . 0.0 109.231 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.545 ' OD2' ' ND2' ' A' ' 54' ' ' ASN . 17.0 p-10 -166.69 77.14 1.08 Allowed Pre-proline 0 N--CA 1.49 1.542 0 O-C-N 121.015 -1.053 . . . . 0.0 109.393 -179.42 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -63.72 11.02 0.1 Allowed 'Trans proline' 0 C--N 1.319 -0.998 0 C-N-CA 121.542 1.495 . . . . 0.0 110.46 -179.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.533 ' H ' ' C ' ' A' ' 51' ' ' ASP . 45.4 mmtt -82.83 -5.37 58.93 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.181 -0.949 . . . . 0.0 109.36 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.545 ' ND2' ' OD2' ' A' ' 51' ' ' ASP . 74.4 m-20 -73.7 -13.34 60.96 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.229 -0.919 . . . . 0.0 109.58 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 46.09 49.62 12.22 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.441 -0.787 . . . . 0.0 109.728 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.401 ' O ' ' OD2' ' A' ' 58' ' ' ASP . 24.5 tt0 -162.54 -52.68 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.34 0 O-C-N 121.243 -0.911 . . . . 0.0 108.663 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.452 ' O ' ' N ' ' A' ' 59' ' ' MET . 28.0 m-20 -56.22 -19.28 13.16 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.367 -0.833 . . . . 0.0 109.634 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.407 ' C ' ' N ' ' A' ' 60' ' ' ARG . 43.8 m-20 48.84 15.44 0.09 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.26 -0.9 . . . . 0.0 109.661 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.452 ' N ' ' O ' ' A' ' 57' ' ' ASP . 63.0 mmm 50.6 16.83 0.33 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.137 -0.977 . . . . 0.0 109.513 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.407 ' N ' ' C ' ' A' ' 58' ' ' ASP . 39.8 ttm180 -82.76 -45.19 14.68 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.187 -0.946 . . . . 0.0 109.578 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -51.47 -51.44 55.02 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.932 -1.105 . . . . 0.0 110.358 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.545 ' O ' ' N ' ' A' ' 64' ' ' GLU . 0.3 OUTLIER -69.76 -9.09 53.21 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.047 -1.033 . . . . 0.0 111.167 -178.622 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.441 ' C ' ' O ' ' A' ' 62' ' ' MET . 12.9 pt-20 -37.92 -26.08 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.523 -0.736 . . . . 0.0 110.699 -179.246 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.545 ' N ' ' O ' ' A' ' 62' ' ' MET . 23.6 mm-40 -54.64 -25.62 27.92 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.226 -0.922 . . . . 0.0 109.54 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.456 ' N ' ' CD ' ' A' ' 65' ' ' GLU . 1.5 mp0 -78.38 -44.59 24.57 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.3 -0.875 . . . . 0.0 109.912 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 57.9 mtt180 -60.43 -43.29 96.95 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.16 -0.963 . . . . 0.0 109.675 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.401 ' O ' ' OE1' ' A' ' 71' ' ' GLU . 42.1 mt -74.33 -29.86 61.78 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.109 -0.994 . . . . 0.0 110.128 -178.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.7 tpp180 -74.43 -38.29 63.06 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.194 -0.941 . . . . 0.0 110.233 -178.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 30.6 mtt -86.36 -46.82 9.92 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 120.956 -1.09 . . . . 0.0 110.096 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 45.1 ttm180 -60.17 -36.98 78.81 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.858 -1.151 . . . . 0.0 110.386 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.401 ' OE1' ' O ' ' A' ' 67' ' ' LEU . 64.2 mt-10 -74.97 -47.78 27.6 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.758 -1.214 . . . . 0.0 110.32 -179.489 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.513 ' CE1' ' OD1' ' A' ' 76' ' ' ASN . 52.0 t-80 -58.04 -38.81 76.95 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.025 -1.047 . . . . 0.0 110.278 -179.329 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 77.9 t -71.86 -55.27 14.06 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 120.785 -1.197 . . . . 0.0 109.815 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 10.4 mtp -64.08 -21.97 66.74 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.054 -1.029 . . . . 0.0 110.107 -179.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -91.03 -32.96 15.71 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.497 -1.377 . . . . 0.0 110.252 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ASN . . . . . 0.513 ' OD1' ' CE1' ' A' ' 72' ' ' HIS . 25.3 m120 -100.78 -9.48 21.69 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.008 -1.057 . . . . 0.0 111.691 -178.801 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 99.4 t -118.62 -33.59 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.515 0 O-C-N 120.667 -1.271 . . . . 0.0 110.698 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -48.94 113.78 0.86 Allowed 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.719 -1.238 . . . . 0.0 108.502 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.403 HG23 ' H ' ' A' ' 79' ' ' THR . 0.4 OUTLIER -91.23 -65.54 1.0 Allowed 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.286 -0.884 . . . . 0.0 112.422 -176.11 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 17.7 p30 -107.16 25.03 11.9 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 120.886 -1.134 . . . . 0.0 110.655 -178.415 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 45.34 78.89 0.06 Allowed 'General case' 0 C--N 1.298 -1.657 0 O-C-N 121.514 -0.741 . . . . 0.0 111.679 177.52 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.558 ' C ' ' H ' ' A' ' 84' ' ' LEU . 26.3 t0 -144.81 19.17 1.64 Allowed 'General case' 0 C--N 1.296 -1.754 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.27 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 47.0 mtm180 58.15 -0.34 0.11 Allowed 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -179.075 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.558 ' H ' ' C ' ' A' ' 82' ' ' ASP . 1.8 mp -125.16 135.57 52.75 Favored 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 107.478 -1.304 . . . . 0.0 107.478 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 60.8 t -113.85 130.45 67.96 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.104 0 O-C-N 121.676 -0.64 . . . . 0.0 109.339 -179.014 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 66.9 p -94.64 163.22 13.47 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.034 -1.041 . . . . 0.0 109.386 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.737 HD13 ' C ' ' A' ' 87' ' ' LEU . 1.2 tm? -68.6 -38.58 80.73 Favored 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 108.002 -1.111 . . . . 0.0 108.002 179.723 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -60.19 -69.49 0.22 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.58 -0.7 . . . . 0.0 111.218 -179.65 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -56.46 -30.56 63.04 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.032 -1.042 . . . . 0.0 110.354 -178.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -62.03 -51.21 68.93 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.852 -1.155 . . . . 0.0 110.106 -179.108 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 89.1 mt -52.22 -38.97 59.57 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.963 -1.085 . . . . 0.0 108.963 178.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.445 ' O ' ' N ' ' A' ' 94' ' ' THR . . . -57.05 -62.75 1.53 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.266 -0.896 . . . . 0.0 109.937 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 45.9 t -44.09 -22.46 0.06 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.383 -0.823 . . . . 0.0 110.14 -179.69 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.445 ' N ' ' O ' ' A' ' 92' ' ' ALA . 44.4 p -98.97 -40.71 7.92 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.349 -0.844 . . . . 0.0 109.785 179.878 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -148.19 124.71 11.02 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.987 -1.071 . . . . 0.0 108.888 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.444 ' CG ' ' O ' ' A' ' 96' ' ' ARG . 4.3 ttp180 -140.48 22.26 2.36 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.106 -0.996 . . . . 0.0 108.98 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 53.3 mttp 53.25 15.95 0.74 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.334 -0.854 . . . . 0.0 109.595 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -73.11 65.0 0.77 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.235 -0.916 . . . . 0.0 109.51 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 57.7 t80 . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 118.047 -0.977 . . . . 0.0 109.418 -179.994 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.418 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 51.3 tp . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 16.7 mtpp -77.18 -30.71 55.01 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.246 -0.909 . . . . 0.0 109.295 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -78.71 -152.13 0.06 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.268 -0.895 . . . . 0.0 109.349 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.448 HG23 ' H ' ' A' ' 7' ' ' GLU . 34.4 m -71.9 -156.87 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.298 -0.876 . . . . 0.0 109.418 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 4.5 m-90 -70.21 54.27 0.14 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.215 -0.928 . . . . 0.0 109.553 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.445 ' N ' ' O ' ' A' ' 4' ' ' VAL . 12.8 mm-40 49.86 48.19 22.08 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.237 -0.914 . . . . 0.0 109.614 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.448 ' H ' HG23 ' A' ' 4' ' ' VAL . 5.5 tp10 54.88 -128.02 2.24 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.289 -0.882 . . . . 0.0 109.476 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.1 tp -160.44 122.79 3.25 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.248 -0.907 . . . . 0.0 109.126 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.508 ' OD1' ' N ' ' A' ' 11' ' ' LEU . 9.6 t70 -51.15 151.79 2.6 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.207 -0.933 . . . . 0.0 110.124 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.444 ' N ' ' OD1' ' A' ' 9' ' ' ASP . . . -80.41 -39.45 15.14 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.368 -1.493 . . . . 0.0 109.368 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.508 ' N ' ' OD1' ' A' ' 9' ' ' ASP . 10.0 tp -154.35 63.0 0.69 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.247 -1.149 . . . . 0.0 109.147 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.432 ' O ' ' O ' ' A' ' 11' ' ' LEU . 0.2 OUTLIER 57.91 162.98 0.08 OUTLIER Pre-proline 0 N--CA 1.506 2.346 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 -179.655 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -57.13 -14.61 15.38 Favored 'Trans proline' 0 C--N 1.319 -1.016 0 C-N-CA 121.22 1.28 . . . . 0.0 109.552 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.535 ' O ' ' N ' ' A' ' 16' ' ' PHE . 2.6 m-20 -48.59 -53.34 18.78 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.313 -0.867 . . . . 0.0 109.685 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.572 HH11 ' CG ' ' A' ' 15' ' ' ARG . 3.8 mtt-85 51.35 -88.23 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.356 -0.84 . . . . 0.0 109.578 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.535 ' N ' ' O ' ' A' ' 14' ' ' ASN . 75.0 m-85 -139.84 -147.68 0.23 Allowed 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.369 -0.832 . . . . 0.0 109.191 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 33.1 t-20 50.13 67.33 4.5 Favored Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.25 -0.906 . . . . 0.0 109.707 -179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -65.29 -17.93 59.41 Favored 'Trans proline' 0 C--N 1.317 -1.081 0 C-N-CA 121.497 1.465 . . . . 0.0 110.09 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.6 tttp -57.3 -34.73 69.01 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.361 -0.837 . . . . 0.0 110.981 -179.505 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 47.9 m -72.17 -41.23 67.29 Favored 'General case' 0 N--CA 1.485 1.282 0 O-C-N 120.695 -1.253 . . . . 0.0 110.226 -178.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.562 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -55.86 -43.88 77.54 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.03 -1.044 . . . . 0.0 108.463 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.562 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 45.3 t80 -61.25 -35.61 77.72 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.45 -0.781 . . . . 0.0 110.355 -179.778 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.401 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.6 mt -73.38 -61.0 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.194 0 O-C-N 120.746 -1.221 . . . . 0.0 109.162 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 22.1 tp -46.33 -34.69 4.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.178 -0.952 . . . . 0.0 110.708 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.45 ' N ' ' ND1' ' A' ' 25' ' ' HIS . 0.3 OUTLIER -79.73 -16.05 56.37 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.314 -1.491 . . . . 0.0 109.705 179.859 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.401 ' N ' ' O ' ' A' ' 23' ' ' ILE . 10.1 t0 -78.42 92.27 4.58 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.036 -1.04 . . . . 0.0 108.798 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 6.4 mt -73.37 -49.66 35.75 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 O-C-N 121.527 -0.733 . . . . 0.0 111.123 -178.488 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 -88.13 8.1 28.49 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.78 -1.2 . . . . 0.0 110.344 -179.445 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.4 p 45.48 60.31 3.14 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.061 -1.024 . . . . 0.0 110.537 179.144 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -101.55 -1.78 32.11 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.286 -0.884 . . . . 0.0 108.891 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 77.59 -1.95 64.88 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.959 -1.256 . . . . 0.0 109.959 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.21 165.41 29.25 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.213 0 O-C-N 121.41 -1.053 . . . . 0.0 108.302 178.303 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.7 tp -116.93 123.17 46.32 Favored 'General case' 0 N--CA 1.513 2.708 0 N-CA-C 107.853 -1.165 . . . . 0.0 107.853 178.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.418 ' OD1' ' OE2' ' A' ' 37' ' ' GLU . 36.2 p-10 -107.77 172.87 6.59 Favored 'General case' 0 N--CA 1.509 2.493 0 CA-C-O 122.179 0.99 . . . . 0.0 111.493 -178.288 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -58.8 -10.59 2.48 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.368 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 41.7 mm-40 -83.03 -48.95 10.07 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.728 -1.232 . . . . 0.0 108.814 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.512 ' N ' ' OE1' ' A' ' 37' ' ' GLU . 0.3 OUTLIER -67.55 -30.26 69.85 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 179.04 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.8 tp -82.09 -33.15 29.91 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.56 -0.712 . . . . 0.0 109.375 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -72.75 -44.21 61.91 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 120.857 -1.152 . . . . 0.0 109.199 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.27 -30.26 62.04 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.266 -0.896 . . . . 0.0 111.011 -178.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 41' ' ' LEU . 40.4 mt -75.56 -21.94 57.45 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 120.836 -1.165 . . . . 0.0 109.464 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -77.48 -50.26 13.02 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.068 -1.02 . . . . 0.0 108.742 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.5 m -61.5 -39.0 89.4 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.427 -0.796 . . . . 0.0 110.575 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 44.1 mtpt -74.97 -36.59 62.04 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.148 -0.97 . . . . 0.0 111.698 -178.098 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -62.78 -30.28 71.34 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.208 -1.558 . . . . 0.0 109.32 -179.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 21.9 mt -72.51 -32.38 66.1 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.037 -1.039 . . . . 0.0 109.279 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 63.9 mm-40 -54.53 -12.87 0.8 Allowed 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.389 -0.819 . . . . 0.0 109.596 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 78.6 mttt -117.34 40.45 3.04 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.506 -0.746 . . . . 0.0 109.87 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 60.8 t -149.49 -59.32 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 O-C-N 121.023 -1.048 . . . . 0.0 109.546 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -89.75 -27.03 20.31 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.18 -0.95 . . . . 0.0 109.905 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 16.4 t0 61.96 72.0 0.68 Allowed Pre-proline 0 N--CA 1.502 2.134 0 O-C-N 121.155 -0.965 . . . . 0.0 108.966 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.64 175.36 1.72 Allowed 'Trans proline' 0 C--N 1.316 -1.144 0 C-N-CA 121.268 1.312 . . . . 0.0 109.84 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.4 ptpp? -171.55 -36.66 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.529 -0.732 . . . . 0.0 109.297 -179.623 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -88.44 -19.62 26.29 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.425 -0.797 . . . . 0.0 109.508 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 64.97 139.69 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -179.254 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 50.02 47.87 22.74 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.383 -0.823 . . . . 0.0 109.464 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.475 ' O ' ' N ' ' A' ' 59' ' ' MET . 24.4 t0 -144.87 -113.51 0.09 Allowed 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.423 -0.798 . . . . 0.0 109.413 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -50.57 -11.34 0.08 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.143 -0.973 . . . . 0.0 109.358 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.475 ' N ' ' O ' ' A' ' 57' ' ' ASP . 96.7 mmm -81.66 21.73 0.79 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.427 -0.796 . . . . 0.0 108.937 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.524 ' O ' ' N ' ' A' ' 62' ' ' MET . 51.4 mtp180 -129.68 -53.92 1.15 Allowed 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 179.704 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -43.26 -16.85 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.44 -0.787 . . . . 0.0 110.928 -179.228 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.561 ' O ' ' N ' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -113.45 5.81 16.88 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.208 -0.932 . . . . 0.0 109.846 179.827 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.408 ' C ' ' O ' ' A' ' 62' ' ' MET . 12.0 pt-20 -41.58 -20.45 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.038 0 CA-C-O 121.528 0.68 . . . . 0.0 109.688 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 62' ' ' MET . 42.7 mt-10 -65.59 -28.78 69.38 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.579 -0.7 . . . . 0.0 109.244 179.183 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -74.71 -40.47 61.31 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.332 -0.855 . . . . 0.0 109.629 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 29.5 mtm180 -64.42 -36.41 84.07 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.183 -0.948 . . . . 0.0 108.974 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 33.2 mt -81.61 -28.51 33.7 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.312 -0.867 . . . . 0.0 109.636 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -72.58 -37.2 68.26 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.243 -0.91 . . . . 0.0 110.02 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 12.6 mtt -85.63 -35.39 20.99 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 120.99 -1.069 . . . . 0.0 109.567 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 64.4 ttt180 -72.0 -33.55 68.17 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.761 -1.212 . . . . 0.0 109.801 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -78.48 -46.56 19.37 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.884 -1.135 . . . . 0.0 109.923 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 42.2 t-80 -60.28 -34.3 73.56 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.153 -0.967 . . . . 0.0 110.154 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 68.9 t -75.0 -55.91 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 O-C-N 120.614 -1.304 . . . . 0.0 109.894 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 5.7 mtt -64.0 -17.45 63.33 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.953 -1.092 . . . . 0.0 110.542 -179.217 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.5 tptm -82.72 -39.05 22.47 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.2 -1.562 . . . . 0.0 110.436 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ASN . . . . . 0.455 ' OD1' ' N ' ' A' ' 77' ' ' VAL . 45.7 p-10 -103.87 -21.89 13.58 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.101 -1.0 . . . . 0.0 112.483 -177.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.455 ' N ' ' OD1' ' A' ' 76' ' ' ASN . 40.5 t -94.99 -35.48 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.414 0 O-C-N 120.404 -1.435 . . . . 0.0 109.507 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -47.57 106.58 0.09 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.043 -1.035 . . . . 0.0 108.889 178.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.56 -72.52 0.33 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.267 -0.895 . . . . 0.0 113.123 -176.791 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.547 ' ND2' ' OD1' ' A' ' 82' ' ' ASP . 15.3 p-10 -106.81 26.88 9.49 Favored 'General case' 0 N--CA 1.513 2.69 0 O-C-N 120.661 -1.274 . . . . 0.0 110.802 -177.288 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 44.7 71.08 0.28 Allowed 'General case' 0 C--N 1.293 -1.869 0 O-C-N 121.433 -0.792 . . . . 0.0 111.185 178.37 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.549 ' C ' ' H ' ' A' ' 84' ' ' LEU . 1.1 m-20 -136.14 18.86 3.2 Favored 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 106.665 -1.606 . . . . 0.0 106.665 177.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 74.0 mtt180 60.69 -2.37 0.18 Allowed 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -178.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.549 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.9 mt -119.96 133.89 55.41 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 53.2 t -109.23 131.66 59.44 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 58.8 p -97.77 157.53 16.02 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 120.926 -1.109 . . . . 0.0 109.732 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.734 HD13 ' C ' ' A' ' 87' ' ' LEU . 0.9 OUTLIER -63.13 -36.62 84.2 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 179.425 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.545 ' CD ' ' H ' ' A' ' 88' ' ' GLU . 20.5 mp0 -58.32 -71.84 0.1 Allowed 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.612 -0.68 . . . . 0.0 112.39 -179.648 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -61.3 -32.49 72.34 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.882 -1.136 . . . . 0.0 110.233 -177.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -57.27 -48.71 78.18 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 120.934 -1.104 . . . . 0.0 109.258 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.454 ' O ' ' N ' ' A' ' 94' ' ' THR . 54.7 mt -52.05 -47.83 64.91 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.979 -1.076 . . . . 0.0 108.822 178.894 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.414 ' C ' ' O ' ' A' ' 91' ' ' LEU . . . -41.57 -57.29 2.3 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.62 -0.675 . . . . 0.0 109.923 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 40.8 t -53.08 -33.72 53.37 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.299 -0.875 . . . . 0.0 109.486 179.296 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.454 ' N ' ' O ' ' A' ' 91' ' ' LEU . 11.6 p -102.27 23.21 12.04 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.441 -0.787 . . . . 0.0 109.296 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -152.95 140.45 19.74 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.248 -0.908 . . . . 0.0 109.854 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.585 ' CG ' HH11 ' A' ' 96' ' ' ARG . 0.0 OUTLIER -145.21 16.01 1.51 Allowed 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 179.377 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.3 mttp 57.75 1.98 0.15 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.723 -0.611 . . . . 0.0 109.906 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.484 ' H ' ' C ' ' A' ' 96' ' ' ARG . 65.1 mt-10 -88.35 49.94 1.88 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.165 -0.959 . . . . 0.0 109.209 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 88.8 m-85 . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 118.054 -0.974 . . . . 0.0 109.646 -179.954 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 8.2 tp . . . . . 0 N--CA 1.492 1.63 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -168.75 -57.22 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.148 -0.97 . . . . 0.0 109.431 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 48.2 tt0 -82.1 99.9 9.47 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.219 -0.925 . . . . 0.0 109.396 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.5 m -57.45 -166.23 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.14 -0.975 . . . . 0.0 109.48 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 71.6 t-105 -162.29 -51.11 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.211 -0.931 . . . . 0.0 109.461 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -61.43 157.17 17.48 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.24 -0.912 . . . . 0.0 109.399 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.1 tt0 -169.77 -21.54 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.213 -0.929 . . . . 0.0 109.357 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 14.9 tp -159.01 92.19 1.08 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.249 -0.907 . . . . 0.0 109.42 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -83.89 76.29 10.04 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.6 -0.688 . . . . 0.0 109.432 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.533 ' O ' ' N ' ' A' ' 12' ' ' ASP . . . -47.63 -36.78 12.93 Favored Glycine 0 N--CA 1.492 2.369 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 37.1 tp -43.54 -17.98 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.594 -0.945 . . . . 0.0 109.731 -179.647 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.533 ' N ' ' O ' ' A' ' 10' ' ' GLY . 1.3 m-20 -126.7 79.68 71.43 Favored Pre-proline 0 N--CA 1.499 2.024 0 O-C-N 121.351 -0.843 . . . . 0.0 109.394 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -62.0 -2.43 2.94 Favored 'Trans proline' 0 C--N 1.319 -0.996 0 C-N-CA 121.23 1.287 . . . . 0.0 109.654 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.419 ' H ' ' C ' ' A' ' 12' ' ' ASP . 7.9 m120 -43.81 -35.92 2.11 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.566 -0.709 . . . . 0.0 109.866 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.3 mmt180 -81.7 -47.96 12.28 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.2 -0.937 . . . . 0.0 109.278 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -74.31 122.22 22.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.309 -0.87 . . . . 0.0 109.499 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.7 p-10 -172.88 68.41 0.38 Allowed Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 121.25 -0.906 . . . . 0.0 109.491 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -63.55 -20.67 69.97 Favored 'Trans proline' 0 C--N 1.318 -1.031 0 C-N-CA 121.449 1.432 . . . . 0.0 110.006 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -55.28 -33.64 63.4 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.179 -0.95 . . . . 0.0 110.773 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.1 m -74.17 -41.64 61.16 Favored 'General case' 0 N--CA 1.484 1.259 0 O-C-N 120.741 -1.225 . . . . 0.0 110.429 -178.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -55.89 -34.65 65.72 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.906 -1.121 . . . . 0.0 108.301 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -70.32 -34.86 73.18 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.402 -0.811 . . . . 0.0 110.089 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.419 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.7 mt -72.4 -60.84 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 O-C-N 120.827 -1.171 . . . . 0.0 109.261 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.2 tp -45.6 -33.55 2.9 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.196 -0.94 . . . . 0.0 110.932 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -83.75 -14.41 51.59 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 120.261 -1.525 . . . . 0.0 109.66 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 23' ' ' ILE . 91.7 m-20 -75.52 94.79 3.2 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.068 -1.02 . . . . 0.0 108.916 179.143 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.411 HD13 HG21 ' A' ' 27' ' ' ILE . 28.4 mt -76.81 -49.93 22.45 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.308 0 O-C-N 121.406 -0.809 . . . . 0.0 110.955 -178.801 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 51.5 t-20 -89.55 7.12 37.9 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 120.706 -1.246 . . . . 0.0 110.106 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 24.6 p 44.35 51.28 7.7 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.097 -1.002 . . . . 0.0 110.624 178.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -93.19 5.37 51.76 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.081 -1.012 . . . . 0.0 108.423 179.077 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 73.61 2.7 61.0 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.669 -1.372 . . . . 0.0 109.669 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -141.94 166.34 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 O-C-N 121.261 -1.141 . . . . 0.0 108.665 178.59 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.1 tp -113.93 112.36 23.2 Favored 'General case' 0 N--CA 1.512 2.631 0 N-CA-C 107.478 -1.305 . . . . 0.0 107.478 178.074 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.58 178.41 6.79 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.503 -0.748 . . . . 0.0 110.645 -178.129 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -73.53 -42.98 61.04 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.467 -0.77 . . . . 0.0 111.25 -178.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.443 ' NE2' ' CG ' ' A' ' 37' ' ' GLU . 1.5 pp0? -60.41 -24.46 65.18 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 120.513 -1.367 . . . . 0.0 108.591 -179.732 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.443 ' CG ' ' NE2' ' A' ' 36' ' ' GLN . 78.4 mt-10 -85.35 -33.28 22.08 Favored 'General case' 0 N--CA 1.498 1.954 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 178.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.1 tp -71.48 -35.49 70.84 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.55 -0.719 . . . . 0.0 109.336 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -74.3 -51.58 14.8 Favored 'General case' 0 C--N 1.306 -1.32 0 O-C-N 121.163 -0.96 . . . . 0.0 110.825 -179.143 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.8 -33.66 76.38 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.879 -1.138 . . . . 0.0 110.876 -178.704 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 40.1 tp -73.17 -27.83 61.87 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.956 -1.09 . . . . 0.0 110.089 -179.001 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -82.18 -47.9 11.93 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 120.716 -1.24 . . . . 0.0 110.156 -179.347 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 18.4 m -59.23 -35.8 74.3 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 120.942 -1.099 . . . . 0.0 110.392 -179.216 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 27.0 ttmt -73.75 -47.79 36.53 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.999 -1.063 . . . . 0.0 111.478 -178.369 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -53.88 -25.91 22.24 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.559 -1.338 . . . . 0.0 108.18 -179.497 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.1 tp -73.33 -21.57 60.52 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -76.74 -35.63 57.65 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.544 -0.722 . . . . 0.0 110.408 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.1 pttp -83.49 -11.98 56.82 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 120.898 -1.126 . . . . 0.0 110.658 -178.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 57.0 t -88.57 -44.87 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 O-C-N 120.94 -1.1 . . . . 0.0 108.438 179.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.464 ' OH ' ' SD ' ' A' ' 62' ' ' MET . 50.5 m-85 -90.55 -153.68 0.31 Allowed 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 179.043 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -152.48 68.06 6.95 Favored Pre-proline 0 N--CA 1.502 2.165 0 O-C-N 120.675 -1.266 . . . . 0.0 110.003 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -57.94 -177.36 0.09 OUTLIER 'Trans proline' 0 C--N 1.318 -1.051 0 C-N-CA 121.472 1.448 . . . . 0.0 109.547 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.466 ' O ' ' CB ' ' A' ' 54' ' ' ASN . 60.5 mttt 67.8 98.37 0.06 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.49 -0.756 . . . . 0.0 109.055 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.466 ' CB ' ' O ' ' A' ' 53' ' ' LYS . 2.1 m-20 81.94 12.98 0.6 Allowed 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -179.561 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 52.0 mm-40 -139.01 50.82 1.81 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.396 -0.815 . . . . 0.0 108.851 179.527 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -54.34 174.38 0.06 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.264 -0.898 . . . . 0.0 109.482 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 48.21 67.45 0.84 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.387 -0.821 . . . . 0.0 109.943 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -158.54 -22.7 0.08 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.221 -0.924 . . . . 0.0 109.369 179.521 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 4.6 mtp -100.04 -6.49 26.35 Favored 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 178.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.542 HH11 ' CG ' ' A' ' 60' ' ' ARG . 0.7 OUTLIER -82.07 -69.1 0.64 Allowed 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.588 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -50.07 -12.92 0.09 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.201 -0.937 . . . . 0.0 109.409 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.464 ' SD ' ' OH ' ' A' ' 50' ' ' TYR . 15.4 tpt -103.5 -12.01 17.41 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.392 -0.817 . . . . 0.0 109.665 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -54.05 -16.61 2.05 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.569 -1.332 . . . . 0.0 108.095 179.476 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -65.38 -44.18 88.39 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.421 -0.799 . . . . 0.0 109.022 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.432 ' O ' ' N ' ' A' ' 68' ' ' ARG . 4.8 tp10 -65.55 -43.99 88.21 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.668 -0.645 . . . . 0.0 109.549 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? -46.08 -36.63 5.94 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 38.2 mt -83.37 -27.27 29.79 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.629 -0.669 . . . . 0.0 109.533 179.066 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.432 ' N ' ' O ' ' A' ' 65' ' ' GLU . 12.3 tpt180 -68.42 -36.89 79.73 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.928 -1.108 . . . . 0.0 109.682 -179.347 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.4 mmt -84.57 -50.76 7.41 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.033 -1.042 . . . . 0.0 109.64 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 41.4 ttp180 -54.69 -38.29 66.83 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.878 -1.139 . . . . 0.0 110.309 -179.442 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -78.35 -53.09 7.67 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.978 -1.077 . . . . 0.0 110.508 -179.029 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 43.1 t60 -56.42 -33.23 65.63 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.019 -1.05 . . . . 0.0 109.506 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 58.4 t -75.04 -54.69 13.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 120.734 -1.228 . . . . 0.0 109.499 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 32.0 mtp -63.58 -16.3 60.47 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.309 -0.869 . . . . 0.0 110.269 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 42.0 tttp -95.56 -38.24 10.5 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.644 -1.285 . . . . 0.0 110.132 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -98.21 -11.12 23.04 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 120.975 -1.078 . . . . 0.0 112.145 -178.015 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 74.0 t -110.32 -34.87 2.53 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.45 0 O-C-N 120.467 -1.396 . . . . 0.0 109.638 179.124 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -59.29 104.13 0.23 Allowed 'General case' 0 N--CA 1.494 1.764 0 O-C-N 120.562 -1.336 . . . . 0.0 107.778 177.656 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.42 HG23 ' H ' ' A' ' 79' ' ' THR . 0.1 OUTLIER -83.16 -53.63 5.64 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.17 -0.956 . . . . 0.0 111.32 -178.22 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -101.87 24.68 9.6 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.24 -0.913 . . . . 0.0 109.666 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 30.7 mm-40 33.08 37.95 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.568 ' C ' ' H ' ' A' ' 84' ' ' LEU . 16.5 p-10 -91.03 14.61 13.5 Favored 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 178.286 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 37.5 mtm180 64.02 -3.88 0.43 Allowed 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.568 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.4 mp -120.52 134.55 55.26 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 179.41 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 82.7 t -112.23 130.12 66.51 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.945 0 O-C-N 121.606 -0.684 . . . . 0.0 109.815 -178.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 26.4 p -103.43 162.35 13.1 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.246 -0.909 . . . . 0.0 108.667 178.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.8 tp -63.35 -35.54 80.73 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.264 -0.898 . . . . 0.0 109.063 179.617 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -60.73 -68.37 0.31 Allowed 'General case' 0 C--N 1.294 -1.824 0 O-C-N 121.128 -0.982 . . . . 0.0 111.623 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -61.46 -30.73 70.77 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.1 -1.0 . . . . 0.0 110.537 -178.095 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -64.58 -51.64 61.69 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.932 -1.105 . . . . 0.0 109.523 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 52.0 mt -48.39 -42.53 32.12 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.297 -0.877 . . . . 0.0 109.421 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -55.19 -57.77 10.43 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.064 -1.022 . . . . 0.0 110.373 -179.581 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 84.8 p -48.08 -61.87 1.76 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.165 -0.959 . . . . 0.0 110.951 -179.119 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.453 ' O ' ' N ' ' A' ' 96' ' ' ARG . 0.2 OUTLIER -62.41 -65.99 0.61 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.105 -0.997 . . . . 0.0 110.302 -178.697 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.447 ' C ' ' O ' ' A' ' 94' ' ' THR . 83.8 mm-40 -32.97 -35.79 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.57 -0.706 . . . . 0.0 111.705 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.453 ' N ' ' O ' ' A' ' 94' ' ' THR . 20.7 mmt180 -60.96 95.47 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.861 -1.15 . . . . 0.0 110.124 -179.525 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 45.5 mttp 55.08 10.5 0.41 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.439 -0.788 . . . . 0.0 110.485 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 50.16 69.56 0.6 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.92 -1.113 . . . . 0.0 109.425 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 56.1 t80 . . . . . 0 N--CA 1.494 1.739 0 CA-C-O 118.007 -0.997 . . . . 0.0 109.396 179.944 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 39.2 tp . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -62.15 135.59 57.57 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.248 -0.907 . . . . 0.0 109.483 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -163.55 -33.33 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.28 -0.887 . . . . 0.0 109.357 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.514 HG22 ' N ' ' A' ' 5' ' ' TRP . 8.3 p -76.36 161.17 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 O-C-N 121.294 -0.879 . . . . 0.0 109.508 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.514 ' N ' HG22 ' A' ' 4' ' ' VAL . 5.1 m-90 -144.13 71.9 1.33 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.284 -0.885 . . . . 0.0 109.15 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -149.83 125.84 10.59 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.221 -0.925 . . . . 0.0 109.502 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 54.73 -109.88 0.52 Allowed 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.524 -0.735 . . . . 0.0 109.641 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.635 ' O ' HD12 ' A' ' 8' ' ' LEU . 0.9 OUTLIER -170.63 157.47 5.76 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.377 -0.827 . . . . 0.0 109.448 -179.657 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.537 ' O ' ' N ' ' A' ' 11' ' ' LEU . 26.1 m-20 -38.55 133.19 1.06 Allowed 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.49 -0.756 . . . . 0.0 109.894 -179.487 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -48.47 -9.56 0.09 OUTLIER Glycine 0 N--CA 1.491 2.339 0 O-C-N 120.61 -1.306 . . . . 0.0 110.359 -179.367 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.537 ' N ' ' O ' ' A' ' 9' ' ' ASP . 0.4 OUTLIER -154.55 62.03 0.68 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.955 -1.321 . . . . 0.0 109.812 -179.952 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -58.33 130.78 84.36 Favored Pre-proline 0 N--CA 1.49 1.527 0 O-C-N 121.081 -1.012 . . . . 0.0 108.763 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -62.0 -10.63 18.34 Favored 'Trans proline' 0 C--O 1.215 -0.63 0 C-N-CA 120.655 0.903 . . . . 0.0 109.867 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 -67.06 -55.21 15.29 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.247 -0.908 . . . . 0.0 109.614 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 38.7 ttp180 48.27 79.29 0.07 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.181 -0.95 . . . . 0.0 109.558 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -78.39 157.13 29.14 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.332 -0.855 . . . . 0.0 109.526 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 33.7 t-20 -171.31 67.37 0.45 Allowed Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 121.304 -0.873 . . . . 0.0 109.738 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -65.34 -23.05 59.32 Favored 'Trans proline' 0 C--N 1.317 -1.13 0 C-N-CA 121.371 1.381 . . . . 0.0 109.761 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 55.7 tttp -56.77 -41.49 77.73 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.401 -0.812 . . . . 0.0 110.803 -179.639 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 29.3 m -64.82 -40.18 94.78 Favored 'General case' 0 N--CA 1.485 1.321 0 O-C-N 120.76 -1.213 . . . . 0.0 110.355 -178.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -55.33 -41.82 72.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.942 -1.099 . . . . 0.0 108.263 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -62.54 -33.13 74.29 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.395 -0.816 . . . . 0.0 110.149 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.411 ' O ' ' N ' ' A' ' 25' ' ' HIS . 96.6 mt -75.84 -62.61 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 O-C-N 120.725 -1.235 . . . . 0.0 109.129 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.9 tp -47.51 -16.2 0.06 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.068 -1.02 . . . . 0.0 111.257 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.54 ' O ' ' ND1' ' A' ' 25' ' ' HIS . 0.7 OUTLIER -100.77 -15.74 17.55 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.479 -1.388 . . . . 0.0 109.833 179.896 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -76.32 89.55 3.17 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.863 -1.148 . . . . 0.0 108.462 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 10.9 mt -71.85 -52.19 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 O-C-N 121.448 -0.782 . . . . 0.0 111.134 -178.384 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 -86.32 4.48 38.95 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.856 -1.153 . . . . 0.0 110.029 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 18.8 p 46.22 57.65 5.13 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.082 -1.011 . . . . 0.0 110.319 179.321 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -99.8 -0.07 40.55 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.274 -0.891 . . . . 0.0 108.737 179.4 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.85 3.76 87.84 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 110.101 -1.2 . . . . 0.0 110.101 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.12 165.35 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.121 0 O-C-N 121.16 -1.2 . . . . 0.0 108.328 178.037 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.405 HD21 ' CD2' ' A' ' 25' ' ' HIS . 4.4 tp -120.43 115.43 23.47 Favored 'General case' 0 N--CA 1.513 2.703 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 178.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.442 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 27.6 p-10 -98.29 -174.21 2.78 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.244 -0.91 . . . . 0.0 111.567 -178.1 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -72.16 -21.23 61.48 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -178.067 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -77.06 -25.86 52.89 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 120.008 -1.683 . . . . 0.0 109.349 -179.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -87.82 -31.84 19.36 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.946 -1.096 . . . . 0.0 108.415 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.2 tp -77.73 -33.58 52.92 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.598 -0.689 . . . . 0.0 109.17 179.072 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -71.85 -44.97 62.94 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.033 -1.042 . . . . 0.0 109.557 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.448 ' HB1' ' NZ ' ' A' ' 44' ' ' LYS . . . -72.13 -43.45 64.66 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.043 -1.035 . . . . 0.0 111.3 -178.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.405 ' CD2' ' CD2' ' A' ' 25' ' ' HIS . 35.7 tp -62.39 -24.94 67.66 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.747 -1.221 . . . . 0.0 109.243 -179.404 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.53 -36.34 63.17 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 120.982 -1.074 . . . . 0.0 108.822 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 17.6 m -62.45 -54.93 32.94 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.468 -0.77 . . . . 0.0 111.747 -178.436 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.448 ' NZ ' ' HB1' ' A' ' 40' ' ' ALA . 1.7 mtmt -72.95 -47.48 45.11 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 120.601 -1.312 . . . . 0.0 112.171 -177.546 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -52.78 -27.93 20.15 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.36 -1.463 . . . . 0.0 109.064 -178.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.2 tp -82.08 -25.02 34.89 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.253 -0.904 . . . . 0.0 108.849 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -72.4 -2.86 20.98 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.543 -0.723 . . . . 0.0 109.706 178.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.1 mttp -102.2 44.05 1.03 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.233 -0.917 . . . . 0.0 109.634 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 45.6 t -149.78 -54.2 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 O-C-N 121.182 -0.949 . . . . 0.0 109.838 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -84.09 -135.3 0.05 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.2 -0.937 . . . . 0.0 110.013 -179.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -142.67 75.71 18.27 Favored Pre-proline 0 N--CA 1.497 1.919 0 O-C-N 121.264 -0.898 . . . . 0.0 109.27 -179.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -60.34 178.42 0.44 Allowed 'Trans proline' 0 C--N 1.316 -1.147 0 C-N-CA 121.411 1.407 . . . . 0.0 110.15 -179.46 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.2 mttp 70.29 31.15 3.18 Favored 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 -179.111 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.503 ' O ' ' CB ' ' A' ' 55' ' ' GLU . 46.4 t30 -134.24 7.36 3.64 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.695 -0.628 . . . . 0.0 109.539 179.771 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.503 ' CB ' ' O ' ' A' ' 54' ' ' ASN . 8.3 tt0 80.47 -149.54 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.423 -0.798 . . . . 0.0 109.372 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -93.31 74.41 4.56 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.995 -1.066 . . . . 0.0 108.965 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -146.06 29.76 1.07 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.486 -0.759 . . . . 0.0 109.959 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -172.43 -17.05 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.953 -1.092 . . . . 0.0 109.547 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.493 ' O ' ' SD ' ' A' ' 62' ' ' MET . 3.3 mmt -108.46 15.34 23.98 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 179.309 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 38.4 ttp180 -97.6 -68.31 0.81 Allowed 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 178.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -35.06 -41.26 0.14 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.875 -0.516 . . . . 0.0 112.175 -179.157 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.594 ' SD ' ' N ' ' A' ' 63' ' ' GLU . 0.0 OUTLIER -89.0 -0.3 57.3 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 120.531 -1.356 . . . . 0.0 111.103 -178.741 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.594 ' N ' ' SD ' ' A' ' 62' ' ' MET . 1.1 pp20? -33.39 -30.08 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.31 0 CA-C-O 121.451 0.643 . . . . 0.0 110.668 -178.562 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.562 ' N ' ' O ' ' A' ' 62' ' ' MET . 46.1 mm-40 -68.8 -54.57 15.11 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.419 -0.8 . . . . 0.0 109.316 178.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.44 ' N ' ' O ' ' A' ' 62' ' ' MET . 7.5 tp10 -43.23 -41.52 3.91 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.604 -0.685 . . . . 0.0 110.698 -179.181 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 6.4 mmm180 -51.81 -46.11 64.15 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.123 -0.986 . . . . 0.0 109.296 -179.634 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 27.3 mt -79.28 -26.88 42.28 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.276 -0.89 . . . . 0.0 110.211 -179.301 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.11 -39.67 82.74 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.025 -1.047 . . . . 0.0 110.368 -178.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 9.8 mtt -86.08 -48.7 8.39 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 120.906 -1.121 . . . . 0.0 110.099 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.485 HH11 ' HG2' ' A' ' 70' ' ' ARG . 2.7 ttt-85 -55.0 -36.22 65.19 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.771 -1.206 . . . . 0.0 109.767 179.832 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -71.91 -50.7 26.91 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 120.847 -1.158 . . . . 0.0 110.276 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 45.0 t-80 -56.23 -35.18 67.08 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.045 -1.034 . . . . 0.0 110.529 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 70.2 t -71.54 -55.12 14.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 120.613 -1.304 . . . . 0.0 109.776 -179.69 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.6 mmt -61.53 -22.13 64.87 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.228 -0.92 . . . . 0.0 110.069 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.408 ' HZ2' ' HB3' ' A' ' 75' ' ' LYS . 0.2 OUTLIER -84.34 -37.04 22.08 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.505 -1.372 . . . . 0.0 111.162 -179.141 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ASN . . . . . 0.483 ' OD1' ' N ' ' A' ' 77' ' ' VAL . 32.2 p-10 -102.01 -24.99 13.91 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 120.961 -1.087 . . . . 0.0 112.611 -177.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.483 ' N ' ' OD1' ' A' ' 76' ' ' ASN . 32.6 t -92.86 -33.22 5.27 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.5 0 O-C-N 120.29 -1.506 . . . . 0.0 110.038 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -65.72 99.12 0.43 Allowed 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 178.311 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.407 HG23 ' H ' ' A' ' 79' ' ' THR . 0.1 OUTLIER -82.68 -56.86 3.6 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.077 -1.014 . . . . 0.0 112.324 -177.099 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.541 ' O ' ' N ' ' A' ' 82' ' ' ASP . 18.3 m-20 -98.28 23.83 7.91 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.063 -1.023 . . . . 0.0 109.591 -178.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.469 ' C ' ' H ' ' A' ' 83' ' ' ARG . 20.3 mm-40 35.65 25.83 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.58 0 CA-C-N 116.31 -0.404 . . . . 0.0 112.015 178.662 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.541 ' N ' ' O ' ' A' ' 80' ' ' ASN . 81.6 m-20 -81.54 11.07 4.93 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 106.696 -1.594 . . . . 0.0 106.696 178.11 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.469 ' H ' ' C ' ' A' ' 81' ' ' GLN . 70.0 mtt180 65.72 -5.74 0.48 Allowed 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 115.131 -0.941 . . . . 0.0 108.737 -178.737 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.518 ' H ' ' C ' ' A' ' 82' ' ' ASP . 10.9 mt -114.35 134.04 55.25 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 107.481 -1.303 . . . . 0.0 107.481 178.717 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 70.4 t -112.15 129.8 66.98 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.875 0 O-C-N 121.51 -0.744 . . . . 0.0 109.391 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 17.5 p -106.17 173.88 6.12 Favored 'General case' 0 N--CA 1.5 2.07 0 N-CA-C 108.166 -1.049 . . . . 0.0 108.166 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.6 tp -69.94 -35.22 74.36 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.213 -0.929 . . . . 0.0 109.422 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -61.04 -67.9 0.36 Allowed 'General case' 0 C--N 1.291 -1.952 0 O-C-N 120.897 -1.127 . . . . 0.0 111.578 -177.592 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -63.12 -30.88 71.94 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.183 -0.948 . . . . 0.0 110.713 -178.057 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -59.72 -52.36 65.82 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.887 -1.133 . . . . 0.0 109.551 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 87.2 mt -50.79 -48.0 59.64 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.234 -0.916 . . . . 0.0 108.963 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.89 -55.12 10.6 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.39 -0.819 . . . . 0.0 110.173 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 51.1 m -57.32 -28.53 63.16 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.978 -1.076 . . . . 0.0 110.633 -178.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.503 ' O ' ' N ' ' A' ' 96' ' ' ARG . 29.4 p -98.81 13.67 31.56 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 120.993 -1.067 . . . . 0.0 109.881 -179.723 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -68.34 53.38 0.08 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.113 -0.992 . . . . 0.0 108.944 179.069 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.503 ' N ' ' O ' ' A' ' 94' ' ' THR . 5.9 tpp180 -177.82 -32.21 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 179.579 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.423 ' O ' ' N ' ' A' ' 99' ' ' PHE . 40.9 mttp -50.34 -19.22 0.77 Allowed 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.281 -0.887 . . . . 0.0 109.141 -179.582 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 46.4 tt0 -62.29 85.37 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.151 -0.968 . . . . 0.0 109.213 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.423 ' N ' ' O ' ' A' ' 97' ' ' LYS . 74.7 m-85 . . . . . 0 N--CA 1.49 1.549 0 CA-C-O 118.014 -0.993 . . . . 0.0 109.233 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.476 ' C ' HD12 ' A' ' 1' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 60.7 mttp -143.83 171.91 13.57 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.182 -0.948 . . . . 0.0 109.31 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 43.4 tp10 -169.18 106.24 0.4 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.189 -0.945 . . . . 0.0 109.497 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 56.7 t -67.94 -82.01 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.218 -0.926 . . . . 0.0 109.463 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 17.7 t90 -172.29 -79.98 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.162 -0.961 . . . . 0.0 109.363 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.459 ' OE2' ' NH1' ' A' ' 15' ' ' ARG . 56.8 mm-40 -69.18 -49.95 52.02 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.224 -0.922 . . . . 0.0 109.274 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 53.74 63.69 2.11 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.455 -0.778 . . . . 0.0 109.615 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 18.0 mt -45.21 134.71 6.19 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.464 -0.772 . . . . 0.0 109.244 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.464 ' N ' ' OD1' ' A' ' 9' ' ' ASP . 25.7 p-10 -127.73 54.61 1.68 Allowed 'General case' 0 N--CA 1.498 1.966 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -179.693 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.532 ' O ' ' O ' ' A' ' 11' ' ' LEU . . . 81.74 68.79 1.43 Allowed Glycine 0 N--CA 1.489 2.21 0 N-CA-C 108.264 -1.935 . . . . 0.0 108.264 -178.507 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.549 HD12 ' N ' ' A' ' 11' ' ' LEU . 6.1 mp 50.25 121.72 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.01 0 CA-C-O 121.991 0.901 . . . . 0.0 111.022 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -135.85 70.06 64.72 Favored Pre-proline 0 N--CA 1.498 1.972 0 O-C-N 121.095 -1.003 . . . . 0.0 109.703 179.585 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -62.04 -37.27 65.7 Favored 'Trans proline' 0 C--N 1.32 -0.932 0 C-N-CA 121.605 1.537 . . . . 0.0 110.041 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 61.7 m-20 -112.51 92.73 4.13 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.459 ' NH1' ' OE2' ' A' ' 6' ' ' GLU . 46.4 mtp180 -61.01 -30.87 70.55 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.314 -0.866 . . . . 0.0 109.394 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -166.69 -70.29 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.208 -0.932 . . . . 0.0 109.953 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 45.1 t-20 -165.76 77.51 1.24 Allowed Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.184 -0.948 . . . . 0.0 109.807 -179.501 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -60.03 -15.04 31.17 Favored 'Trans proline' 0 C--N 1.318 -1.055 0 C-N-CA 121.352 1.368 . . . . 0.0 110.115 -179.649 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 58.5 tttp -55.7 -42.2 74.9 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.496 -0.752 . . . . 0.0 111.171 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 58.5 m -69.19 -40.65 77.95 Favored 'General case' 0 N--CA 1.484 1.27 0 O-C-N 120.619 -1.301 . . . . 0.0 110.619 -178.304 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.615 ' CE2' ' NE2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -54.68 -33.86 61.46 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 179.883 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -69.68 -34.89 74.58 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.493 -0.755 . . . . 0.0 109.977 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.458 ' O ' ' N ' ' A' ' 26' ' ' ASP . 97.8 mt -69.36 -59.92 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 O-C-N 120.866 -1.146 . . . . 0.0 109.1 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.7 tp -44.75 -36.47 3.2 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.468 -0.77 . . . . 0.0 110.577 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.615 ' NE2' ' CE2' ' A' ' 21' ' ' PHE . 56.1 m-70 -81.25 -11.88 59.26 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.273 -1.517 . . . . 0.0 109.609 179.631 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.458 ' N ' ' O ' ' A' ' 23' ' ' ILE . 73.3 m-20 -79.91 90.68 5.34 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.02 -1.05 . . . . 0.0 108.812 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.417 HD13 HG21 ' A' ' 27' ' ' ILE . 22.2 mt -75.75 -52.61 17.68 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.354 0 O-C-N 121.283 -0.885 . . . . 0.0 110.878 -178.793 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 15.2 m-20 -86.69 11.22 13.49 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.844 -1.16 . . . . 0.0 109.896 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 25.0 p 43.6 52.65 6.11 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.333 -0.855 . . . . 0.0 110.554 179.048 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -95.0 -2.31 50.62 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.08 -1.012 . . . . 0.0 108.332 179.174 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 76.79 -1.87 61.23 Favored Glycine 0 N--CA 1.488 2.166 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.442 ' O ' HD12 ' A' ' 33' ' ' LEU . 0.9 OUTLIER -143.67 164.9 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.106 0 O-C-N 121.274 -1.133 . . . . 0.0 108.605 178.541 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.442 HD12 ' O ' ' A' ' 32' ' ' VAL . 2.6 mp -121.36 125.6 47.38 Favored 'General case' 0 N--CA 1.519 3.006 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 178.04 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -108.03 -176.82 3.16 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.06 -1.025 . . . . 0.0 110.26 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -59.5 -13.21 8.1 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.676 -0.64 . . . . 0.0 111.042 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -81.17 -27.68 35.31 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.53 -1.356 . . . . 0.0 109.25 179.724 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -83.9 -37.46 22.35 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.961 -1.087 . . . . 0.0 109.652 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.537 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 1.5 mt -75.59 -30.7 59.7 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.712 -1.243 . . . . 0.0 108.476 178.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -61.73 -45.64 93.05 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 178.697 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.93 -28.42 61.51 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.395 -0.816 . . . . 0.0 110.733 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.405 HD23 ' O ' ' A' ' 41' ' ' LEU . 0.6 OUTLIER -73.96 -27.11 60.83 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 120.874 -1.141 . . . . 0.0 110.313 -178.983 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.537 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 37.9 m-85 -80.98 -49.91 10.35 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.677 -1.265 . . . . 0.0 108.989 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 49.0 m -59.18 -54.45 46.84 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.16 -0.963 . . . . 0.0 111.169 -179.302 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.476 ' CG ' ' N ' ' A' ' 45' ' ' GLU . 15.8 ptmt -61.33 -48.0 83.33 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.142 -0.974 . . . . 0.0 111.864 -177.618 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.476 ' N ' ' CG ' ' A' ' 44' ' ' LYS . 22.5 mm-40 -55.19 -26.27 38.13 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.416 -1.428 . . . . 0.0 109.139 -179.337 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 41.5 mt -82.84 -37.63 24.13 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.122 -0.986 . . . . 0.0 110.762 -179.312 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.75 0.02 16.67 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.514 -1.366 . . . . 0.0 109.457 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.4 ttmm -92.44 -27.74 17.28 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.252 -0.905 . . . . 0.0 109.361 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 84.8 t -102.43 -53.92 7.07 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 121.298 -0.876 . . . . 0.0 109.809 -179.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -72.3 -131.05 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.115 -0.99 . . . . 0.0 109.456 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -179.58 69.99 0.17 Allowed Pre-proline 0 N--CA 1.503 2.208 0 O-C-N 121.406 -0.809 . . . . 0.0 109.041 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -59.59 177.15 0.48 Allowed 'Trans proline' 0 C--N 1.316 -1.162 0 C-N-CA 121.47 1.447 . . . . 0.0 109.995 -179.577 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 60.1 mttp 53.16 42.37 32.15 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.479 -0.763 . . . . 0.0 109.386 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 25.2 t30 -173.7 -32.26 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.509 -0.744 . . . . 0.0 110.416 179.628 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.42 ' O ' ' O ' ' A' ' 56' ' ' GLU . 55.1 mt-10 -112.09 163.89 13.78 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.433 -0.792 . . . . 0.0 109.529 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.42 ' O ' ' O ' ' A' ' 55' ' ' GLU . 40.7 mt-10 -55.84 -168.02 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.262 -0.899 . . . . 0.0 109.594 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.511 ' C ' ' H ' ' A' ' 59' ' ' MET . 63.5 m-20 -75.86 35.47 0.13 Allowed 'General case' 0 N--CA 1.486 1.358 0 O-C-N 121.161 -0.962 . . . . 0.0 109.865 -179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.413 ' H ' ' C ' ' A' ' 56' ' ' GLU . 19.8 m-20 -50.36 -8.62 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.187 -0.945 . . . . 0.0 109.79 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.511 ' H ' ' C ' ' A' ' 57' ' ' ASP . 33.3 mtp -70.14 -5.74 29.29 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.239 -0.913 . . . . 0.0 109.035 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.403 ' O ' ' CG ' ' A' ' 63' ' ' GLU . 26.1 ttm180 -89.16 -49.5 6.71 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.376 -0.827 . . . . 0.0 109.238 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -56.57 -57.37 12.65 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.592 -1.318 . . . . 0.0 109.489 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.569 ' O ' ' N ' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -59.88 -7.12 1.52 Allowed 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.345 -0.847 . . . . 0.0 110.938 -179.239 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.416 ' C ' ' O ' ' A' ' 62' ' ' MET . 12.1 pt-20 -40.3 -21.73 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.406 -0.809 . . . . 0.0 109.99 -179.42 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.569 ' N ' ' O ' ' A' ' 62' ' ' MET . 52.3 mt-10 -54.56 -39.83 68.14 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.318 -0.864 . . . . 0.0 109.196 179.182 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 59.6 mm-40 -71.85 -41.62 67.89 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.216 -0.928 . . . . 0.0 108.871 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.548 ' CG ' HH11 ' A' ' 66' ' ' ARG . 0.0 OUTLIER -51.51 -43.44 62.27 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.452 -0.78 . . . . 0.0 109.12 179.672 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 22.8 mt -76.92 -27.4 54.88 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.385 -0.822 . . . . 0.0 109.87 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.524 ' CG ' HH11 ' A' ' 68' ' ' ARG . 0.0 OUTLIER -73.81 -38.1 64.69 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.023 -1.048 . . . . 0.0 109.88 -179.556 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 23.7 mtt -86.47 -41.59 14.27 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 120.673 -1.267 . . . . 0.0 109.182 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -68.3 -39.74 81.96 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.14 -0.975 . . . . 0.0 110.479 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -84.51 -51.52 6.84 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.987 -1.071 . . . . 0.0 111.419 -178.507 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 56.9 t60 -53.76 -40.75 66.47 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.875 -1.141 . . . . 0.0 110.292 -178.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 69.2 t -73.94 -47.23 43.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 120.716 -1.24 . . . . 0.0 109.616 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.502 ' SD ' ' OD2' ' A' ' 78' ' ' ASP . 3.4 mmt -69.5 -17.16 63.57 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.126 -0.984 . . . . 0.0 110.275 -179.648 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.495 ' HB3' ' HZ3' ' A' ' 75' ' ' LYS . 6.4 ttpm? -90.64 -34.64 15.36 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.362 -1.461 . . . . 0.0 111.159 -178.733 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ASN . . . . . 0.471 ' OD1' ' N ' ' A' ' 77' ' ' VAL . 33.8 p-10 -106.37 -26.49 11.46 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 120.95 -1.094 . . . . 0.0 113.079 -177.67 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.471 ' N ' ' OD1' ' A' ' 76' ' ' ASN . 40.9 t -94.44 -31.03 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.551 0 O-C-N 120.286 -1.509 . . . . 0.0 110.503 -179.018 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.502 ' OD2' ' SD ' ' A' ' 74' ' ' MET . 1.6 m-20 -69.06 103.53 1.89 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 120.447 -1.408 . . . . 0.0 107.652 178.538 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.429 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -83.23 -53.19 5.95 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.217 -0.927 . . . . 0.0 111.45 -177.829 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.462 ' O ' ' N ' ' A' ' 82' ' ' ASP . 8.7 t-20 -101.16 23.92 10.18 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 121.201 -0.937 . . . . 0.0 109.578 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.411 ' C ' ' O ' ' A' ' 80' ' ' ASN . 33.2 mm-40 31.63 35.97 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 178.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.552 ' C ' ' H ' ' A' ' 84' ' ' LEU . 26.2 t0 -85.27 11.9 9.15 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 178.399 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 36.0 mtm180 65.34 -4.77 0.51 Allowed 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 -178.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.552 ' H ' ' C ' ' A' ' 82' ' ' ASP . 4.4 mp -121.08 134.61 55.27 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 179.117 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 76.1 t -113.85 130.17 68.45 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 O-C-N 121.514 -0.741 . . . . 0.0 110.321 -178.383 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 47.4 p -100.04 173.76 6.49 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 178.257 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.1 tp -73.6 -36.91 65.56 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.206 -0.934 . . . . 0.0 109.229 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 -63.6 -60.27 3.55 Favored 'General case' 0 C--N 1.29 -2.013 0 O-C-N 120.823 -1.173 . . . . 0.0 111.678 -177.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.429 ' CB ' HG21 ' A' ' 79' ' ' THR . 13.4 mm-40 -63.66 -32.54 74.06 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.644 -1.285 . . . . 0.0 110.139 -178.253 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -66.01 -52.43 49.41 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.677 -1.265 . . . . 0.0 109.35 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.4 mp -46.85 -45.6 20.35 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.241 -0.912 . . . . 0.0 108.877 179.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -52.42 -57.6 9.35 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.199 -0.938 . . . . 0.0 110.214 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 40.6 m -45.09 -27.83 0.64 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.242 -0.911 . . . . 0.0 109.977 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 29.3 p -97.99 -54.07 3.2 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.35 -0.844 . . . . 0.0 108.723 178.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -52.31 177.87 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.202 -0.936 . . . . 0.0 109.335 179.686 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.524 ' CG ' HH11 ' A' ' 96' ' ' ARG . 0.0 OUTLIER -162.37 42.0 0.13 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.256 -0.902 . . . . 0.0 109.215 -179.972 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 30.8 ttpt -50.8 -19.59 1.02 Allowed 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.304 -0.872 . . . . 0.0 109.683 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 44.7 mm-40 -66.35 92.62 0.2 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.276 -0.89 . . . . 0.0 109.635 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 58.9 t80 . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 117.932 -1.032 . . . . 0.0 109.51 179.805 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 18.9 mt . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 67.8 mttm 51.5 -102.51 0.12 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.26 -0.9 . . . . 0.0 109.401 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.528 ' O ' ' N ' ' A' ' 5' ' ' TRP . 0.0 OUTLIER -162.41 -22.76 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.156 -0.965 . . . . 0.0 109.658 -179.95 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.421 ' O ' ' O ' ' A' ' 5' ' ' TRP . 27.5 t 55.06 -84.21 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.373 -0.829 . . . . 0.0 109.729 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.528 ' N ' ' O ' ' A' ' 3' ' ' GLU . 61.0 m95 -62.64 -135.84 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.003 -1.061 . . . . 0.0 109.582 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -160.95 148.13 15.36 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.171 -0.956 . . . . 0.0 109.631 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.482 ' N ' ' OE2' ' A' ' 7' ' ' GLU . 1.1 pm0 -167.47 41.47 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.675 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.3 tp -174.89 140.6 0.56 Allowed 'General case' 0 N--CA 1.491 1.617 0 N-CA-C 107.883 -1.155 . . . . 0.0 107.883 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.505 ' OD1' ' N ' ' A' ' 12' ' ' ASP . 0.6 OUTLIER -91.37 -21.33 21.05 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.867 -1.146 . . . . 0.0 109.042 179.758 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.99 -0.99 89.3 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 108.815 -1.714 . . . . 0.0 108.815 -179.327 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -169.62 69.71 0.06 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.484 -1.009 . . . . 0.0 109.374 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.505 ' N ' ' OD1' ' A' ' 9' ' ' ASP . 2.5 p30 -82.78 149.52 60.23 Favored Pre-proline 0 N--CA 1.494 1.738 0 O-C-N 121.139 -0.975 . . . . 0.0 109.104 -179.666 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.495 ' O ' ' N ' ' A' ' 15' ' ' ARG . 3.4 Cg_endo -61.46 -11.05 18.09 Favored 'Trans proline' 0 C--N 1.324 -0.759 0 C-N-CA 121.003 1.135 . . . . 0.0 109.641 179.322 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 33.0 m120 -65.57 67.74 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.268 -0.895 . . . . 0.0 109.642 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.495 ' N ' ' O ' ' A' ' 13' ' ' PRO . 99.2 mtt180 -60.67 173.21 0.76 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.317 -0.864 . . . . 0.0 109.343 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 24.5 p90 -77.25 25.59 0.17 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.205 -0.934 . . . . 0.0 109.538 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.432 ' H ' ' C ' ' A' ' 15' ' ' ARG . 72.3 m-20 51.53 69.34 2.57 Favored Pre-proline 0 N--CA 1.491 1.582 0 O-C-N 121.282 -0.887 . . . . 0.0 109.805 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -62.84 -18.76 66.28 Favored 'Trans proline' 0 C--N 1.318 -1.071 0 C-N-CA 121.573 1.515 . . . . 0.0 110.013 -179.692 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -55.17 -36.84 66.29 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.404 -0.81 . . . . 0.0 110.924 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.5 m -72.21 -40.91 67.47 Favored 'General case' 0 N--CA 1.484 1.266 0 O-C-N 120.802 -1.186 . . . . 0.0 110.523 -178.421 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -56.24 -34.85 66.74 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.9 -1.125 . . . . 0.0 108.038 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -69.68 -33.6 72.79 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.453 -0.779 . . . . 0.0 109.884 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 98.2 mt -72.85 -60.54 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 O-C-N 120.838 -1.164 . . . . 0.0 109.278 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.51 ' O ' HD13 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -45.92 -39.26 8.52 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.297 -0.877 . . . . 0.0 110.798 -179.415 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -78.78 -15.86 57.88 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.332 -1.48 . . . . 0.0 110.155 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -78.38 96.42 5.33 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.984 -1.073 . . . . 0.0 108.64 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.402 HD13 HG21 ' A' ' 27' ' ' ILE . 14.9 mt -75.9 -48.36 29.42 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.363 0 O-C-N 121.501 -0.749 . . . . 0.0 111.032 -178.547 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -89.31 8.04 32.53 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.853 -1.154 . . . . 0.0 110.003 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 46.4 p 44.59 54.75 6.28 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.112 -0.993 . . . . 0.0 110.59 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.462 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 21.0 p-10 -94.77 -3.18 49.59 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.054 -1.029 . . . . 0.0 108.71 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 79.41 -5.69 59.58 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -132.43 165.57 31.76 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 178.507 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.1 tp -116.66 123.5 47.42 Favored 'General case' 0 N--CA 1.515 2.82 0 N-CA-C 107.68 -1.229 . . . . 0.0 107.68 178.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 35.4 p-10 -103.94 179.59 4.23 Favored 'General case' 0 N--CA 1.507 2.379 0 CA-C-O 122.06 0.933 . . . . 0.0 111.038 -178.514 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -68.19 -8.2 36.72 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.389 -179.468 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 43.6 mm-40 -85.66 -47.11 10.12 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 120.812 -1.18 . . . . 0.0 109.292 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -73.91 -29.4 62.03 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.333 -0.854 . . . . 0.0 108.814 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.0 tp -79.23 -40.56 30.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.45 -0.781 . . . . 0.0 109.792 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 47.5 mm-40 -74.65 -44.15 51.8 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.598 -1.314 . . . . 0.0 109.59 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.83 -32.57 71.05 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 120.971 -1.081 . . . . 0.0 110.632 -179.241 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 55.6 tp -76.59 -27.67 55.9 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.906 -1.121 . . . . 0.0 110.481 -178.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -81.73 -50.25 9.49 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 120.686 -1.259 . . . . 0.0 109.27 -179.594 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 20.7 m -62.24 -44.46 96.5 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.34 -0.85 . . . . 0.0 110.758 -178.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.1 ptmt -67.75 -43.15 80.56 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.799 -1.188 . . . . 0.0 111.17 -177.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -52.89 -36.82 59.8 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.286 -1.508 . . . . 0.0 108.789 -179.371 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.452 ' C ' ' H ' ' A' ' 48' ' ' LYS . 4.8 tp -67.85 -25.66 65.65 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 179.371 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -60.23 -3.69 0.67 Allowed 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.452 ' H ' ' C ' ' A' ' 46' ' ' LEU . 61.1 mttm -119.92 46.55 1.92 Allowed 'General case' 0 N--CA 1.498 1.969 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 179.405 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 60.3 t -149.91 -53.87 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.221 -0.925 . . . . 0.0 109.57 -179.752 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -81.91 12.55 3.97 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.245 -0.909 . . . . 0.0 109.943 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.8 t70 60.73 103.87 0.03 OUTLIER Pre-proline 0 N--CA 1.501 2.112 0 O-C-N 121.25 -0.906 . . . . 0.0 109.176 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -70.9 170.7 17.31 Favored 'Trans proline' 0 C--N 1.324 -0.747 0 N-CA-C 109.458 -1.016 . . . . 0.0 109.458 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.409 ' NZ ' ' CB ' ' A' ' 53' ' ' LYS . 8.8 mtmp? 59.8 5.91 0.8 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.663 -0.648 . . . . 0.0 109.702 -179.418 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 57.9 t-20 -86.01 -2.83 58.68 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.565 ' O ' ' N ' ' A' ' 57' ' ' ASP . 19.6 mm-40 50.45 -145.09 0.49 Allowed 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.553 -0.717 . . . . 0.0 109.387 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.526 ' O ' ' N ' ' A' ' 58' ' ' ASP . 44.1 mt-10 48.31 -87.46 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.595 -0.69 . . . . 0.0 109.722 179.818 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.613 ' C ' ' H ' ' A' ' 59' ' ' MET . 0.7 OUTLIER -60.86 77.5 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.271 -0.893 . . . . 0.0 109.685 179.962 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.526 ' N ' ' O ' ' A' ' 56' ' ' GLU . 8.2 m-20 -59.05 21.56 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.586 -0.696 . . . . 0.0 111.212 -179.428 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.613 ' H ' ' C ' ' A' ' 57' ' ' ASP . 75.0 mmm 52.41 42.69 31.23 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 120.885 -1.134 . . . . 0.0 108.975 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.421 ' O ' ' OE2' ' A' ' 63' ' ' GLU . 37.1 ttp180 -132.86 -67.15 0.65 Allowed 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -179.787 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.406 ' C ' ' O ' ' A' ' 60' ' ' ARG . 49.6 mm-40 -45.11 -30.36 1.1 Allowed 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.004 -1.06 . . . . 0.0 109.709 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.535 ' C ' ' H ' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -85.09 3.67 37.75 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.274 -0.891 . . . . 0.0 110.396 -179.821 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.549 ' OE1' ' N ' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -53.97 -1.61 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.135 -0.978 . . . . 0.0 110.019 179.844 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.549 ' N ' ' OE1' ' A' ' 63' ' ' GLU . 15.0 mm-40 -72.97 -48.86 32.96 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.046 -1.034 . . . . 0.0 109.662 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -67.97 -39.46 83.32 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.221 -0.924 . . . . 0.0 109.442 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 38.7 ttt180 -55.46 -36.78 66.94 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.362 -0.836 . . . . 0.0 109.447 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.414 ' O ' ' OE1' ' A' ' 71' ' ' GLU . 24.6 mt -81.88 -28.3 33.0 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.038 -1.039 . . . . 0.0 110.043 -179.59 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.9 -40.41 87.73 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.036 -1.04 . . . . 0.0 109.788 -179.309 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.4 mtm -84.75 -50.23 7.77 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.058 -1.026 . . . . 0.0 109.895 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.4 ttp180 -54.04 -27.69 33.79 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.795 -1.191 . . . . 0.0 109.982 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.414 ' OE1' ' O ' ' A' ' 67' ' ' LEU . 37.5 mt-10 -80.23 -51.22 9.2 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.853 -1.154 . . . . 0.0 110.103 -179.763 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -54.59 -34.48 62.03 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.092 -1.005 . . . . 0.0 110.547 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 72.6 t -73.2 -54.02 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 120.665 -1.272 . . . . 0.0 109.938 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.422 ' O ' ' CG ' ' A' ' 78' ' ' ASP . 2.0 mmt -62.41 -17.77 60.01 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.16 -0.962 . . . . 0.0 109.786 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.47 ' HZ3' ' HB2' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -94.29 -38.57 10.94 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.633 -1.292 . . . . 0.0 111.014 -178.926 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 8.9 m-20 -98.06 -9.16 26.42 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.101 -1.0 . . . . 0.0 112.254 -177.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 84.6 t -116.1 -34.1 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.579 0 O-C-N 120.614 -1.304 . . . . 0.0 110.42 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.573 ' OD2' ' NE2' ' A' ' 81' ' ' GLN . 14.5 p-10 -48.93 108.0 0.16 Allowed 'General case' 0 N--CA 1.497 1.925 0 O-C-N 120.684 -1.26 . . . . 0.0 109.099 178.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -83.15 -66.62 0.87 Allowed 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.015 -1.053 . . . . 0.0 110.791 -178.024 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.53 ' O ' ' N ' ' A' ' 82' ' ' ASP . 53.1 m-20 -104.62 25.2 10.59 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.109 -0.994 . . . . 0.0 109.351 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.573 ' NE2' ' OD2' ' A' ' 78' ' ' ASP . 21.2 mm-40 37.23 26.28 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.176 0.512 . . . . 0.0 111.135 178.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.531 ' C ' ' H ' ' A' ' 84' ' ' LEU . 56.4 t0 -81.32 12.84 3.27 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 178.405 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.468 ' H ' ' C ' ' A' ' 81' ' ' GLN . 72.6 mtt180 65.67 -5.29 0.51 Allowed 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 -178.784 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.531 ' H ' ' C ' ' A' ' 82' ' ' ASP . 9.9 mt -116.08 133.71 55.73 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 178.68 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 69.8 t -111.05 130.95 63.57 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.031 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 51.5 p -104.86 159.37 15.85 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.26 -0.9 . . . . 0.0 109.378 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.0 tp -61.3 -36.61 80.57 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -57.02 -68.55 0.21 Allowed 'General case' 0 C--N 1.294 -1.839 0 O-C-N 121.534 -0.728 . . . . 0.0 110.866 -178.23 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.422 ' O ' ' HB3' ' A' ' 92' ' ' ALA . 56.8 mm-40 -63.94 -34.91 79.04 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.193 -0.942 . . . . 0.0 110.938 -178.556 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -58.3 -49.84 75.74 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.589 -1.319 . . . . 0.0 109.102 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 71.1 mt -51.71 -46.13 63.82 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.098 -1.001 . . . . 0.0 108.844 178.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.422 ' HB3' ' O ' ' A' ' 89' ' ' GLU . . . -43.94 -51.36 7.71 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.458 -0.776 . . . . 0.0 110.094 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 93.7 p -58.0 -32.19 67.68 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.313 -0.867 . . . . 0.0 110.734 -179.365 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.452 ' OG1' ' N ' ' A' ' 95' ' ' GLN . 22.2 p -93.83 -69.67 0.74 Allowed 'General case' 0 N--CA 1.502 2.172 0 O-C-N 120.999 -1.063 . . . . 0.0 110.271 -179.333 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.452 ' N ' ' OG1' ' A' ' 94' ' ' THR . 2.1 pt20 -46.21 170.29 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.008 -1.057 . . . . 0.0 109.755 -179.632 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.511 ' NE ' ' O ' ' A' ' 96' ' ' ARG . 0.4 OUTLIER -164.36 93.44 0.68 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.059 -1.026 . . . . 0.0 109.47 179.897 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.535 ' O ' ' N ' ' A' ' 99' ' ' PHE . 39.6 tptt -167.99 77.43 0.15 Allowed 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.232 -0.917 . . . . 0.0 109.536 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.403 ' O ' ' OE1' ' A' ' 98' ' ' GLU . 0.0 OUTLIER -64.33 66.76 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.38 -0.825 . . . . 0.0 109.882 -179.87 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.535 ' N ' ' O ' ' A' ' 97' ' ' LYS . 77.9 t80 . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 118.024 -0.989 . . . . 0.0 109.379 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 61.8 tp . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -72.24 179.5 3.34 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.31 -0.869 . . . . 0.0 109.433 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.465 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 3.3 mp0 -65.46 140.39 58.6 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.137 -0.977 . . . . 0.0 109.383 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 34.1 t -64.51 127.52 25.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.292 -0.88 . . . . 0.0 109.507 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 84.3 m95 -64.75 109.17 1.95 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.268 -0.895 . . . . 0.0 109.554 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -163.88 65.76 0.16 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.236 -0.915 . . . . 0.0 109.366 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 64.1 tt0 -168.02 156.46 8.99 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.084 -1.01 . . . . 0.0 109.568 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.2 tp -148.85 125.61 11.16 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.293 -0.879 . . . . 0.0 109.023 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -97.85 70.33 2.15 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.146 -0.971 . . . . 0.0 109.166 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -162.06 -74.09 0.02 OUTLIER Glycine 0 N--CA 1.489 2.201 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 41.7 mt -130.72 -83.86 0.53 Allowed 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.587 -0.949 . . . . 0.0 109.364 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -154.77 161.72 28.74 Favored Pre-proline 0 N--CA 1.497 1.908 0 O-C-N 121.007 -1.058 . . . . 0.0 108.629 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -58.79 -45.33 29.74 Favored 'Trans proline' 0 C--N 1.32 -0.943 0 C-N-CA 121.354 1.37 . . . . 0.0 109.867 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.615 HD22 ' H ' ' A' ' 14' ' ' ASN . 1.5 p30 -81.84 -118.4 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.109 -0.995 . . . . 0.0 109.473 -179.715 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.576 HH11 ' CG ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -175.62 174.23 2.28 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.748 -1.22 . . . . 0.0 109.137 -179.955 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -58.56 98.93 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.17 -0.956 . . . . 0.0 108.859 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -136.84 79.92 38.06 Favored Pre-proline 0 N--CA 1.498 1.927 0 O-C-N 121.401 -0.812 . . . . 0.0 109.671 -179.387 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -58.98 -8.74 6.54 Favored 'Trans proline' 0 C--N 1.318 -1.07 0 C-N-CA 121.192 1.262 . . . . 0.0 109.877 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.0 tttp -60.87 -37.18 81.25 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.455 -0.778 . . . . 0.0 110.533 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 48.3 m -70.53 -39.14 74.22 Favored 'General case' 0 C--N 1.308 -1.228 0 O-C-N 120.854 -1.154 . . . . 0.0 110.261 -178.678 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.447 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.11 -39.95 72.98 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.972 -1.08 . . . . 0.0 108.264 179.692 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.447 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 35.9 t80 -64.97 -36.76 85.44 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.319 -0.863 . . . . 0.0 110.543 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.442 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.9 mt -71.5 -61.32 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 O-C-N 120.735 -1.228 . . . . 0.0 109.491 -179.226 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.474 ' O ' HD13 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -46.72 -37.42 8.42 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.098 -1.001 . . . . 0.0 110.178 -179.93 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 4.6 m80 -74.69 -14.74 60.78 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.552 -1.342 . . . . 0.0 109.56 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.442 ' N ' ' O ' ' A' ' 23' ' ' ILE . 65.9 m-20 -76.26 93.22 3.38 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.948 -1.095 . . . . 0.0 108.859 179.052 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 33.0 mt -75.1 -53.18 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 O-C-N 121.135 -0.978 . . . . 0.0 110.731 -178.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 8.3 m-20 -86.42 13.86 7.61 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 120.844 -1.16 . . . . 0.0 109.955 -179.681 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.402 ' O ' ' OG ' ' A' ' 29' ' ' SER . 6.7 t 42.54 51.43 4.86 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.416 -0.803 . . . . 0.0 110.516 178.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -94.44 -4.07 48.94 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.11 -0.994 . . . . 0.0 108.33 179.257 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 77.25 -2.11 62.64 Favored Glycine 0 N--CA 1.489 2.167 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.423 ' O ' HD12 ' A' ' 33' ' ' LEU . 0.9 OUTLIER -140.5 164.82 21.39 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.04 0 O-C-N 121.41 -1.053 . . . . 0.0 108.601 178.929 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.423 HD12 ' O ' ' A' ' 32' ' ' VAL . 3.4 mp -118.43 129.77 55.58 Favored 'General case' 0 N--CA 1.52 3.035 0 N-CA-C 107.872 -1.159 . . . . 0.0 107.872 177.758 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.452 ' O ' ' N ' ' A' ' 36' ' ' GLN . 26.2 p-10 -108.01 168.62 9.16 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.3 -0.875 . . . . 0.0 110.325 -179.076 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -50.8 -8.79 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.552 -0.717 . . . . 0.0 110.458 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.452 ' N ' ' O ' ' A' ' 34' ' ' ASP . 45.7 mm-40 -84.09 -38.28 20.98 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 120.973 -1.079 . . . . 0.0 109.026 178.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -77.99 -29.61 49.74 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.211 -0.931 . . . . 0.0 109.012 179.518 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.543 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 10.4 mp -78.02 -40.53 38.65 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.107 -0.996 . . . . 0.0 108.368 179.369 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -69.03 -44.64 72.31 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.967 -1.083 . . . . 0.0 109.474 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.88 -27.9 65.19 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.323 -0.86 . . . . 0.0 110.59 -179.406 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.424 ' O ' ' OE1' ' A' ' 45' ' ' GLU . 22.4 tp -75.32 -25.77 58.11 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.501 -1.374 . . . . 0.0 110.706 -178.546 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.543 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 11.4 m-85 -82.88 -39.9 20.94 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 120.296 -1.502 . . . . 0.0 110.287 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 84.8 m -72.42 -41.69 65.94 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.717 -1.239 . . . . 0.0 111.406 -178.442 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.465 ' CE ' ' N ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -73.98 -50.94 17.63 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 120.652 -1.28 . . . . 0.0 109.421 -178.331 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.424 ' OE1' ' O ' ' A' ' 41' ' ' LEU . 15.4 pt-20 -51.14 -28.63 11.36 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 120.987 -1.07 . . . . 0.0 108.971 -179.871 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.3 tp -84.77 -35.31 22.49 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.261 -0.899 . . . . 0.0 109.292 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -52.51 -33.73 46.42 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.295 -0.878 . . . . 0.0 110.257 179.342 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.9 pttt -81.7 17.38 1.48 Allowed 'General case' 0 N--CA 1.496 1.857 0 O-C-N 120.686 -1.259 . . . . 0.0 109.734 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 59.7 t -120.31 -59.39 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.386 -0.821 . . . . 0.0 110.196 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -85.46 -129.94 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.983 -1.073 . . . . 0.0 109.933 -179.353 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.525 ' C ' ' H ' ' A' ' 53' ' ' LYS . 50.7 p-10 -172.93 78.65 0.42 Allowed Pre-proline 0 N--CA 1.49 1.548 0 O-C-N 121.141 -0.974 . . . . 0.0 109.006 -179.443 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -65.85 17.65 0.09 OUTLIER 'Trans proline' 0 C--N 1.319 -0.986 0 C-N-CA 121.639 1.56 . . . . 0.0 110.889 -179.045 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.525 ' H ' ' C ' ' A' ' 51' ' ' ASP . 0.1 OUTLIER -136.26 6.96 3.09 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.304 -0.873 . . . . 0.0 109.553 179.795 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 68.8 m-20 -141.55 14.07 2.15 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.196 -0.94 . . . . 0.0 109.858 179.799 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.414 ' C ' ' H ' ' A' ' 57' ' ' ASP . 21.8 tp10 -152.48 140.89 20.63 Favored 'General case' 0 C--N 1.308 -1.219 0 O-C-N 120.964 -1.085 . . . . 0.0 108.852 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.546 ' CD ' ' H ' ' A' ' 56' ' ' GLU . 2.3 mp0 -79.12 30.84 0.21 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.235 -0.915 . . . . 0.0 109.341 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' A' ' 59' ' ' MET . 13.6 p-10 -72.52 -11.91 60.86 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.298 -0.876 . . . . 0.0 109.838 -179.527 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 46.04 15.6 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.253 -0.904 . . . . 0.0 109.859 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.518 ' N ' ' O ' ' A' ' 57' ' ' ASP . 37.8 mmm 51.41 49.22 21.43 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.288 -0.883 . . . . 0.0 108.767 -179.395 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.497 ' O ' ' N ' ' A' ' 62' ' ' MET . 41.8 ttp180 -129.05 -57.31 1.16 Allowed 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -179.361 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -45.35 -17.54 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.08 -1.013 . . . . 0.0 110.065 -179.356 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.6 ' SD ' ' N ' ' A' ' 63' ' ' GLU . 0.0 OUTLIER -101.14 -0.38 36.23 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.167 -0.958 . . . . 0.0 109.724 -179.9 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.6 ' N ' ' SD ' ' A' ' 62' ' ' MET . 16.2 pt-20 -43.86 -16.2 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.914 0 CA-C-O 121.564 0.697 . . . . 0.0 109.536 -179.152 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.562 ' N ' ' O ' ' A' ' 62' ' ' MET . 35.6 mt-10 -62.38 -58.66 6.84 Favored 'General case' 0 C--N 1.3 -1.545 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.771 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 -62.93 -35.6 80.65 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.286 -0.884 . . . . 0.0 109.431 179.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 33.5 ttp180 -54.15 -50.41 67.03 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.43 -0.794 . . . . 0.0 109.403 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.637 HD12 ' C ' ' A' ' 67' ' ' LEU . 0.6 OUTLIER -79.65 -26.73 40.99 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.31 -0.868 . . . . 0.0 109.716 -179.65 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.77 -38.65 85.97 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.886 -1.134 . . . . 0.0 109.664 -179.685 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 25.9 mtt -83.79 -50.41 8.15 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.927 -1.108 . . . . 0.0 109.864 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 52.8 ttt180 -50.43 -26.57 5.19 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 120.6 -1.312 . . . . 0.0 110.496 -179.461 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 -85.16 -51.78 6.39 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.774 -1.203 . . . . 0.0 110.684 -179.16 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.528 ' CE1' ' OD1' ' A' ' 76' ' ' ASN . 59.2 t-80 -54.82 -39.87 68.96 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.963 -1.086 . . . . 0.0 110.337 -179.281 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 68.9 t -73.29 -53.57 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 120.704 -1.248 . . . . 0.0 109.865 -179.657 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.445 ' O ' ' CG ' ' A' ' 78' ' ' ASP . 4.0 mmt -63.99 -22.8 67.08 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.014 -1.053 . . . . 0.0 109.815 -179.304 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.403 ' NZ ' ' CB ' ' A' ' 75' ' ' LYS . 7.3 ttpm? -89.42 -35.9 15.76 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.641 -1.287 . . . . 0.0 110.727 -178.868 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ASN . . . . . 0.528 ' OD1' ' CE1' ' A' ' 72' ' ' HIS . 5.5 m120 -100.15 -8.95 23.05 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.027 -1.046 . . . . 0.0 112.339 -178.263 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 90.1 t -118.4 -31.56 1.74 Allowed 'Isoleucine or valine' 0 N--CA 1.513 2.684 0 O-C-N 120.497 -1.377 . . . . 0.0 111.063 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.593 ' OD2' ' NE2' ' A' ' 81' ' ' GLN . 17.1 p-10 -48.9 103.42 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.928 0 O-C-N 120.499 -1.375 . . . . 0.0 109.158 179.396 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -78.58 -63.55 1.38 Allowed 'General case' 0 C--N 1.298 -1.647 0 O-C-N 120.754 -1.216 . . . . 0.0 110.259 -178.518 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.445 ' O ' ' N ' ' A' ' 82' ' ' ASP . 47.7 t30 -107.98 26.91 9.79 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.142 -0.974 . . . . 0.0 109.745 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.593 ' NE2' ' OD2' ' A' ' 78' ' ' ASP . 22.6 mm-40 36.64 31.32 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.864 0 CA-C-O 121.203 0.525 . . . . 0.0 111.333 178.817 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.553 ' C ' ' H ' ' A' ' 84' ' ' LEU . 89.9 m-20 -87.34 15.66 6.19 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 178.681 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.504 HH11 ' HG2' ' A' ' 83' ' ' ARG . 6.5 mtt-85 63.17 -2.94 0.39 Allowed 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 -178.574 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.553 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.8 mp -122.73 134.12 54.46 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 179.309 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 75.6 t -112.61 129.52 68.04 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.111 0 O-C-N 121.634 -0.666 . . . . 0.0 109.407 -179.023 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 64.5 p -94.57 167.22 11.62 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 120.967 -1.083 . . . . 0.0 109.121 179.187 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.747 HD13 ' C ' ' A' ' 87' ' ' LEU . 1.0 OUTLIER -70.14 -38.36 75.48 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.685 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -58.94 -69.37 0.2 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.415 -0.803 . . . . 0.0 111.431 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.406 ' N ' ' CD ' ' A' ' 89' ' ' GLU . 4.9 mp0 -56.49 -32.28 64.86 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.008 -1.058 . . . . 0.0 110.497 -178.417 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -61.79 -48.93 78.42 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 120.799 -1.188 . . . . 0.0 110.135 -179.146 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.425 ' O ' ' N ' ' A' ' 95' ' ' GLN . 87.4 mt -51.32 -48.39 62.38 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.809 -1.182 . . . . 0.0 108.899 179.172 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -46.22 -59.88 2.64 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.4 -0.812 . . . . 0.0 110.295 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 44.1 t -48.88 -28.05 3.5 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.156 -0.965 . . . . 0.0 110.511 -179.03 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 43.9 p -96.17 -57.62 2.29 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.093 -1.004 . . . . 0.0 108.987 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.425 ' N ' ' O ' ' A' ' 91' ' ' LEU . 91.0 mt-30 -53.08 123.98 13.15 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.18 -0.95 . . . . 0.0 109.011 179.46 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.433 ' O ' ' O ' ' A' ' 97' ' ' LYS . 7.3 ttp180 -166.15 117.62 1.03 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.114 -0.991 . . . . 0.0 109.459 -179.729 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.433 ' O ' ' O ' ' A' ' 96' ' ' ARG . 66.8 mmtt 55.3 105.48 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.321 -0.862 . . . . 0.0 109.435 -179.755 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -68.35 81.3 0.25 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.176 -0.953 . . . . 0.0 109.279 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 74.5 t80 . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 118.06 -0.972 . . . . 0.0 109.432 179.959 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.5 ' O ' HD23 ' A' ' 1' ' ' LEU . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 59.4 mttp -144.77 91.46 2.17 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.187 -0.946 . . . . 0.0 109.356 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.447 ' C ' ' H ' ' A' ' 5' ' ' TRP . 9.0 mm-40 52.65 -174.96 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.291 -0.88 . . . . 0.0 109.471 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 26.8 m -73.6 16.08 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.246 -0.909 . . . . 0.0 109.66 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.447 ' H ' ' C ' ' A' ' 3' ' ' GLU . 3.0 t90 -67.12 -71.16 0.21 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.252 -0.905 . . . . 0.0 109.222 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 52.31 -105.78 0.24 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.209 -0.932 . . . . 0.0 109.33 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 71.8 tt0 -170.27 -42.52 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.868 -1.145 . . . . 0.0 109.468 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.492 ' O ' ' N ' ' A' ' 10' ' ' GLY . 12.9 tp -166.81 96.12 0.52 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.201 -0.937 . . . . 0.0 109.41 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.426 ' N ' ' OD1' ' A' ' 9' ' ' ASP . 17.8 p-10 -66.31 56.73 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.482 -0.761 . . . . 0.0 109.876 -179.709 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 8' ' ' LEU . . . 164.07 81.61 0.04 OUTLIER Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 63.7 tp -51.39 108.16 0.24 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.324 -1.104 . . . . 0.0 108.887 179.529 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -160.38 151.03 15.33 Favored Pre-proline 0 N--CA 1.493 1.72 0 O-C-N 121.152 -0.967 . . . . 0.0 109.129 -179.758 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -57.45 -46.74 25.58 Favored 'Trans proline' 0 C--N 1.324 -0.76 0 C-N-CA 121.083 1.189 . . . . 0.0 109.918 179.381 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.413 ' O ' ' O ' ' A' ' 15' ' ' ARG . 15.4 m120 -154.76 66.97 0.68 Allowed 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.222 -0.924 . . . . 0.0 109.361 -179.397 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.413 ' O ' ' O ' ' A' ' 14' ' ' ASN . 55.2 mtp180 51.18 -179.68 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.159 -0.963 . . . . 0.0 109.555 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.445 ' O ' ' CD2' ' A' ' 16' ' ' PHE . 64.3 t80 -96.95 32.58 2.09 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.277 -0.889 . . . . 0.0 109.502 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 62.9 t-20 -170.58 68.16 0.52 Allowed Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.168 -0.958 . . . . 0.0 109.836 -179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -64.65 -23.53 63.51 Favored 'Trans proline' 0 C--N 1.318 -1.045 0 C-N-CA 121.468 1.445 . . . . 0.0 109.751 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 61.1 tttp -59.21 -40.06 84.62 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.365 -0.834 . . . . 0.0 110.937 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 52.5 m -68.3 -41.5 80.8 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 120.767 -1.208 . . . . 0.0 110.525 -178.482 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -55.54 -36.86 67.24 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.026 -1.046 . . . . 0.0 108.371 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -66.87 -35.61 80.42 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.46 -0.775 . . . . 0.0 110.149 -179.644 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 97.5 mt -71.36 -60.99 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 O-C-N 120.702 -1.249 . . . . 0.0 108.985 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 tp -46.21 -37.51 7.23 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.334 -0.854 . . . . 0.0 110.795 -179.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.524 ' O ' ' ND1' ' A' ' 25' ' ' HIS . 0.9 OUTLIER -76.28 -16.22 59.83 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.517 -1.364 . . . . 0.0 109.548 -179.943 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -79.54 94.82 5.69 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.17 -0.956 . . . . 0.0 108.891 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 18.5 mt -75.93 -52.21 18.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 O-C-N 121.322 -0.861 . . . . 0.0 110.819 -178.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.55 ' ND2' ' OD2' ' A' ' 30' ' ' ASP . 6.7 p30 -84.57 -2.52 57.51 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.969 -1.082 . . . . 0.0 110.032 -179.615 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.4 m 57.2 53.16 8.04 Favored 'General case' 0 C--N 1.294 -1.828 0 O-C-N 121.19 -0.944 . . . . 0.0 110.345 178.81 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.55 ' OD2' ' ND2' ' A' ' 28' ' ' ASN . 58.1 m-20 -96.21 -1.07 48.99 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.163 -0.961 . . . . 0.0 108.468 179.145 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 76.45 -0.09 65.45 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.46 160.35 16.94 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 O-C-N 121.262 -1.14 . . . . 0.0 108.578 178.064 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 80.3 mt -107.85 128.6 54.75 Favored 'General case' 0 N--CA 1.511 2.616 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 178.384 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.415 ' C ' ' H ' ' A' ' 36' ' ' GLN . 39.2 p-10 -106.58 165.02 11.59 Favored 'General case' 0 N--CA 1.501 2.086 0 CA-C-O 121.757 0.789 . . . . 0.0 110.175 -179.279 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.414 ' O ' ' OE2' ' A' ' 39' ' ' GLU . 62.6 mt-10 -52.76 -8.56 0.09 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.771 -0.581 . . . . 0.0 110.325 -179.614 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.415 ' H ' ' C ' ' A' ' 34' ' ' ASP . 45.6 mm-40 -86.33 -48.88 8.1 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.812 -1.18 . . . . 0.0 109.707 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 59.3 mt-10 -71.12 -29.19 64.94 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.277 -0.889 . . . . 0.0 109.18 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.4 tp -77.83 -39.04 44.92 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.506 -0.746 . . . . 0.0 109.885 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.53 ' N ' ' OE1' ' A' ' 39' ' ' GLU . 0.2 OUTLIER -74.68 -40.37 61.43 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.847 -1.158 . . . . 0.0 109.916 179.993 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.65 -39.31 73.71 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.075 -1.016 . . . . 0.0 111.686 -178.187 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 41.3 tp -73.07 -25.53 60.94 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 120.833 -1.167 . . . . 0.0 110.214 -178.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 1.4 m-30 -84.82 -49.65 8.24 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 120.853 -1.154 . . . . 0.0 109.388 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 16.2 m -63.01 -34.7 78.12 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.994 -1.066 . . . . 0.0 110.054 -179.498 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 30.0 ttpt -70.65 -46.64 62.89 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.073 -1.017 . . . . 0.0 110.246 -179.234 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -56.21 -27.48 54.89 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.888 -1.132 . . . . 0.0 110.036 -179.402 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 7.2 tp -71.03 -24.29 62.33 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.978 -1.076 . . . . 0.0 109.958 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.86 2.86 28.38 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 120.875 -1.141 . . . . 0.0 109.496 179.532 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -105.57 -23.39 12.79 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.233 -0.917 . . . . 0.0 109.524 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 55.5 t -90.36 -38.07 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.265 -0.897 . . . . 0.0 109.101 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -88.06 -17.95 29.99 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.25 -0.906 . . . . 0.0 109.792 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 48.24 81.72 0.25 Allowed Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 120.7 -1.25 . . . . 0.0 110.296 178.403 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -60.07 179.09 0.32 Allowed 'Trans proline' 0 C--N 1.318 -1.078 0 C-N-CA 121.098 1.199 . . . . 0.0 109.513 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 9.3 mtmm -131.15 -64.81 0.8 Allowed 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.425 -0.797 . . . . 0.0 110.005 -179.355 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -172.26 97.53 0.16 Allowed 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.227 -0.921 . . . . 0.0 109.079 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 57.15 98.77 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.488 -0.758 . . . . 0.0 109.245 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.473 ' N ' ' CD ' ' A' ' 56' ' ' GLU . 1.5 pm0 -129.72 -168.84 2.01 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -147.05 -57.54 0.26 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.138 -0.976 . . . . 0.0 109.65 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.431 ' N ' ' OD1' ' A' ' 58' ' ' ASP . 12.8 p-10 -46.84 -30.82 2.67 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.151 -0.968 . . . . 0.0 109.717 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.409 ' C ' ' SD ' ' A' ' 59' ' ' MET . 1.5 tmt? -56.3 -34.03 66.12 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.473 -0.767 . . . . 0.0 109.027 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -79.28 -44.9 20.77 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.262 -0.899 . . . . 0.0 109.138 179.522 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.427 ' O ' ' OE1' ' A' ' 64' ' ' GLU . 42.7 tt0 -54.59 -11.58 0.59 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.329 -0.857 . . . . 0.0 109.509 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.565 ' C ' ' H ' ' A' ' 64' ' ' GLU . 4.6 tpt -100.19 -6.92 25.37 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.347 -0.846 . . . . 0.0 108.998 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.41 ' HB2' HH21 ' A' ' 66' ' ' ARG . 14.6 pt-20 -53.97 4.64 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.188 -0.945 . . . . 0.0 111.282 -179.238 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.565 ' H ' ' C ' ' A' ' 62' ' ' MET . 20.9 mp0 -61.72 -30.8 71.0 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.63 -1.293 . . . . 0.0 110.045 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -55.23 -27.19 44.46 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.061 -1.024 . . . . 0.0 109.802 -179.448 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.41 HH21 ' HB2' ' A' ' 63' ' ' GLU . 43.5 mtm180 -70.08 -44.17 69.63 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.002 -1.061 . . . . 0.0 109.691 -179.577 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 72.3 mt -57.85 -41.78 83.08 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.097 -1.002 . . . . 0.0 110.124 -178.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -70.21 -37.24 75.01 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.286 -0.884 . . . . 0.0 109.867 -179.378 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -82.52 -32.29 28.77 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.144 -0.972 . . . . 0.0 108.87 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 40.7 ttp180 -73.85 -49.74 23.63 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.02 -1.05 . . . . 0.0 109.915 179.329 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -60.58 -49.43 77.58 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.925 -1.11 . . . . 0.0 110.182 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 13.3 t-160 -54.58 -36.41 64.37 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.169 -0.957 . . . . 0.0 110.259 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 69.5 t -75.5 -54.94 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 120.611 -1.306 . . . . 0.0 109.916 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.414 ' O ' ' CG ' ' A' ' 78' ' ' ASP . 4.1 mmt -63.32 -19.03 64.26 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.032 -1.043 . . . . 0.0 110.188 -179.163 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 72.7 tttt -93.43 -39.72 10.75 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.903 -1.123 . . . . 0.0 111.215 -178.384 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -101.46 -9.47 21.05 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 121.081 -1.012 . . . . 0.0 112.33 -177.706 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 87.1 t -110.62 -35.38 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.471 0 O-C-N 120.475 -1.391 . . . . 0.0 109.692 179.237 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.574 ' OD2' ' NE2' ' A' ' 81' ' ' GLN . 11.9 p-10 -49.1 109.12 0.23 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.763 -1.211 . . . . 0.0 108.649 178.577 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.593 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -85.3 -62.54 1.51 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 120.914 -1.116 . . . . 0.0 110.397 -177.661 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.413 ' N ' ' OG1' ' A' ' 79' ' ' THR . 52.8 t-20 -104.46 17.43 24.14 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.238 -0.914 . . . . 0.0 109.805 -179.557 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.574 ' NE2' ' OD2' ' A' ' 78' ' ' ASP . 25.4 mm-40 43.79 75.01 0.1 Allowed 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.414 -0.804 . . . . 0.0 111.013 177.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.583 ' C ' ' H ' ' A' ' 84' ' ' LEU . 45.8 t0 -132.33 19.44 4.4 Favored 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 107.899 -1.149 . . . . 0.0 107.899 178.525 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.525 ' CG ' HH11 ' A' ' 83' ' ' ARG . 5.1 mtt-85 59.62 -3.51 0.11 Allowed 'General case' 0 N--CA 1.491 1.621 0 CA-C-O 121.478 0.656 . . . . 0.0 109.236 -178.844 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.583 ' H ' ' C ' ' A' ' 82' ' ' ASP . 11.2 mt -123.39 134.96 53.93 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 179.569 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 74.4 t -110.4 128.43 66.68 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.036 0 O-C-N 121.493 -0.754 . . . . 0.0 109.124 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 60.9 p -102.37 156.54 17.52 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.264 -0.898 . . . . 0.0 109.346 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.1 tp -59.06 -39.27 81.55 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.484 -0.76 . . . . 0.0 108.955 179.426 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -58.8 -68.57 0.25 Allowed 'General case' 0 C--N 1.295 -1.803 0 O-C-N 121.607 -0.683 . . . . 0.0 110.993 -177.739 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.593 ' CB ' HG21 ' A' ' 79' ' ' THR . 34.6 mm-40 -61.52 -30.28 70.53 Favored 'General case' 0 C--N 1.299 -1.618 0 O-C-N 121.233 -0.917 . . . . 0.0 110.717 -178.497 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -63.13 -51.68 65.53 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.902 -1.124 . . . . 0.0 109.68 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 78.7 mt -50.33 -45.07 54.58 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.263 -0.898 . . . . 0.0 109.376 179.466 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -51.52 -57.79 8.08 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.236 -0.915 . . . . 0.0 110.162 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 37.7 t -46.34 -34.34 4.5 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.24 -0.913 . . . . 0.0 110.518 -179.414 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 44.0 p -86.85 -51.68 5.93 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.003 -1.06 . . . . 0.0 109.063 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -53.46 144.24 17.43 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.053 -1.03 . . . . 0.0 108.784 179.451 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.521 ' NH1' ' O ' ' A' ' 98' ' ' GLU . 0.0 OUTLIER -164.11 49.93 0.13 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.027 -1.046 . . . . 0.0 109.1 -179.655 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.494 ' O ' ' N ' ' A' ' 99' ' ' PHE . 25.6 mtpt -50.04 -37.75 34.61 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 121.048 -1.032 . . . . 0.0 109.356 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.607 ' CD ' ' H ' ' A' ' 98' ' ' GLU . 2.8 mp0 -48.41 95.01 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.165 -0.959 . . . . 0.0 109.241 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.494 ' N ' ' O ' ' A' ' 97' ' ' LYS . 65.7 m-85 . . . . . 0 N--CA 1.498 1.941 0 CA-C-O 117.957 -1.02 . . . . 0.0 110.385 -179.223 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.57 HD22 ' N ' ' A' ' 1' ' ' LEU . 3.5 mm? . . . . . 0 N--CA 1.49 1.532 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -51.06 -45.44 61.37 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.206 -0.934 . . . . 0.0 109.546 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -63.34 -178.81 0.28 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.207 -0.933 . . . . 0.0 109.543 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.449 HG22 ' N ' ' A' ' 5' ' ' TRP . 8.5 p -59.08 157.98 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.292 -0.88 . . . . 0.0 109.446 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.449 ' N ' HG22 ' A' ' 4' ' ' VAL . 29.8 t90 -170.55 0.5 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.281 -0.887 . . . . 0.0 109.585 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.461 ' N ' ' CD ' ' A' ' 6' ' ' GLU . 4.4 mp0 -80.01 -158.74 0.18 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.229 -0.92 . . . . 0.0 109.53 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.482 ' N ' ' CD ' ' A' ' 7' ' ' GLU . 1.1 pm0 -164.41 17.18 0.06 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.21 -0.931 . . . . 0.0 109.249 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.3 tp -166.18 141.44 4.65 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -135.17 30.96 3.25 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.068 -1.02 . . . . 0.0 109.422 -179.806 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.465 ' O ' ' C ' ' A' ' 11' ' ' LEU . . . 172.73 82.69 0.05 OUTLIER Glycine 0 N--CA 1.488 2.109 0 N-CA-C 108.995 -1.642 . . . . 0.0 108.995 -179.539 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.465 ' C ' ' O ' ' A' ' 10' ' ' GLY . 18.7 tp -32.09 127.46 0.24 Allowed 'General case' 0 N--CA 1.509 2.523 0 O-C-N 122.28 -0.541 . . . . 0.0 110.603 -179.427 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.514 ' C ' ' H ' ' A' ' 14' ' ' ASN . 4.4 m-20 -57.73 150.54 46.77 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.153 -0.967 . . . . 0.0 109.115 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -59.79 4.22 0.17 Allowed 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 121.312 1.341 . . . . 0.0 110.506 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.523 ' CG ' ' H ' ' A' ' 15' ' ' ARG . 8.6 t-20 -127.2 -148.15 0.38 Allowed 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.527 HH11 ' CG ' ' A' ' 15' ' ' ARG . 0.3 OUTLIER 44.53 93.27 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.656 -0.653 . . . . 0.0 109.73 179.877 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -135.17 70.28 1.44 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.423 -0.798 . . . . 0.0 109.452 -179.631 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 50.76 76.1 0.58 Allowed Pre-proline 0 N--CA 1.489 1.5 0 O-C-N 121.246 -0.909 . . . . 0.0 109.556 179.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -59.48 -11.76 14.95 Favored 'Trans proline' 0 C--N 1.319 -1.006 0 C-N-CA 121.445 1.43 . . . . 0.0 110.274 -179.364 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 48.4 tttm -56.05 -48.22 76.43 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.337 -0.852 . . . . 0.0 110.495 179.685 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 46.2 m -59.66 -37.98 80.19 Favored 'General case' 0 C--N 1.306 -1.296 0 O-C-N 120.963 -1.086 . . . . 0.0 110.444 -178.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.401 ' CD2' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.35 -47.71 78.27 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.915 -1.116 . . . . 0.0 108.126 179.717 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.401 ' N ' ' CD2' ' A' ' 21' ' ' PHE . 20.7 t80 -54.51 -32.7 58.56 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.527 -0.733 . . . . 0.0 109.896 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.48 ' O ' ' N ' ' A' ' 25' ' ' HIS . 96.5 mt -75.04 -61.94 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.223 0 O-C-N 120.814 -1.179 . . . . 0.0 109.676 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 24' ' ' LEU . 20.5 mt -47.74 -13.23 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.785 -1.197 . . . . 0.0 110.742 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.503 ' O ' ' ND1' ' A' ' 25' ' ' HIS . 1.0 OUTLIER -104.62 -14.02 15.76 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.526 -1.359 . . . . 0.0 110.582 -179.417 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.472 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 20.6 p-10 -79.59 70.33 6.05 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 120.827 -1.17 . . . . 0.0 109.238 179.662 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.414 HD12 ' OE2' ' A' ' 37' ' ' GLU . 8.1 mt -50.1 -53.18 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 O-C-N 121.041 -1.037 . . . . 0.0 111.127 -179.13 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.463 ' N ' ' OD1' ' A' ' 28' ' ' ASN . 5.0 p30 -85.85 -1.85 57.67 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.891 -1.131 . . . . 0.0 110.095 -179.412 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 19.9 p 53.34 50.82 16.69 Favored 'General case' 0 C--N 1.292 -1.895 0 O-C-N 121.289 -0.882 . . . . 0.0 110.49 178.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -95.11 3.41 54.79 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 74.47 1.13 60.31 Favored Glycine 0 N--CA 1.489 2.213 0 N-CA-C 109.776 -1.329 . . . . 0.0 109.776 -179.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.67 163.39 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.093 0 O-C-N 121.131 -1.217 . . . . 0.0 108.931 178.371 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 68.4 mt -113.7 124.83 53.24 Favored 'General case' 0 N--CA 1.513 2.709 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 178.112 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -105.61 163.0 13.01 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.614 -0.679 . . . . 0.0 109.931 -179.3 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -49.23 -32.29 10.34 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.418 -0.801 . . . . 0.0 111.625 -178.192 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 46.5 mm-40 -64.61 -33.06 75.05 Favored 'General case' 0 C--N 1.293 -1.877 0 O-C-N 120.558 -1.339 . . . . 0.0 109.244 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.414 ' OE2' HD12 ' A' ' 27' ' ' ILE . 33.8 mm-40 -74.34 -38.14 63.34 Favored 'General case' 0 N--CA 1.496 1.852 0 C-N-CA 119.269 -0.972 . . . . 0.0 108.831 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.9 mt -81.58 -39.18 24.96 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.141 -0.975 . . . . 0.0 109.264 178.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -59.97 -39.93 87.33 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 120.628 -1.295 . . . . 0.0 108.775 179.096 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.21 -29.39 62.77 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.295 -0.878 . . . . 0.0 110.369 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.524 ' O ' HD23 ' A' ' 41' ' ' LEU . 0.8 OUTLIER -76.45 -24.3 53.89 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.195 -0.941 . . . . 0.0 110.289 -179.173 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -82.7 -50.5 8.65 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.672 -1.267 . . . . 0.0 109.646 -179.454 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 31.3 m -60.4 -41.74 94.48 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.368 -0.833 . . . . 0.0 111.233 -179.036 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -73.77 -47.48 38.67 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.039 -1.038 . . . . 0.0 111.808 -177.724 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.403 ' CD ' ' CD2' ' A' ' 41' ' ' LEU . 18.9 mt-10 -53.91 -28.04 34.26 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.446 -1.408 . . . . 0.0 109.685 -178.885 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.46 ' C ' ' H ' ' A' ' 48' ' ' LYS . 30.7 mt -77.05 -31.33 56.13 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.926 -1.109 . . . . 0.0 110.441 -179.427 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.426 ' O ' ' OE1' ' A' ' 47' ' ' GLU . 0.9 OUTLIER -62.89 1.74 0.38 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.8 -1.188 . . . . 0.0 109.627 179.887 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.46 ' H ' ' C ' ' A' ' 46' ' ' LEU . 43.1 mttt -123.9 31.05 5.95 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.188 -0.945 . . . . 0.0 109.679 179.23 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 44.6 t -148.38 -59.01 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 O-C-N 120.915 -1.116 . . . . 0.0 110.338 -179.641 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.581 ' CZ ' ' SD ' ' A' ' 62' ' ' MET . 84.2 m-85 -85.62 -18.81 32.19 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.977 -1.077 . . . . 0.0 110.358 -179.066 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.509 ' C ' ' H ' ' A' ' 53' ' ' LYS . 25.3 m-20 51.91 71.62 1.44 Allowed Pre-proline 0 N--CA 1.49 1.526 0 O-C-N 120.97 -1.081 . . . . 0.0 109.211 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -65.73 14.51 0.1 Allowed 'Trans proline' 0 C--N 1.317 -1.089 0 C-N-CA 121.753 1.635 . . . . 0.0 110.658 -179.336 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.509 ' H ' ' C ' ' A' ' 51' ' ' ASP . 66.6 mttm -121.42 25.85 9.18 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.451 -0.78 . . . . 0.0 109.745 -179.764 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -160.17 26.03 0.17 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.117 -0.989 . . . . 0.0 109.916 179.848 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.462 ' O ' ' C ' ' A' ' 56' ' ' GLU . 36.2 mt-10 -156.33 73.01 0.78 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.107 -0.996 . . . . 0.0 109.342 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.472 ' N ' ' CD ' ' A' ' 56' ' ' GLU . 1.4 mp0 32.8 -104.95 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.844 -0.535 . . . . 0.0 110.763 179.527 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.47 ' N ' ' OD1' ' A' ' 57' ' ' ASP . 10.0 p-10 -147.55 29.82 0.93 Allowed 'General case' 0 N--CA 1.496 1.832 0 O-C-N 120.996 -1.065 . . . . 0.0 109.888 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.42 ' OD1' ' N ' ' A' ' 58' ' ' ASP . 0.6 OUTLIER -71.22 -1.27 12.04 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.973 -1.08 . . . . 0.0 109.609 -179.817 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -54.19 -32.28 55.15 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.256 -0.903 . . . . 0.0 109.059 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.557 ' O ' ' N ' ' A' ' 62' ' ' MET . 99.5 mtt180 -82.1 -36.28 27.73 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.33 -0.856 . . . . 0.0 109.694 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -46.1 -12.72 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.885 -1.134 . . . . 0.0 110.25 -179.277 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.581 ' SD ' ' CZ ' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -122.62 4.79 9.54 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.331 -0.855 . . . . 0.0 109.639 179.878 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.445 ' CD ' HH21 ' A' ' 66' ' ' ARG . 1.4 tt0 -44.17 -16.47 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.458 -0.776 . . . . 0.0 109.471 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.547 ' N ' ' O ' ' A' ' 62' ' ' MET . 74.5 mm-40 -61.01 -24.68 66.35 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.253 -0.905 . . . . 0.0 110.139 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -72.68 -41.87 64.88 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.156 -0.965 . . . . 0.0 109.752 -179.615 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.445 HH21 ' CD ' ' A' ' 63' ' ' GLU . 5.9 mtm180 -50.91 -38.24 48.84 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.169 -0.957 . . . . 0.0 108.902 -179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 64.8 mt -75.05 -28.81 60.55 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.163 -0.961 . . . . 0.0 109.422 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.51 HH11 ' HG2' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -64.67 -40.69 95.85 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.112 -0.992 . . . . 0.0 109.498 -179.683 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 9.1 mtm -86.07 -50.3 7.14 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 120.988 -1.07 . . . . 0.0 109.367 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 24.8 ttt-85 -58.51 -41.71 86.05 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.915 -1.116 . . . . 0.0 110.576 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -74.9 -52.18 11.93 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 120.808 -1.183 . . . . 0.0 110.671 -179.064 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 17.6 t60 -54.32 -41.13 68.65 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.942 -1.099 . . . . 0.0 110.294 -179.487 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 75.3 t -71.34 -49.07 50.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 120.689 -1.257 . . . . 0.0 109.522 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 16.9 mtp -67.81 -19.85 65.12 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.201 -0.937 . . . . 0.0 110.877 -179.296 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 35.1 pttt -88.11 -32.2 18.81 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 120.302 -1.499 . . . . 0.0 110.721 -179.531 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ASN . . . . . 0.476 ' OD1' ' N ' ' A' ' 77' ' ' VAL . 27.6 p-10 -104.91 -27.07 11.93 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.104 -0.997 . . . . 0.0 112.587 -178.09 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.476 ' N ' ' OD1' ' A' ' 76' ' ' ASN . 40.2 t -92.61 -33.7 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 O-C-N 120.253 -1.53 . . . . 0.0 110.236 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -66.04 105.24 1.3 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.467 -1.396 . . . . 0.0 108.001 178.57 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.475 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -83.48 -54.16 5.17 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.298 -0.876 . . . . 0.0 111.417 -178.176 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.427 ' O ' ' C ' ' A' ' 81' ' ' GLN . 30.7 m-20 -100.12 24.84 8.12 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.287 -0.883 . . . . 0.0 109.642 -179.438 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.427 ' C ' ' O ' ' A' ' 80' ' ' ASN . 31.2 mm-40 32.45 37.05 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.569 ' C ' ' H ' ' A' ' 84' ' ' LEU . 26.0 t0 -88.69 13.73 11.66 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 178.414 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 40.8 mtp180 61.93 -2.52 0.29 Allowed 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 -178.476 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.569 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.5 mp -122.92 134.53 54.36 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 106.695 -1.594 . . . . 0.0 106.695 178.916 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 69.0 t -112.84 129.98 67.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.049 0 O-C-N 121.687 -0.633 . . . . 0.0 110.21 -178.207 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 30.1 p -101.78 173.9 6.2 Favored 'General case' 0 N--CA 1.499 1.999 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.568 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.9 tp -73.14 -34.76 66.27 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.164 -0.96 . . . . 0.0 109.236 179.848 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -61.32 -68.24 0.33 Allowed 'General case' 0 C--N 1.293 -1.852 0 O-C-N 121.034 -1.041 . . . . 0.0 111.379 -177.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.475 ' CB ' HG21 ' A' ' 79' ' ' THR . 6.4 mm-40 -60.01 -31.36 69.86 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.242 -0.911 . . . . 0.0 110.719 -178.325 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -64.26 -52.37 59.0 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.912 -1.118 . . . . 0.0 110.136 -179.361 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.505 ' O ' ' N ' ' A' ' 95' ' ' GLN . 77.5 mt -49.97 -42.49 48.91 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.124 -0.985 . . . . 0.0 109.301 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -53.39 -57.64 9.92 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.297 -0.877 . . . . 0.0 110.304 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 42.9 t -48.31 -28.9 3.4 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.122 -0.986 . . . . 0.0 109.992 -179.158 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.423 ' OG1' ' N ' ' A' ' 95' ' ' GLN . 33.2 p -98.96 -65.86 0.94 Allowed 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.242 -0.911 . . . . 0.0 108.993 179.677 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.505 ' N ' ' O ' ' A' ' 91' ' ' LEU . 77.7 mt-30 -43.02 -48.87 6.1 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.392 -0.817 . . . . 0.0 110.315 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 20.6 mmm180 52.47 54.44 10.65 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.957 -1.089 . . . . 0.0 109.583 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 63.8 tttm -51.07 -24.45 3.92 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.306 -0.872 . . . . 0.0 109.465 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -74.79 93.48 2.62 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.372 -0.83 . . . . 0.0 109.585 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 118.006 -0.997 . . . . 0.0 109.424 179.999 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 24.0 mt . . . . . 0 N--CA 1.49 1.555 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -61.95 -30.51 70.97 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.282 -0.886 . . . . 0.0 109.677 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -67.46 128.94 38.3 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.193 -0.942 . . . . 0.0 109.509 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 10.6 p -169.12 134.24 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.218 -0.927 . . . . 0.0 109.483 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.419 ' O ' ' CE3' ' A' ' 5' ' ' TRP . 23.1 p-90 -87.37 66.05 8.96 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.252 -0.905 . . . . 0.0 109.633 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 54.7 tt0 -101.89 150.73 22.88 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.372 -0.83 . . . . 0.0 109.46 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.476 ' O ' ' CB ' ' A' ' 8' ' ' LEU . 7.4 tp10 66.4 169.86 0.23 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.321 -0.862 . . . . 0.0 109.013 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.476 ' CB ' ' O ' ' A' ' 7' ' ' GLU . 2.3 tp 74.15 36.71 0.66 Allowed 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.277 -0.889 . . . . 0.0 108.873 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -73.14 -24.57 60.6 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.27 -0.894 . . . . 0.0 109.576 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.444 ' O ' ' N ' ' A' ' 12' ' ' ASP . . . -77.74 -73.84 1.04 Allowed Glycine 0 N--CA 1.488 2.155 0 N-CA-C 109.211 -1.556 . . . . 0.0 109.211 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.647 HD22 ' N ' ' A' ' 11' ' ' LEU . 3.2 mm? -63.71 81.59 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.254 -1.144 . . . . 0.0 109.036 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.444 ' N ' ' O ' ' A' ' 10' ' ' GLY . 1.0 OUTLIER -68.76 153.43 95.93 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.208 -0.932 . . . . 0.0 108.677 179.909 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_endo -61.45 172.11 3.74 Favored 'Trans proline' 0 C--N 1.321 -0.879 0 C-N-CA 121.328 1.352 . . . . 0.0 109.618 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 -104.76 82.13 1.85 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.565 -0.71 . . . . 0.0 109.302 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.6 ptp180 -138.42 -6.68 1.54 Allowed 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.491 -0.756 . . . . 0.0 109.146 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -77.62 -109.15 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.305 -0.872 . . . . 0.0 109.499 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.4 m120 45.58 65.13 6.91 Favored Pre-proline 0 N--CA 1.493 1.68 0 O-C-N 121.296 -0.878 . . . . 0.0 109.725 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -68.3 -20.33 42.88 Favored 'Trans proline' 0 C--N 1.318 -1.066 0 C-N-CA 121.585 1.523 . . . . 0.0 110.54 -179.416 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -68.32 -49.42 60.48 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.176 -0.953 . . . . 0.0 111.362 -178.244 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.1 m -63.89 -41.34 97.74 Favored 'General case' 0 N--CA 1.485 1.283 0 O-C-N 120.723 -1.236 . . . . 0.0 110.53 -178.575 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.47 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.05 -39.56 72.21 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.948 -1.095 . . . . 0.0 108.357 -179.803 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.47 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 53.1 t80 -63.35 -34.0 76.76 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.188 -0.945 . . . . 0.0 110.074 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.47 ' O ' ' N ' ' A' ' 26' ' ' ASP . 97.0 mt -69.92 -59.83 3.11 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 O-C-N 120.714 -1.241 . . . . 0.0 109.099 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.7 tp -45.15 -38.91 5.6 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.325 -0.859 . . . . 0.0 110.377 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.405 ' ND1' HD21 ' A' ' 41' ' ' LEU . 13.7 m-70 -75.15 -17.01 60.49 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 120.428 -1.42 . . . . 0.0 109.402 179.488 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.47 ' N ' ' O ' ' A' ' 23' ' ' ILE . 75.7 m-20 -80.02 92.25 5.57 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.094 -1.004 . . . . 0.0 109.066 179.624 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.1 mt -76.3 -45.17 35.36 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.429 0 O-C-N 121.318 -0.863 . . . . 0.0 110.635 -178.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 50.9 t-20 -94.04 8.21 42.28 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.788 -1.195 . . . . 0.0 110.12 -179.626 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 54.3 p 44.67 64.16 1.45 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.152 -0.967 . . . . 0.0 110.749 178.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -104.39 4.93 33.93 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.257 -0.902 . . . . 0.0 108.914 179.294 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 70.93 -0.05 31.53 Favored Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.388 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -139.2 165.32 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.033 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 177.907 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.437 HD12 ' HA ' ' A' ' 33' ' ' LEU . 6.2 tp -106.76 110.16 22.26 Favored 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 178.27 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -80.55 147.87 30.61 Favored 'General case' 0 N--CA 1.498 1.93 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.305 -178.477 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -52.32 -38.52 58.78 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.45 -0.781 . . . . 0.0 110.406 -179.281 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 51.0 mm-40 -64.02 -34.21 77.49 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 120.927 -1.108 . . . . 0.0 108.605 179.544 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -73.46 -33.86 65.08 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 179.161 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.2 tp -76.5 -37.22 57.12 Favored 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.155 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -72.63 -49.7 30.16 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.957 -1.089 . . . . 0.0 110.119 -179.756 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.17 -50.46 61.04 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.895 -1.128 . . . . 0.0 110.902 -178.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.405 HD21 ' ND1' ' A' ' 25' ' ' HIS . 40.2 tp -56.16 -26.03 48.92 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.075 -1.015 . . . . 0.0 110.035 -178.702 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -83.13 -49.3 9.64 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 120.896 -1.127 . . . . 0.0 109.379 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 30.1 m -63.37 -41.0 98.78 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 120.943 -1.098 . . . . 0.0 110.22 -179.303 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.9 ttpt -73.4 -49.05 29.14 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.028 -1.045 . . . . 0.0 110.982 -178.54 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -54.62 -26.55 33.53 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.541 -1.349 . . . . 0.0 109.088 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.445 ' C ' ' H ' ' A' ' 48' ' ' LYS . 5.7 tp -80.43 -36.07 34.2 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.468 -0.77 . . . . 0.0 109.88 -179.484 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -67.09 5.02 0.75 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 120.939 -1.101 . . . . 0.0 109.11 179.402 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.445 ' H ' ' C ' ' A' ' 46' ' ' LEU . 37.0 mtpt -112.72 -6.9 13.84 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.503 -0.748 . . . . 0.0 109.038 179.486 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 77.9 t -97.9 -61.27 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.3 -0.875 . . . . 0.0 108.846 179.376 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -67.21 -137.33 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 178.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -166.03 67.25 1.07 Allowed Pre-proline 0 N--CA 1.49 1.526 0 O-C-N 120.923 -1.11 . . . . 0.0 109.267 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -63.41 173.18 4.53 Favored 'Trans proline' 0 C--N 1.317 -1.12 0 C-N-CA 121.259 1.306 . . . . 0.0 109.814 -179.594 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 5.4 mtmm -139.07 49.53 1.85 Allowed 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 51.33 48.56 22.75 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 -179.301 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -106.55 139.19 41.41 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.697 -0.627 . . . . 0.0 109.622 -179.634 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -76.61 -7.46 55.29 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.184 -0.947 . . . . 0.0 109.441 179.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -143.97 94.45 2.59 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.328 -0.857 . . . . 0.0 109.697 -179.367 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -166.02 -22.23 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.182 -0.949 . . . . 0.0 109.544 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.494 ' O ' ' SD ' ' A' ' 62' ' ' MET . 55.0 mtp -98.87 29.93 3.58 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.33 -0.856 . . . . 0.0 109.379 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -104.59 -55.16 2.39 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.376 -0.828 . . . . 0.0 109.724 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.592 ' H ' ' CD ' ' A' ' 61' ' ' GLU . 5.2 mp0 -39.6 -42.26 1.15 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.195 -0.94 . . . . 0.0 111.416 -178.906 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.589 ' SD ' ' N ' ' A' ' 62' ' ' MET . 0.0 OUTLIER -83.87 6.05 22.96 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.717 -1.239 . . . . 0.0 110.481 -179.21 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.461 ' N ' ' SD ' ' A' ' 62' ' ' MET . 2.9 pp20? -45.56 -15.28 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.267 -0.896 . . . . 0.0 109.331 -179.614 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.553 ' N ' ' O ' ' A' ' 62' ' ' MET . 26.4 mm-40 -63.13 -57.6 10.03 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.519 -0.738 . . . . 0.0 109.053 178.79 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -64.17 -35.93 82.41 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.478 -0.764 . . . . 0.0 109.584 -179.828 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 24.9 ttp180 -55.69 -49.3 73.34 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.29 -0.881 . . . . 0.0 109.649 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.644 HD12 ' C ' ' A' ' 67' ' ' LEU . 0.5 OUTLIER -78.83 -26.85 44.22 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.19 -0.944 . . . . 0.0 109.948 -179.622 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.515 HH11 ' HG2' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -65.55 -38.76 90.54 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 120.959 -1.088 . . . . 0.0 109.889 -179.452 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 9.0 mtt -85.05 -29.56 24.83 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.121 -0.987 . . . . 0.0 109.857 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -72.95 -40.86 65.03 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.861 -1.149 . . . . 0.0 110.29 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -73.02 -47.28 46.34 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 120.793 -1.192 . . . . 0.0 110.501 -179.248 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 35.4 t-80 -55.75 -40.87 73.13 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.147 -0.971 . . . . 0.0 110.863 -179.449 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 66.0 t -72.6 -54.18 16.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 120.551 -1.343 . . . . 0.0 110.126 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.7 mmt -61.11 -19.72 61.81 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.141 -0.975 . . . . 0.0 110.018 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 43.4 tttp -82.64 -40.05 21.27 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.662 -1.273 . . . . 0.0 111.399 -178.634 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ASN . . . . . 0.445 ' OD1' ' N ' ' A' ' 77' ' ' VAL . 48.2 p-10 -102.91 -20.77 14.14 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 120.983 -1.073 . . . . 0.0 112.35 -177.842 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.445 ' N ' ' OD1' ' A' ' 76' ' ' ASN . 31.3 t -97.83 -32.02 3.91 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.391 0 O-C-N 120.455 -1.403 . . . . 0.0 110.025 -179.723 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -53.28 107.76 0.27 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.724 -1.235 . . . . 0.0 109.302 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -81.18 -69.11 0.63 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.339 -0.85 . . . . 0.0 112.815 -177.711 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.466 ' O ' ' N ' ' A' ' 82' ' ' ASP . 59.5 m-20 -107.88 27.8 8.86 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 120.879 -1.138 . . . . 0.0 110.748 -177.425 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.481 ' C ' ' H ' ' A' ' 83' ' ' ARG . 22.7 mm-40 42.13 23.24 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.751 0 O-C-N 121.58 -0.7 . . . . 0.0 111.245 178.794 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.504 ' C ' ' H ' ' A' ' 84' ' ' LEU . 37.3 t0 -82.78 13.97 3.51 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 177.881 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.481 ' H ' ' C ' ' A' ' 81' ' ' GLN . 44.0 mtm180 64.05 -2.25 0.59 Allowed 'General case' 0 N--CA 1.486 1.363 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.797 -179.036 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.504 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.3 mt -115.46 133.57 55.9 Favored 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 179.013 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 78.1 t -109.58 130.98 61.7 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 53.8 p -107.03 153.27 22.85 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.138 -0.976 . . . . 0.0 109.81 -179.624 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.4 tp -55.36 -34.62 64.43 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 179.32 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -57.09 -69.42 0.16 Allowed 'General case' 0 C--N 1.296 -1.743 0 O-C-N 121.43 -0.794 . . . . 0.0 111.862 -178.095 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -68.97 -33.24 73.37 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.862 -1.149 . . . . 0.0 110.895 -177.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -56.38 -50.93 70.13 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 120.765 -1.21 . . . . 0.0 108.777 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.492 ' O ' ' N ' ' A' ' 95' ' ' GLN . 52.9 mt -51.65 -49.72 61.77 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.187 -0.945 . . . . 0.0 109.337 179.152 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -44.48 -46.07 9.53 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.415 -0.803 . . . . 0.0 109.85 -179.686 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 53.5 p -57.27 -34.97 69.19 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.363 -0.836 . . . . 0.0 109.712 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 22.2 p -94.06 -51.33 4.89 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.199 -0.938 . . . . 0.0 109.222 179.68 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.492 ' N ' ' O ' ' A' ' 91' ' ' LEU . 91.6 mm-40 -68.26 124.58 23.87 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.246 -0.909 . . . . 0.0 109.422 179.84 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 23.4 mmm180 -130.72 -24.28 2.46 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.402 -0.811 . . . . 0.0 109.185 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 56.4 tttp -44.2 108.86 0.12 Allowed 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.374 -0.829 . . . . 0.0 110.101 -179.719 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 77.2 mt-10 -85.31 89.79 7.75 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.161 -0.962 . . . . 0.0 109.411 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 88.3 t80 . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 117.976 -1.011 . . . . 0.0 109.418 179.932 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.59 HD12 ' N ' ' A' ' 1' ' ' LEU . 8.6 mp . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.311 -0.625 . . . . 0.0 109.311 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 73.4 tttt 51.35 -127.33 2.39 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.299 -0.876 . . . . 0.0 109.405 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -68.6 116.71 9.44 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.155 -0.966 . . . . 0.0 109.488 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 26.1 t -75.54 -8.86 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.227 -0.921 . . . . 0.0 109.492 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 90.3 t90 -144.17 134.71 24.75 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.247 -0.908 . . . . 0.0 109.321 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -167.93 111.96 0.65 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.215 -0.928 . . . . 0.0 109.357 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -167.53 137.38 2.78 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.222 -0.923 . . . . 0.0 109.79 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.9 tp -105.01 -31.68 9.09 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.565 -0.709 . . . . 0.0 109.191 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 -68.84 76.01 0.3 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.221 -0.925 . . . . 0.0 109.532 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -149.35 58.65 0.45 Allowed Glycine 0 N--CA 1.495 2.587 0 N-CA-C 109.576 -1.409 . . . . 0.0 109.576 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 35.5 mt 46.11 53.39 9.32 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.286 -1.126 . . . . 0.0 109.809 179.76 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.98 152.64 76.5 Favored Pre-proline 0 N--CA 1.489 1.521 0 O-C-N 121.187 -0.946 . . . . 0.0 108.698 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -54.94 -42.92 64.45 Favored 'Trans proline' 0 C--N 1.321 -0.894 0 C-N-CA 120.989 1.126 . . . . 0.0 109.62 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -84.52 44.08 1.02 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.237 -0.914 . . . . 0.0 109.223 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.542 HH11 ' CG ' ' A' ' 15' ' ' ARG . 0.3 OUTLIER -53.56 133.74 41.14 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.378 -0.827 . . . . 0.0 109.623 -179.947 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -170.14 -36.38 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.295 -0.878 . . . . 0.0 109.451 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 50.22 68.6 3.27 Favored Pre-proline 0 N--CA 1.49 1.549 0 O-C-N 121.26 -0.9 . . . . 0.0 109.68 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -63.9 -21.97 68.81 Favored 'Trans proline' 0 C--N 1.318 -1.051 0 C-N-CA 121.402 1.401 . . . . 0.0 109.895 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -58.26 -37.38 74.83 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.165 -0.959 . . . . 0.0 110.801 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 52.7 m -71.52 -40.98 69.75 Favored 'General case' 0 C--N 1.307 -1.263 0 O-C-N 120.742 -1.224 . . . . 0.0 110.565 -178.568 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -55.85 -35.16 66.12 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.88 -1.137 . . . . 0.0 107.969 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -68.2 -33.3 74.18 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.423 -0.798 . . . . 0.0 109.268 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.505 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 96.7 mt -73.13 -61.51 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.217 0 O-C-N 120.882 -1.136 . . . . 0.0 108.992 179.603 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.515 ' O ' HD13 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -44.37 -27.69 0.46 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.889 -1.132 . . . . 0.0 110.725 -179.644 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.528 ' N ' ' ND1' ' A' ' 25' ' ' HIS . 0.2 OUTLIER -90.21 -13.73 34.91 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.142 -1.599 . . . . 0.0 110.31 179.887 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.505 ' OD1' ' O ' ' A' ' 23' ' ' ILE . 20.3 p-10 -74.45 62.37 0.99 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.779 -1.2 . . . . 0.0 109.553 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 64.4 mt -48.83 -52.06 10.48 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 O-C-N 120.929 -1.107 . . . . 0.0 110.977 -179.198 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.402 ' O ' ' C ' ' A' ' 29' ' ' SER . 52.0 t-20 -90.1 12.47 17.71 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.818 -1.176 . . . . 0.0 110.056 -179.459 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.402 ' C ' ' O ' ' A' ' 28' ' ' ASN . 26.5 p 42.23 50.91 4.55 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.261 -0.9 . . . . 0.0 110.699 178.683 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.408 ' OD1' ' O ' ' A' ' 30' ' ' ASP . 10.9 t70 -95.04 -3.89 47.45 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.03 -1.044 . . . . 0.0 108.53 179.365 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.61 4.51 87.72 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 -179.643 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.78 164.19 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 O-C-N 121.177 -1.19 . . . . 0.0 108.876 178.521 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.0 mp -115.43 121.06 41.61 Favored 'General case' 0 N--CA 1.518 2.934 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 177.255 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.544 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 0.2 OUTLIER -105.68 172.91 6.55 Favored 'General case' 0 N--CA 1.505 2.286 0 CA-C-O 121.766 0.794 . . . . 0.0 111.108 -177.82 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -53.92 -40.6 66.84 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.493 -0.755 . . . . 0.0 112.156 -178.635 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.3 pp0? -61.88 -24.45 66.94 Favored 'General case' 0 C--N 1.295 -1.764 0 O-C-N 120.161 -1.587 . . . . 0.0 108.717 -179.799 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -81.09 -40.89 23.41 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.12 -0.987 . . . . 0.0 109.653 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.49 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 6.4 mt -75.81 -30.41 59.02 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.885 -1.134 . . . . 0.0 108.716 178.544 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -60.72 -46.2 91.32 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 120.887 -1.133 . . . . 0.0 108.699 178.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.44 -29.58 62.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.455 -0.778 . . . . 0.0 110.706 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -72.67 -25.76 61.38 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.057 -1.027 . . . . 0.0 110.248 -178.919 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.49 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 38.1 m-85 -80.67 -49.27 11.45 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 120.862 -1.149 . . . . 0.0 109.732 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 28.2 m -59.39 -48.7 80.65 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.142 -0.974 . . . . 0.0 111.266 -178.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 12.8 ptpt -66.71 -41.26 88.24 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.811 -1.181 . . . . 0.0 111.674 -177.77 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -56.86 -28.22 61.45 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 120.304 -1.498 . . . . 0.0 108.466 -179.054 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.4 mt -85.9 -26.38 25.63 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.363 -0.836 . . . . 0.0 110.163 179.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.5 1.17 1.26 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 120.966 -1.084 . . . . 0.0 110.552 -178.633 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.3 pttp -120.87 42.15 3.11 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.289 -0.882 . . . . 0.0 110.873 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -171.77 -38.45 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 120.669 -1.27 . . . . 0.0 110.6 178.057 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -95.07 -12.23 26.91 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.839 -1.163 . . . . 0.0 109.556 -179.635 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.534 ' C ' ' H ' ' A' ' 53' ' ' LYS . 0.5 OUTLIER 50.58 75.86 0.61 Allowed Pre-proline 0 N--CA 1.49 1.548 0 O-C-N 121.086 -1.009 . . . . 0.0 109.661 179.618 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -65.82 13.39 0.12 Allowed 'Trans proline' 0 C--N 1.318 -1.051 0 C-N-CA 121.612 1.541 . . . . 0.0 110.367 -179.697 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.534 ' H ' ' C ' ' A' ' 51' ' ' ASP . 5.1 mtmp? -107.21 -31.68 8.13 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.489 -0.757 . . . . 0.0 109.403 179.912 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.418 ' OD1' ' O ' ' A' ' 51' ' ' ASP . 52.2 p30 -66.6 12.33 0.07 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.375 -0.828 . . . . 0.0 109.951 179.533 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.604 ' O ' ' N ' ' A' ' 57' ' ' ASP . 36.2 mt-10 49.82 -147.48 0.33 Allowed 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.0 -1.063 . . . . 0.0 109.505 179.462 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 56.83 -70.76 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.94 -0.475 . . . . 0.0 110.076 179.46 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.634 ' C ' ' H ' ' A' ' 59' ' ' MET . 25.3 t70 -76.52 81.0 3.21 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.113 -0.992 . . . . 0.0 109.442 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -56.62 12.17 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.565 -0.709 . . . . 0.0 110.77 -179.526 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.634 ' H ' ' C ' ' A' ' 57' ' ' ASP . 68.8 mmm 56.4 16.26 2.36 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.082 -1.011 . . . . 0.0 109.296 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 28.7 ttm180 -97.42 -49.61 4.84 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.452 -0.78 . . . . 0.0 109.155 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -55.58 -50.91 68.83 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.996 -1.065 . . . . 0.0 110.588 -179.015 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.529 ' O ' ' N ' ' A' ' 64' ' ' GLU . 0.2 OUTLIER -72.2 -3.97 26.57 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.994 -1.066 . . . . 0.0 110.929 -178.548 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.428 ' C ' ' O ' ' A' ' 62' ' ' MET . 15.4 pt-20 -38.09 -26.13 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.662 -0.649 . . . . 0.0 110.296 -179.636 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.529 ' N ' ' O ' ' A' ' 62' ' ' MET . 75.5 mm-40 -56.41 -24.0 41.96 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.285 -0.884 . . . . 0.0 109.457 179.447 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -76.88 -46.48 24.38 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.209 -0.932 . . . . 0.0 109.775 -179.654 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 37.4 mtm180 -52.95 -45.14 67.57 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.155 -0.966 . . . . 0.0 108.983 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 30.1 mt -68.92 -27.67 65.97 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.203 -0.936 . . . . 0.0 109.586 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.3 -41.04 94.5 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.289 -0.882 . . . . 0.0 109.526 -179.62 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.9 mtt -85.8 -50.11 7.4 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.944 -1.098 . . . . 0.0 109.382 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.547 HH11 ' CG ' ' A' ' 70' ' ' ARG . 0.9 OUTLIER -56.1 -45.16 79.55 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.027 -1.045 . . . . 0.0 110.669 -179.703 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -75.55 -52.36 10.8 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.0 -1.063 . . . . 0.0 111.146 -178.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 13.8 t60 -55.49 -39.77 70.86 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.062 -1.024 . . . . 0.0 110.455 -179.249 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 72.1 t -71.87 -53.79 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 120.654 -1.279 . . . . 0.0 109.782 -179.687 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.439 ' O ' ' OD1' ' A' ' 78' ' ' ASP . 3.0 mmt -64.67 -15.5 61.41 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.242 -0.911 . . . . 0.0 110.335 -179.694 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -93.86 -38.78 11.05 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.719 -1.238 . . . . 0.0 111.084 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ASN . . . . . 0.466 ' OD1' ' N ' ' A' ' 77' ' ' VAL . 29.7 p-10 -100.61 -26.24 13.89 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 120.947 -1.096 . . . . 0.0 112.039 -178.178 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.466 ' N ' ' OD1' ' A' ' 76' ' ' ASN . 40.3 t -90.63 -36.14 7.97 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.279 0 O-C-N 120.268 -1.52 . . . . 0.0 109.197 179.637 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.576 ' OD2' ' NE2' ' A' ' 81' ' ' GLN . 10.0 p-10 -49.27 109.49 0.27 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.808 -1.182 . . . . 0.0 108.659 178.534 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.603 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -86.94 -64.18 1.19 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.994 -1.066 . . . . 0.0 110.318 -177.567 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.427 ' N ' ' OG1' ' A' ' 79' ' ' THR . 17.9 p-10 -102.41 16.28 26.73 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.244 -0.91 . . . . 0.0 109.574 -179.651 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.576 ' NE2' ' OD2' ' A' ' 78' ' ' ASP . 26.5 mm-40 42.96 74.0 0.13 Allowed 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.495 -0.753 . . . . 0.0 111.09 178.127 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.581 ' C ' ' H ' ' A' ' 84' ' ' LEU . 38.9 t0 -129.45 18.36 5.84 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 178.313 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 78.2 mtt180 61.88 -4.71 0.18 Allowed 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 -178.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.581 ' H ' ' C ' ' A' ' 82' ' ' ASP . 9.8 mt -124.26 134.45 53.23 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 75.0 t -109.91 129.42 64.87 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.529 -0.732 . . . . 0.0 109.083 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 65.4 p -101.79 162.15 13.13 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.195 -0.941 . . . . 0.0 109.187 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.8 tp -63.8 -37.64 88.12 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.561 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -58.33 -68.72 0.23 Allowed 'General case' 0 C--N 1.293 -1.872 0 O-C-N 121.468 -0.77 . . . . 0.0 110.894 -178.124 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.603 ' CB ' HG21 ' A' ' 79' ' ' THR . 8.3 mm-40 -61.95 -30.55 70.99 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.324 -0.86 . . . . 0.0 110.863 -178.368 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -64.26 -51.6 62.8 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.763 -1.21 . . . . 0.0 109.539 -179.681 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.485 ' O ' ' N ' ' A' ' 95' ' ' GLN . 67.4 mt -49.12 -44.31 42.26 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.224 -0.923 . . . . 0.0 109.224 179.399 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -51.16 -58.81 5.15 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.326 -0.859 . . . . 0.0 110.054 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 43.2 t -45.61 -29.99 1.38 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.135 -0.978 . . . . 0.0 109.968 -179.481 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 29.9 p -95.86 -58.61 2.05 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.241 -0.912 . . . . 0.0 108.856 179.323 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.485 ' N ' ' O ' ' A' ' 91' ' ' LEU . 11.1 tt0 -41.59 -48.55 4.04 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.544 -0.723 . . . . 0.0 110.472 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.448 ' CA ' ' HE ' ' A' ' 96' ' ' ARG . 0.0 OUTLIER -55.96 87.87 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.841 -1.162 . . . . 0.0 109.536 -179.861 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.484 ' N ' ' O ' ' A' ' 95' ' ' GLN . 88.6 tttt -45.53 113.18 0.55 Allowed 'General case' 0 N--CA 1.486 1.354 0 O-C-N 121.268 -0.895 . . . . 0.0 109.843 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 54.5 tt0 -58.34 92.77 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.169 -0.957 . . . . 0.0 109.524 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 69.9 t80 . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 118.0 -1.0 . . . . 0.0 109.412 179.864 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 17.1 mt . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 54.9 mttp -148.55 67.81 1.07 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.266 -0.896 . . . . 0.0 109.345 -179.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -168.64 134.37 1.75 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.301 -0.874 . . . . 0.0 109.322 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 23.2 t -147.02 -20.01 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 O-C-N 121.293 -0.88 . . . . 0.0 109.418 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 72.7 t-105 -56.57 113.32 1.57 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.181 -0.95 . . . . 0.0 109.388 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -78.79 53.04 1.3 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.308 -0.87 . . . . 0.0 109.633 -179.737 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.462 ' CD ' HH22 ' A' ' 15' ' ' ARG . 43.1 mt-10 52.62 -163.43 0.08 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.3 -0.875 . . . . 0.0 109.14 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.7 pp -159.04 133.63 7.98 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.22 -0.925 . . . . 0.0 109.492 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -89.46 77.96 7.21 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.218 -0.926 . . . . 0.0 109.624 -179.837 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -163.86 -28.01 0.02 OUTLIER Glycine 0 N--CA 1.491 2.319 0 C-N-CA 119.621 -1.276 . . . . 0.0 109.951 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.3 mt -149.23 60.48 1.04 Allowed 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.21 -1.171 . . . . 0.0 108.685 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -74.85 148.99 85.32 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 120.981 -1.074 . . . . 0.0 109.307 -179.382 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_endo -62.62 -37.69 55.94 Favored 'Trans proline' 0 C--N 1.324 -0.741 0 C-N-CA 121.199 1.266 . . . . 0.0 109.715 179.357 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.506 ' CG ' ' H ' ' A' ' 15' ' ' ARG . 19.0 t30 -140.21 -114.56 0.14 Allowed 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.404 -0.81 . . . . 0.0 109.293 -179.212 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.506 ' H ' ' CG ' ' A' ' 14' ' ' ASN . 97.4 mtt180 52.95 -173.28 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.644 -1.285 . . . . 0.0 109.513 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -62.83 156.56 23.69 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.31 -0.869 . . . . 0.0 109.993 -179.51 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 25.4 p30 -159.75 66.38 2.73 Favored Pre-proline 0 N--CA 1.491 1.602 0 O-C-N 121.305 -0.872 . . . . 0.0 109.295 179.633 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -64.82 -17.19 58.74 Favored 'Trans proline' 0 C--N 1.318 -1.066 0 C-N-CA 121.535 1.49 . . . . 0.0 110.299 -179.451 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 43.4 tttm -57.48 -36.84 71.98 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.247 -0.908 . . . . 0.0 110.767 -179.269 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.4 m -69.13 -39.37 78.92 Favored 'General case' 0 C--N 1.306 -1.291 0 O-C-N 120.804 -1.185 . . . . 0.0 110.091 -179.125 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.419 ' CE2' ' CD2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -56.72 -40.5 75.78 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.091 -1.006 . . . . 0.0 108.508 -179.951 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -64.11 -36.28 83.51 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.358 -0.839 . . . . 0.0 110.583 -179.318 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.415 ' O ' ' N ' ' A' ' 26' ' ' ASP . 84.0 mt -73.96 -61.33 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.247 0 O-C-N 120.71 -1.244 . . . . 0.0 109.323 -179.586 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 34.9 tp -46.31 -30.78 2.2 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.098 -1.001 . . . . 0.0 110.743 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.419 ' CD2' ' CE2' ' A' ' 21' ' ' PHE . 1.1 m80 -84.75 -14.73 47.38 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.27 -1.519 . . . . 0.0 109.424 179.537 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.415 ' N ' ' O ' ' A' ' 23' ' ' ILE . 95.0 m-20 -74.81 94.18 2.73 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.151 -0.968 . . . . 0.0 108.895 179.131 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.413 HD13 HG21 ' A' ' 27' ' ' ILE . 25.7 mt -76.64 -51.6 18.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.346 0 O-C-N 121.414 -0.804 . . . . 0.0 110.964 -178.736 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 50.6 t-20 -87.65 7.91 27.81 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 120.753 -1.217 . . . . 0.0 110.03 -179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 24.8 p 44.03 48.88 7.41 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.165 -0.959 . . . . 0.0 110.528 178.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.511 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 19.6 p-10 -91.98 0.01 57.48 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.128 -0.982 . . . . 0.0 108.489 179.1 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 79.28 -2.77 69.51 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 109.791 -1.324 . . . . 0.0 109.791 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -138.61 164.16 26.83 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 O-C-N 121.286 -1.126 . . . . 0.0 108.673 178.374 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.7 tp -113.92 110.04 19.46 Favored 'General case' 0 N--CA 1.511 2.576 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 177.549 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.72 -176.09 5.13 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.472 -0.768 . . . . 0.0 110.751 -177.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -73.46 -44.49 57.96 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.523 -0.736 . . . . 0.0 111.372 -178.761 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.449 ' NE2' ' CG ' ' A' ' 37' ' ' GLU . 1.5 pp0? -59.29 -25.0 63.75 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 120.455 -1.403 . . . . 0.0 108.323 -179.768 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.449 ' CG ' ' NE2' ' A' ' 36' ' ' GLN . 49.5 mt-10 -85.02 -33.68 22.47 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 179.126 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.4 tp -74.65 -32.27 62.22 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.42 -0.8 . . . . 0.0 109.283 179.108 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.24 -46.51 60.9 Favored 'General case' 0 C--N 1.305 -1.342 0 O-C-N 121.28 -0.888 . . . . 0.0 109.733 -179.524 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.53 -35.51 73.2 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.103 -0.998 . . . . 0.0 110.514 -179.305 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.6 mt -69.3 -25.76 64.39 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.938 -1.101 . . . . 0.0 109.325 -179.758 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.412 ' CZ ' ' SD ' ' A' ' 69' ' ' MET . 0.1 OUTLIER -81.58 -51.81 7.86 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 120.881 -1.137 . . . . 0.0 109.781 -179.13 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 68.6 m -69.4 -47.08 65.29 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.218 -0.926 . . . . 0.0 111.345 -178.392 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 18.4 ttpt -74.6 -47.5 32.01 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.018 -1.051 . . . . 0.0 111.811 -177.715 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -57.22 -29.38 63.69 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.224 -1.548 . . . . 0.0 109.708 -179.044 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.483 ' C ' ' H ' ' A' ' 48' ' ' LYS . 12.6 tp -71.87 -24.1 61.62 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.232 -0.918 . . . . 0.0 109.844 -179.58 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -56.48 -5.48 0.21 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.297 -0.877 . . . . 0.0 109.232 179.292 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.483 ' H ' ' C ' ' A' ' 46' ' ' LEU . 39.2 mttp -108.65 37.36 2.54 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.368 -0.833 . . . . 0.0 109.86 -179.516 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 85.3 t -151.01 -60.09 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 O-C-N 121.04 -1.038 . . . . 0.0 109.67 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 40.8 m-85 -79.71 -20.32 46.75 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.14 -0.975 . . . . 0.0 109.753 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 48.81 73.73 0.94 Allowed Pre-proline 0 N--CA 1.493 1.695 0 O-C-N 120.76 -1.212 . . . . 0.0 109.554 179.168 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -60.78 174.59 1.62 Allowed 'Trans proline' 0 C--N 1.315 -1.207 0 C-N-CA 121.308 1.339 . . . . 0.0 110.026 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.503 ' CG ' ' H ' ' A' ' 54' ' ' ASN . 0.0 OUTLIER -150.46 -90.55 0.07 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.546 -0.721 . . . . 0.0 109.224 -179.816 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.503 ' H ' ' CG ' ' A' ' 53' ' ' LYS . 14.4 p30 -165.75 90.46 0.46 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.185 -0.947 . . . . 0.0 109.447 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -143.5 -177.86 5.6 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.285 -0.884 . . . . 0.0 109.492 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 80.0 mt-10 -81.54 -13.2 58.37 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.323 -0.861 . . . . 0.0 109.789 -179.661 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.533 ' O ' ' N ' ' A' ' 59' ' ' MET . 77.2 m-20 -102.53 44.81 0.99 Allowed 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.315 -0.866 . . . . 0.0 109.135 179.791 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -42.78 90.26 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.684 -0.635 . . . . 0.0 110.741 -179.129 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.533 ' N ' ' O ' ' A' ' 57' ' ' ASP . 61.2 mtp 53.3 50.37 17.73 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.548 -0.72 . . . . 0.0 109.104 -179.717 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.575 ' O ' ' N ' ' A' ' 62' ' ' MET . 42.2 ttm180 -122.55 -59.56 1.61 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.67 -0.644 . . . . 0.0 109.394 -179.58 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -41.54 -16.54 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.092 -1.005 . . . . 0.0 111.193 -178.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.575 ' N ' ' O ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -116.3 3.44 13.37 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.239 -0.913 . . . . 0.0 110.122 179.794 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.493 ' N ' ' SD ' ' A' ' 62' ' ' MET . 1.8 tt0 -42.8 -17.77 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.438 -0.789 . . . . 0.0 109.674 -178.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 62' ' ' MET . 50.9 mt-10 -59.37 -56.74 18.15 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.309 -0.87 . . . . 0.0 109.175 179.104 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -58.3 -38.38 76.94 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.27 -0.894 . . . . 0.0 109.675 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.422 ' CG ' HH11 ' A' ' 66' ' ' ARG . 0.0 OUTLIER -53.51 -51.8 61.64 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.361 -0.837 . . . . 0.0 109.915 -179.767 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.633 HD12 ' C ' ' A' ' 67' ' ' LEU . 0.6 OUTLIER -79.68 -27.34 40.78 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.228 -0.92 . . . . 0.0 110.037 -179.149 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -62.05 -39.27 91.8 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.98 -1.075 . . . . 0.0 109.883 -179.347 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' MET . . . . . 0.412 ' SD ' ' CZ ' ' A' ' 42' ' ' PHE . 17.8 ttm -86.11 -33.02 21.02 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.05 -1.031 . . . . 0.0 109.859 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 66.4 ttt180 -65.07 -30.33 71.28 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.593 -1.317 . . . . 0.0 109.363 179.17 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 67.0 mt-10 -77.81 -48.18 17.14 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.205 -0.934 . . . . 0.0 109.975 -179.588 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.519 ' CD2' ' OD1' ' A' ' 76' ' ' ASN . 29.4 t60 -59.63 -35.15 73.81 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.16 -0.962 . . . . 0.0 110.007 -179.488 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 69.6 t -74.47 -54.17 15.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 120.708 -1.245 . . . . 0.0 109.381 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.486 ' SD ' ' OD2' ' A' ' 78' ' ' ASP . 2.7 mmt -58.78 -22.41 58.15 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.087 -1.008 . . . . 0.0 109.298 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.8 ttpt -94.4 -27.66 15.93 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.801 -1.187 . . . . 0.0 110.759 -179.237 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ASN . . . . . 0.519 ' OD1' ' CD2' ' A' ' 72' ' ' HIS . 12.9 m120 -105.95 -12.1 15.94 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.159 -0.963 . . . . 0.0 112.643 -177.897 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 57.3 t -118.13 -34.86 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.533 0 O-C-N 120.372 -1.455 . . . . 0.0 111.397 -178.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.486 ' OD2' ' SD ' ' A' ' 74' ' ' MET . 0.9 OUTLIER -67.15 99.48 0.68 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.241 -1.537 . . . . 0.0 107.574 178.929 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.417 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -80.77 -52.25 7.73 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.213 -0.93 . . . . 0.0 111.891 -177.476 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.529 ' O ' ' N ' ' A' ' 82' ' ' ASP . 9.5 t-20 -99.63 24.1 8.69 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.061 -1.024 . . . . 0.0 109.532 -179.406 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.443 ' C ' ' H ' ' A' ' 83' ' ' ARG . 31.2 mm-40 32.95 30.51 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.754 0 CA-C-O 120.985 0.421 . . . . 0.0 112.062 178.697 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.545 ' C ' ' H ' ' A' ' 84' ' ' LEU . 87.0 m-20 -81.03 10.6 4.95 Favored 'General case' 0 C--N 1.299 -1.613 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 178.406 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.443 ' H ' ' C ' ' A' ' 81' ' ' GLN . 25.3 mtp180 65.12 -4.03 0.55 Allowed 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 -178.391 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.545 ' H ' ' C ' ' A' ' 82' ' ' ASP . 4.6 mp -118.48 134.47 55.05 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 178.834 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 88.9 t -112.3 129.39 67.91 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.076 0 O-C-N 121.617 -0.677 . . . . 0.0 109.541 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 22.0 p -103.36 167.22 9.95 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.262 -0.898 . . . . 0.0 108.722 178.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.726 HD13 ' C ' ' A' ' 87' ' ' LEU . 1.2 tm? -65.15 -35.47 81.21 Favored 'General case' 0 C--N 1.297 -1.705 0 O-C-N 121.383 -0.823 . . . . 0.0 108.782 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -61.75 -70.06 0.21 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.946 -1.096 . . . . 0.0 112.811 -178.738 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.417 ' CB ' HG21 ' A' ' 79' ' ' THR . 1.7 mt-10 -59.37 -32.66 70.33 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.773 -1.204 . . . . 0.0 110.914 -177.289 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -58.83 -50.92 72.16 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.92 -1.113 . . . . 0.0 109.901 -179.366 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.434 ' O ' ' N ' ' A' ' 95' ' ' GLN . 78.7 mt -52.78 -48.94 66.49 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 120.924 -1.11 . . . . 0.0 109.602 179.472 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -46.66 -44.69 18.7 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.27 -0.894 . . . . 0.0 110.077 -179.52 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 46.5 m -62.41 -30.66 71.38 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.279 -0.888 . . . . 0.0 110.266 -179.309 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 44.6 p -95.94 -57.6 2.32 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.018 -1.051 . . . . 0.0 109.081 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.434 ' N ' ' O ' ' A' ' 91' ' ' LEU . 91.8 mt-30 -50.99 118.17 3.01 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.176 -0.953 . . . . 0.0 109.187 179.6 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -169.21 55.39 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.197 -0.939 . . . . 0.0 109.138 -179.871 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 87.3 mttt 52.61 40.53 30.23 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.291 -0.881 . . . . 0.0 109.343 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 54.18 59.95 3.89 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.259 -0.9 . . . . 0.0 109.335 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.445 ' O ' ' CD2' ' A' ' 99' ' ' PHE . 61.5 t80 . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 117.979 -1.01 . . . . 0.0 109.534 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.576 HD12 ' N ' ' A' ' 1' ' ' LEU . 9.4 mp . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -80.67 83.48 6.43 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.194 -0.942 . . . . 0.0 109.472 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.443 ' N ' ' CD ' ' A' ' 3' ' ' GLU . 5.9 mp0 -64.37 -166.16 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.251 -0.906 . . . . 0.0 109.471 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 37.1 t -56.45 -34.72 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.164 -0.96 . . . . 0.0 109.425 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 66.5 m95 -60.7 163.63 5.37 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.319 -0.863 . . . . 0.0 109.484 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -168.42 96.24 0.4 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.163 -0.96 . . . . 0.0 109.454 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 53.0 -109.66 0.49 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.425 -0.797 . . . . 0.0 109.087 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.467 ' C ' ' H ' ' A' ' 10' ' ' GLY . 0.4 OUTLIER -153.39 36.49 0.47 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.247 -0.908 . . . . 0.0 109.488 179.783 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 65.6 -4.51 0.58 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.411 -0.806 . . . . 0.0 109.403 -179.525 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.467 ' H ' ' C ' ' A' ' 8' ' ' LEU . . . 59.73 60.13 9.28 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 17.1 mt -70.56 51.61 0.13 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.258 -1.142 . . . . 0.0 108.88 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.429 ' N ' ' O ' ' A' ' 10' ' ' GLY . 35.5 t0 -170.22 70.98 0.6 Allowed Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.339 -0.851 . . . . 0.0 108.81 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.447 ' O ' ' N ' ' A' ' 15' ' ' ARG . 3.2 Cg_exo -57.23 -16.03 20.62 Favored 'Trans proline' 0 C--N 1.315 -1.189 0 C-N-CA 121.197 1.265 . . . . 0.0 110.241 -178.187 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.452 HD22 ' C ' ' A' ' 14' ' ' ASN . 0.3 OUTLIER -68.37 68.19 0.13 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.259 -0.901 . . . . 0.0 109.359 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.447 ' N ' ' O ' ' A' ' 13' ' ' PRO . 33.9 ptt180 -158.31 -158.73 0.74 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.346 -0.846 . . . . 0.0 109.404 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.404 ' O ' ' O ' ' A' ' 15' ' ' ARG . 83.4 m-85 -54.96 -172.29 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.245 -0.909 . . . . 0.0 109.636 -179.89 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 63.6 t-20 49.07 63.17 10.86 Favored Pre-proline 0 N--CA 1.49 1.569 0 O-C-N 121.33 -0.856 . . . . 0.0 110.059 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -65.93 -21.92 56.44 Favored 'Trans proline' 0 C--N 1.319 -0.975 0 C-N-CA 121.588 1.525 . . . . 0.0 110.033 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 69.7 tttt -57.3 -35.85 70.35 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.216 -0.928 . . . . 0.0 110.887 -179.283 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.4 m -71.01 -41.24 71.15 Favored 'General case' 0 C--N 1.306 -1.303 0 O-C-N 120.785 -1.197 . . . . 0.0 110.272 -178.67 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.482 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.37 -36.91 69.36 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.042 -1.036 . . . . 0.0 108.487 -179.835 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.482 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 36.4 t80 -67.15 -34.81 78.37 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.335 -0.853 . . . . 0.0 110.135 -179.614 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.1 mt -74.54 -61.18 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.241 0 O-C-N 120.731 -1.23 . . . . 0.0 109.39 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.3 tp -46.57 -37.57 8.24 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.066 -1.021 . . . . 0.0 110.811 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.408 ' N ' ' ND1' ' A' ' 25' ' ' HIS . 0.6 OUTLIER -75.99 -18.26 59.37 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.367 -1.458 . . . . 0.0 109.709 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -75.98 90.67 3.01 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.131 -0.981 . . . . 0.0 108.783 179.323 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.41 HD13 HG21 ' A' ' 27' ' ' ILE . 13.9 mt -71.23 -52.26 28.28 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 O-C-N 121.319 -0.863 . . . . 0.0 110.801 -178.64 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 12.5 m-20 -84.08 11.6 7.72 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.831 -1.168 . . . . 0.0 109.83 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.0 t 43.88 43.76 5.41 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.222 -0.924 . . . . 0.0 110.373 178.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -87.35 -3.41 59.03 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.009 -1.057 . . . . 0.0 108.819 179.611 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.38 -0.34 75.42 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -142.42 161.5 19.2 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 O-C-N 121.196 -1.179 . . . . 0.0 108.783 178.621 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.6 mp -113.12 131.74 55.72 Favored 'General case' 0 N--CA 1.517 2.91 0 N-CA-C 107.764 -1.198 . . . . 0.0 107.764 177.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 39.8 p-10 -106.51 174.2 5.99 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 121.371 -0.831 . . . . 0.0 109.934 -179.22 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -59.63 -7.69 1.63 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.431 -0.793 . . . . 0.0 110.088 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 44.7 mm-40 -85.29 -40.22 16.83 Favored 'General case' 0 C--N 1.297 -1.706 0 O-C-N 121.052 -1.03 . . . . 0.0 109.845 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -67.79 -33.03 74.01 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.157 -0.964 . . . . 0.0 109.56 -179.644 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.459 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 1.4 mt -80.45 -38.48 29.95 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.958 -1.089 . . . . 0.0 109.38 179.192 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.49 ' N ' ' OE1' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -59.76 -41.81 91.88 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.882 -1.137 . . . . 0.0 108.794 179.481 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.07 -29.21 61.76 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.236 -0.915 . . . . 0.0 111.142 -179.204 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.49 ' O ' HD23 ' A' ' 41' ' ' LEU . 0.8 OUTLIER -76.76 -26.63 54.75 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 120.896 -1.127 . . . . 0.0 110.819 -178.654 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.459 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 28.9 m-85 -80.49 -49.19 11.71 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 120.42 -1.425 . . . . 0.0 108.929 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 53.5 m -64.04 -39.35 93.9 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.245 -0.909 . . . . 0.0 110.277 -179.858 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 28.2 ttpt -74.92 -47.58 28.98 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.199 -0.938 . . . . 0.0 111.404 -178.528 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -53.68 -28.86 36.01 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.719 -1.238 . . . . 0.0 109.849 -178.831 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 21.1 mt -78.13 -24.63 47.32 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.119 -0.988 . . . . 0.0 109.973 -179.797 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -78.09 -2.6 38.14 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 120.828 -1.17 . . . . 0.0 110.272 -179.087 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.507 ' NZ ' ' CB ' ' A' ' 48' ' ' LYS . 6.4 mtmp? -113.57 26.05 10.73 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.072 -1.018 . . . . 0.0 109.891 -179.519 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 57.3 t -149.14 -48.14 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 121.11 -0.994 . . . . 0.0 109.654 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.578 ' CZ ' ' SD ' ' A' ' 62' ' ' MET . 68.7 m-85 -83.48 -24.85 31.59 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.972 -1.08 . . . . 0.0 109.214 179.714 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 12.9 t70 63.05 69.19 0.87 Allowed Pre-proline 0 N--CA 1.502 2.141 0 O-C-N 121.36 -0.838 . . . . 0.0 109.969 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -60.27 178.29 0.45 Allowed 'Trans proline' 0 C--N 1.315 -1.204 0 C-N-CA 121.312 1.342 . . . . 0.0 109.565 179.726 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 16.2 mtmt -120.32 -91.46 0.56 Allowed 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.521 -0.737 . . . . 0.0 109.587 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -179.46 96.59 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.015 -1.053 . . . . 0.0 109.013 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -145.03 179.23 7.49 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.174 -0.954 . . . . 0.0 109.43 -179.856 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 64.5 mt-10 -53.36 -92.8 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.11 -0.994 . . . . 0.0 109.016 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.567 ' C ' ' H ' ' A' ' 59' ' ' MET . 30.1 t70 -135.59 26.56 3.4 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.13 -0.981 . . . . 0.0 109.462 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -62.49 14.39 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.059 -1.025 . . . . 0.0 110.451 -179.692 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.567 ' H ' ' C ' ' A' ' 57' ' ' ASP . 0.0 OUTLIER -80.55 -4.71 55.01 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.755 -1.215 . . . . 0.0 108.129 179.256 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.4 ' O ' ' CG ' ' A' ' 63' ' ' GLU . 30.3 ttp180 -45.37 -39.16 6.56 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.629 -0.669 . . . . 0.0 109.673 179.842 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.582 ' C ' ' H ' ' A' ' 63' ' ' GLU . 63.2 mm-40 -61.27 167.12 3.34 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 120.688 -1.257 . . . . 0.0 108.73 179.746 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.578 ' SD ' ' CZ ' ' A' ' 50' ' ' TYR . 9.3 tpt 56.56 -10.9 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.319 -0.863 . . . . 0.0 111.282 179.456 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.582 ' H ' ' C ' ' A' ' 61' ' ' GLU . 15.8 pt-20 -60.87 2.97 0.09 Allowed 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.498 -1.376 . . . . 0.0 110.105 -179.705 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.484 ' H ' ' C ' ' A' ' 62' ' ' MET . 59.1 mt-10 -67.33 -44.12 79.89 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.035 -1.041 . . . . 0.0 110.506 -179.231 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.4 tp10 -69.54 -27.36 65.09 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.905 -1.122 . . . . 0.0 109.698 -179.333 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -53.8 -37.66 63.74 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.13 -0.981 . . . . 0.0 108.581 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 25.0 mt -79.45 -28.72 41.62 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.459 -0.776 . . . . 0.0 109.303 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -65.42 -37.24 86.36 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.211 -0.93 . . . . 0.0 109.677 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 13.7 mtt -85.34 -37.93 19.36 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.922 -1.111 . . . . 0.0 109.677 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.536 HH11 ' CG ' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -66.25 -51.88 53.17 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.022 -1.049 . . . . 0.0 110.393 -179.386 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -69.85 -51.55 32.43 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.152 -0.967 . . . . 0.0 110.934 -178.805 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.491 ' CE1' ' OD1' ' A' ' 76' ' ' ASN . 62.0 t-80 -55.73 -42.03 74.77 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.921 -1.112 . . . . 0.0 110.516 -178.792 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 77.4 t -73.05 -54.21 16.37 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 120.645 -1.285 . . . . 0.0 109.804 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.462 ' SD ' ' NH1' ' A' ' 70' ' ' ARG . 37.2 mtp -65.36 -19.67 66.05 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.971 -1.081 . . . . 0.0 110.264 -179.098 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.5 ttpp -94.79 -32.66 13.2 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.727 -1.233 . . . . 0.0 110.237 -179.535 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ASN . . . . . 0.491 ' OD1' ' CE1' ' A' ' 72' ' ' HIS . 6.3 m120 -100.57 -8.79 22.64 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.203 -0.936 . . . . 0.0 111.792 -178.464 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 85.5 t -117.13 -38.04 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.539 0 O-C-N 120.593 -1.317 . . . . 0.0 110.376 179.253 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.401 ' OD2' ' O ' ' A' ' 74' ' ' MET . 83.9 m-20 -49.47 112.38 0.63 Allowed 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.606 -1.309 . . . . 0.0 108.983 178.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.59 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -87.58 -59.24 2.3 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.284 -0.885 . . . . 0.0 110.41 -177.903 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.403 ' O ' ' C ' ' A' ' 81' ' ' GLN . 46.8 t30 -103.43 25.53 9.51 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.309 -0.869 . . . . 0.0 109.447 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.403 ' C ' ' O ' ' A' ' 80' ' ' ASN . 33.3 mm-40 34.63 48.22 0.29 Allowed 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.054 0.454 . . . . 0.0 112.146 178.363 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.578 ' C ' ' H ' ' A' ' 84' ' ' LEU . 12.8 p-10 -99.72 15.33 27.16 Favored 'General case' 0 N--CA 1.495 1.809 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 178.463 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.449 HH11 ' HG3' ' A' ' 83' ' ' ARG . 10.5 mtm-85 63.06 -2.83 0.38 Allowed 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 -178.345 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.578 ' H ' ' C ' ' A' ' 82' ' ' ASP . 4.8 mp -125.62 135.3 52.03 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 179.524 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 70.2 t -112.81 129.71 67.94 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.083 0 O-C-N 121.552 -0.718 . . . . 0.0 109.615 -178.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 68.8 p -98.1 163.01 12.93 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.225 -0.922 . . . . 0.0 109.13 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.733 HD13 ' C ' ' A' ' 87' ' ' LEU . 1.4 tm? -66.04 -38.61 88.81 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 179.823 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -59.38 -69.71 0.19 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.344 -0.848 . . . . 0.0 111.456 -179.607 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.59 ' CB ' HG21 ' A' ' 79' ' ' THR . 33.5 mm-40 -57.24 -30.07 64.31 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.101 -0.999 . . . . 0.0 110.36 -178.495 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -61.5 -51.22 69.56 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.024 -1.048 . . . . 0.0 110.076 -179.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.526 ' O ' ' N ' ' A' ' 95' ' ' GLN . 92.4 mt -52.81 -44.98 67.03 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.984 -1.073 . . . . 0.0 109.354 179.294 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -46.9 -49.68 20.0 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.185 -0.947 . . . . 0.0 109.911 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 41.9 m -60.5 -26.27 66.7 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.249 -0.907 . . . . 0.0 110.179 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.451 ' OG1' ' N ' ' A' ' 95' ' ' GLN . 26.4 p -102.37 -63.4 1.16 Allowed 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.213 -0.929 . . . . 0.0 110.047 -179.544 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.526 ' N ' ' O ' ' A' ' 91' ' ' LEU . 13.8 tp60 -48.12 -60.42 2.65 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.154 -0.966 . . . . 0.0 109.897 -179.482 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.564 ' CG ' HH11 ' A' ' 96' ' ' ARG . 0.0 OUTLIER -48.79 -35.73 15.06 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.868 -1.145 . . . . 0.0 110.03 -179.402 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -54.29 -19.93 6.22 Favored 'General case' 0 N--CA 1.484 1.266 0 O-C-N 120.868 -1.145 . . . . 0.0 109.851 -179.547 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 53.9 tt0 -72.79 77.1 1.13 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.245 -0.909 . . . . 0.0 109.407 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 55.6 t80 . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 118.012 -0.994 . . . . 0.0 109.472 179.953 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.542 HD12 ' N ' ' A' ' 1' ' ' LEU . 9.7 mp . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp 54.22 63.64 2.1 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.429 -0.794 . . . . 0.0 109.663 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.51 ' OE2' ' CH2' ' A' ' 5' ' ' TRP . 6.8 pt-20 -70.94 70.16 0.49 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.386 -0.821 . . . . 0.0 109.065 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 58.8 t -71.92 102.09 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.339 -0.851 . . . . 0.0 109.878 -179.685 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.51 ' CH2' ' OE2' ' A' ' 3' ' ' GLU . 8.2 m0 -90.96 92.22 8.66 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.187 -0.945 . . . . 0.0 109.578 179.628 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 55.67 87.38 0.05 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.316 -0.865 . . . . 0.0 110.147 179.453 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.404 ' O ' ' O ' ' A' ' 8' ' ' LEU . 72.8 mt-10 52.82 175.48 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.451 -0.781 . . . . 0.0 109.892 179.527 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.404 ' O ' ' O ' ' A' ' 7' ' ' GLU . 24.0 mt 60.39 157.61 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.065 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 -179.357 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -73.78 -25.99 60.42 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.78 -1.2 . . . . 0.0 109.312 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 177.7 -73.81 0.07 OUTLIER Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.817 -1.313 . . . . 0.0 109.817 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 31.7 mt -132.43 109.02 9.53 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.538 -0.978 . . . . 0.0 109.868 -179.664 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.445 ' OD1' ' N ' ' A' ' 12' ' ' ASP . 19.9 p-10 -90.59 147.45 36.39 Favored Pre-proline 0 N--CA 1.493 1.711 0 O-C-N 121.288 -0.882 . . . . 0.0 108.678 179.249 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.474 ' C ' ' H ' ' A' ' 15' ' ' ARG . 4.9 Cg_endo -61.38 -29.13 85.06 Favored 'Trans proline' 0 N--CA 1.48 0.68 0 C-N-CA 121.349 1.366 . . . . 0.0 110.593 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -71.55 32.57 0.05 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.967 -1.083 . . . . 0.0 110.218 -179.037 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.474 ' H ' ' C ' ' A' ' 13' ' ' PRO . 3.2 ptm180 -59.91 174.99 0.42 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.07 -1.019 . . . . 0.0 109.054 179.587 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 51.8 p90 -170.44 142.23 2.09 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.07 -1.019 . . . . 0.0 109.843 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 50.8 t-20 -170.07 65.24 0.5 Allowed Pre-proline 0 N--CA 1.489 1.52 0 O-C-N 121.277 -0.889 . . . . 0.0 109.954 179.708 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -65.35 -22.44 59.94 Favored 'Trans proline' 0 C--N 1.319 -1.009 0 C-N-CA 121.509 1.473 . . . . 0.0 109.698 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -56.24 -36.07 68.09 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.352 -0.842 . . . . 0.0 110.991 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 69.9 m -73.17 -41.64 63.65 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 120.687 -1.258 . . . . 0.0 110.617 -178.595 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -56.39 -35.02 67.27 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.919 -1.113 . . . . 0.0 108.184 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -69.25 -34.96 75.6 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.323 -0.861 . . . . 0.0 109.836 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.485 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.9 mt -69.89 -59.69 3.25 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.157 0 O-C-N 120.798 -1.189 . . . . 0.0 109.006 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 tp -44.49 -36.39 2.92 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.353 -0.842 . . . . 0.0 110.735 -179.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.509 ' N ' ' ND1' ' A' ' 25' ' ' HIS . 0.3 OUTLIER -80.57 -14.19 58.42 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.391 -1.443 . . . . 0.0 109.536 179.758 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.485 ' N ' ' O ' ' A' ' 23' ' ' ILE . 82.1 m-20 -78.34 93.29 4.65 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.174 -0.954 . . . . 0.0 109.236 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 75.5 mt -77.3 -51.8 17.78 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.437 0 O-C-N 121.407 -0.808 . . . . 0.0 110.65 -178.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.528 ' ND2' ' OD2' ' A' ' 30' ' ' ASP . 10.1 p30 -88.18 -3.12 58.92 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.917 -1.115 . . . . 0.0 110.234 -179.41 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.442 ' O ' ' OG ' ' A' ' 29' ' ' SER . 4.5 t 52.86 57.83 5.96 Favored 'General case' 0 C--N 1.295 -1.796 0 O-C-N 121.263 -0.898 . . . . 0.0 110.402 179.111 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.528 ' OD2' ' ND2' ' A' ' 28' ' ' ASN . 79.9 m-20 -99.9 7.17 45.08 Favored 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 72.88 5.47 64.93 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.876 -1.29 . . . . 0.0 109.876 -179.54 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -144.18 164.85 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.985 0 O-C-N 121.196 -1.179 . . . . 0.0 108.565 177.658 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 tp -112.81 128.6 56.48 Favored 'General case' 0 N--CA 1.512 2.643 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 178.61 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 40.0 p-10 -104.91 163.04 12.82 Favored 'General case' 0 N--CA 1.504 2.265 0 CA-C-O 121.896 0.855 . . . . 0.0 110.606 -178.432 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.596 ' CD ' ' H ' ' A' ' 35' ' ' GLU . 1.7 mp0 -57.73 -8.95 1.03 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.911 -0.493 . . . . 0.0 111.069 -179.216 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 41.1 mm-40 -85.12 -36.64 20.98 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.765 -1.209 . . . . 0.0 109.548 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -81.12 -34.9 32.22 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 179.404 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.4 tp -72.75 -42.02 64.51 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.614 -0.679 . . . . 0.0 110.029 179.494 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -71.85 -34.03 68.93 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.553 -1.342 . . . . 0.0 108.892 179.401 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.3 -28.63 62.2 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.256 -0.902 . . . . 0.0 110.285 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.428 ' O ' HD23 ' A' ' 41' ' ' LEU . 0.7 OUTLIER -70.63 -31.2 68.07 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.913 -1.117 . . . . 0.0 109.855 -179.111 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -77.8 -47.98 17.63 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 120.509 -1.37 . . . . 0.0 109.812 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 54.3 m -57.45 -44.24 84.62 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.069 -1.02 . . . . 0.0 111.321 -178.769 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.8 mtmt -74.46 -47.9 30.66 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.894 -1.129 . . . . 0.0 111.959 -177.658 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -57.55 -27.9 63.05 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 120.459 -1.401 . . . . 0.0 110.069 -178.573 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.455 ' C ' ' H ' ' A' ' 48' ' ' LYS . 24.1 mt -70.14 -25.68 63.59 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.849 -1.157 . . . . 0.0 109.646 -179.731 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.408 ' OE2' ' O ' ' A' ' 47' ' ' GLU . 0.1 OUTLIER -65.31 3.76 0.61 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.042 -1.036 . . . . 0.0 109.67 -179.845 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.455 ' H ' ' C ' ' A' ' 46' ' ' LEU . 7.7 mtmp? -106.86 -1.95 21.88 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.239 -0.913 . . . . 0.0 109.673 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 61.7 t -114.88 -59.15 3.28 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 121.535 -0.728 . . . . 0.0 109.641 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -83.5 -159.77 0.38 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.107 -0.996 . . . . 0.0 109.376 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.407 ' OD1' ' O ' ' A' ' 51' ' ' ASP . 18.5 p30 -147.23 66.22 10.03 Favored Pre-proline 0 N--CA 1.494 1.772 0 O-C-N 121.262 -0.899 . . . . 0.0 109.414 179.824 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -64.53 174.4 4.42 Favored 'Trans proline' 0 C--N 1.318 -1.04 0 C-N-CA 121.55 1.5 . . . . 0.0 109.762 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.454 ' C ' ' H ' ' A' ' 55' ' ' GLU . 23.0 mtmt -97.58 51.79 1.08 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.305 -0.872 . . . . 0.0 109.026 179.51 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.429 ' O ' ' OE2' ' A' ' 55' ' ' GLU . 43.3 t-20 57.76 5.28 0.33 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.367 -0.833 . . . . 0.0 109.51 -179.756 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.454 ' H ' ' C ' ' A' ' 53' ' ' LYS . 69.9 mm-40 -140.38 129.35 23.38 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.343 -0.848 . . . . 0.0 109.223 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.444 ' CG ' HH22 ' A' ' 66' ' ' ARG . 2.4 mp0 -66.4 95.82 0.33 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.144 -0.972 . . . . 0.0 109.369 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -170.65 46.53 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.19 -0.944 . . . . 0.0 109.457 179.785 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -171.6 -0.39 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.272 -0.893 . . . . 0.0 109.386 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 58.6 mtp -98.64 3.56 47.87 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.105 -0.997 . . . . 0.0 109.018 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.57 ' O ' ' N ' ' A' ' 62' ' ' MET . 68.6 ttt180 -45.16 -54.91 6.28 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.432 -0.792 . . . . 0.0 109.729 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.598 ' H ' ' CD ' ' A' ' 61' ' ' GLU . 16.8 mp0 -43.45 -12.78 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.442 -0.786 . . . . 0.0 111.368 -178.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.57 ' N ' ' O ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -134.99 5.59 3.33 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 120.871 -1.143 . . . . 0.0 109.811 -179.909 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -47.85 -12.1 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.295 -0.878 . . . . 0.0 109.116 179.366 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.527 ' N ' ' O ' ' A' ' 62' ' ' MET . 13.3 mp0 -63.17 -28.92 70.38 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.214 -0.929 . . . . 0.0 110.035 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -69.56 -49.09 57.56 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.012 -1.055 . . . . 0.0 109.815 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ARG . . . . . 0.444 HH22 ' CG ' ' A' ' 56' ' ' GLU . 47.8 mtt180 -48.27 -38.35 18.51 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.366 -0.834 . . . . 0.0 109.753 -179.292 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.901 ' O ' HD12 ' A' ' 67' ' ' LEU . 0.0 OUTLIER -82.68 -33.09 27.78 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.024 -1.048 . . . . 0.0 109.832 -178.936 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.4 tpp180 -63.8 -38.82 92.53 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.111 -0.993 . . . . 0.0 110.009 -179.101 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 4.0 mtt -83.65 -51.12 7.55 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.068 -1.02 . . . . 0.0 109.272 179.841 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 29.1 ttp180 -51.07 -41.05 59.67 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.842 -1.161 . . . . 0.0 109.79 179.175 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -74.91 -52.52 11.05 Favored 'General case' 0 C--N 1.305 -1.343 0 O-C-N 120.841 -1.162 . . . . 0.0 111.166 -178.276 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.457 ' CD2' ' OD1' ' A' ' 76' ' ' ASN . 23.5 t60 -55.95 -36.85 68.24 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.92 -1.112 . . . . 0.0 110.059 -179.587 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 78.9 t -75.56 -55.32 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 120.68 -1.263 . . . . 0.0 109.798 -179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 35.7 mtp -62.48 -18.06 61.01 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.304 -0.872 . . . . 0.0 109.889 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 43.3 tttp -94.01 -37.66 11.55 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.656 -1.277 . . . . 0.0 109.929 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ASN . . . . . 0.457 ' OD1' ' CD2' ' A' ' 72' ' ' HIS . 11.9 m120 -98.23 -11.05 23.09 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.146 -0.971 . . . . 0.0 112.05 -178.15 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 64.5 t -111.26 -35.76 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.559 0 O-C-N 120.458 -1.401 . . . . 0.0 109.911 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -57.88 109.46 0.73 Allowed 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.477 -1.39 . . . . 0.0 108.123 177.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.543 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -85.06 -55.15 4.2 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.173 -0.955 . . . . 0.0 111.102 -178.158 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.527 ' O ' ' N ' ' A' ' 82' ' ' ASP . 23.9 m120 -101.95 25.15 9.02 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.231 -0.918 . . . . 0.0 109.687 -179.442 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.419 ' C ' ' H ' ' A' ' 83' ' ' ARG . 27.4 mm-40 33.83 29.37 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 178.609 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.527 ' N ' ' O ' ' A' ' 80' ' ' ASN . 19.8 p-10 -81.36 9.98 6.36 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 178.428 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.454 HH11 ' HG3' ' A' ' 83' ' ' ARG . 8.4 mtm-85 66.86 -5.43 0.66 Allowed 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 -178.731 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.523 ' H ' ' C ' ' A' ' 82' ' ' ASP . 13.6 mt -116.81 134.89 54.23 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 107.583 -1.265 . . . . 0.0 107.583 178.661 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 82.0 t -111.49 129.92 65.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.976 0 O-C-N 121.576 -0.703 . . . . 0.0 109.948 -178.732 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 31.9 p -105.53 159.87 15.61 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.695 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.6 tp -60.92 -36.78 80.18 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.382 -0.824 . . . . 0.0 109.223 179.645 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -60.18 -69.56 0.21 Allowed 'General case' 0 C--N 1.295 -1.788 0 O-C-N 121.254 -0.904 . . . . 0.0 111.495 -177.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.543 ' CB ' HG21 ' A' ' 79' ' ' THR . 14.3 mm-40 -60.42 -30.31 69.53 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.161 -0.962 . . . . 0.0 110.334 -178.396 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -64.91 -51.95 59.12 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.874 -1.142 . . . . 0.0 109.893 -179.708 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 57.3 mt -48.25 -44.87 33.78 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.142 -0.974 . . . . 0.0 109.294 179.651 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -54.69 -60.3 3.54 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.403 -0.811 . . . . 0.0 110.497 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.0 t -42.44 -35.17 0.97 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.445 -0.784 . . . . 0.0 111.349 -178.273 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 50.7 p -84.28 -51.06 7.3 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 120.671 -1.268 . . . . 0.0 108.767 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 44.5 mm-40 -53.02 126.03 19.2 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.008 -1.058 . . . . 0.0 108.71 179.084 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.431 ' O ' ' O ' ' A' ' 97' ' ' LYS . 0.7 OUTLIER -153.9 83.27 1.15 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.999 -1.063 . . . . 0.0 109.582 -179.508 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.431 ' O ' ' O ' ' A' ' 96' ' ' ARG . 21.5 ttpp 53.48 101.97 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.219 -0.926 . . . . 0.0 109.711 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -58.55 90.96 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.144 -0.972 . . . . 0.0 109.361 179.795 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.409 ' N ' ' O ' ' A' ' 97' ' ' LYS . 30.1 m-85 . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 117.938 -1.03 . . . . 0.0 109.399 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.575 HD12 ' N ' ' A' ' 1' ' ' LEU . 8.8 mp . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 59.7 tttm -63.29 -18.07 63.2 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.281 -0.887 . . . . 0.0 109.418 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -55.3 132.42 47.89 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.319 -0.863 . . . . 0.0 109.508 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 29.2 t -58.74 130.84 22.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.319 -0.863 . . . . 0.0 109.517 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 69.0 m95 -61.22 110.91 1.53 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.252 -0.905 . . . . 0.0 109.425 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -58.28 -175.49 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.273 -0.892 . . . . 0.0 109.281 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -168.61 72.7 0.09 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.24 -0.912 . . . . 0.0 109.412 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.0 tp -109.89 67.77 0.66 Allowed 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.566 -0.709 . . . . 0.0 109.14 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -82.75 -24.54 33.47 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.214 -0.929 . . . . 0.0 109.289 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -167.85 -37.3 0.02 OUTLIER Glycine 0 N--CA 1.489 2.196 0 N-CA-C 109.286 -1.526 . . . . 0.0 109.286 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 53.3 tp -49.05 122.87 6.32 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.29 -1.124 . . . . 0.0 108.949 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -76.39 150.3 82.39 Favored Pre-proline 0 N--CA 1.491 1.576 0 O-C-N 121.23 -0.919 . . . . 0.0 109.07 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_endo -61.44 -18.51 59.8 Favored 'Trans proline' 0 C--N 1.325 -0.678 0 C-N-CA 121.011 1.14 . . . . 0.0 110.093 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.659 ' ND2' ' CE2' ' A' ' 16' ' ' PHE . 0.4 OUTLIER -74.83 64.17 1.25 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.965 -1.084 . . . . 0.0 109.7 -179.703 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.584 HH11 ' CG ' ' A' ' 15' ' ' ARG . 0.3 OUTLIER -97.79 77.74 2.54 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.304 -0.872 . . . . 0.0 109.497 179.965 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.659 ' CE2' ' ND2' ' A' ' 14' ' ' ASN . 49.4 m-85 -58.36 145.52 37.84 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.165 -0.96 . . . . 0.0 109.304 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -171.57 68.09 0.45 Allowed Pre-proline 0 N--CA 1.492 1.633 0 O-C-N 121.303 -0.873 . . . . 0.0 109.678 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -63.95 -21.37 68.7 Favored 'Trans proline' 0 C--N 1.317 -1.081 0 C-N-CA 121.354 1.37 . . . . 0.0 109.862 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 55.8 tttp -55.41 -38.64 69.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.434 -0.791 . . . . 0.0 111.15 -179.493 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 49.4 m -70.78 -41.9 71.06 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 120.477 -1.389 . . . . 0.0 110.37 -178.683 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.514 ' CE2' ' NE2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -54.46 -44.88 72.93 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 179.761 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.421 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 20.9 t80 -57.67 -34.0 68.92 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.468 -0.77 . . . . 0.0 109.548 179.524 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.52 ' O ' ' N ' ' A' ' 25' ' ' HIS . 92.8 mt -72.41 -61.64 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 O-C-N 120.819 -1.175 . . . . 0.0 108.559 179.403 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 tp -45.48 -14.32 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.072 -1.018 . . . . 0.0 110.846 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.52 ' N ' ' O ' ' A' ' 23' ' ' ILE . 0.6 OUTLIER -104.21 -12.69 16.53 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 120.644 -1.285 . . . . 0.0 110.215 179.909 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.477 ' OD1' ' O ' ' A' ' 23' ' ' ILE . 33.7 p-10 -78.64 67.3 4.36 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.87 -1.144 . . . . 0.0 109.446 179.746 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 69.1 mt -50.53 -51.91 17.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 O-C-N 121.191 -0.943 . . . . 0.0 110.993 -179.3 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.408 ' O ' ' C ' ' A' ' 29' ' ' SER . 51.7 t-20 -89.38 12.44 16.28 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 120.721 -1.237 . . . . 0.0 110.128 -179.454 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.419 ' O ' ' OG ' ' A' ' 29' ' ' SER . 6.9 t 41.71 51.78 4.0 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.355 -0.841 . . . . 0.0 110.774 178.661 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -95.28 1.66 54.56 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.987 -1.071 . . . . 0.0 108.395 179.252 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 74.22 -0.17 54.69 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 109.453 -1.459 . . . . 0.0 109.453 -179.659 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -143.84 162.46 15.68 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 O-C-N 121.289 -1.124 . . . . 0.0 108.905 178.666 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 73.0 mt -107.94 110.76 22.58 Favored 'General case' 0 N--CA 1.513 2.715 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 177.377 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -86.17 -178.33 6.48 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.481 -0.762 . . . . 0.0 110.127 -179.2 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -73.3 -43.06 61.6 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.292 -0.88 . . . . 0.0 111.468 -178.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.439 ' NE2' ' CG ' ' A' ' 37' ' ' GLU . 1.5 pp0? -61.86 -24.57 67.0 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 120.36 -1.463 . . . . 0.0 108.589 -179.885 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.439 ' CG ' ' NE2' ' A' ' 36' ' ' GLN . 64.3 mt-10 -86.51 -32.42 20.76 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.375 -0.828 . . . . 0.0 109.069 179.312 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.0 tp -72.38 -34.96 68.33 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.343 -0.848 . . . . 0.0 109.554 179.524 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -74.71 -51.18 14.97 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.315 -0.866 . . . . 0.0 110.73 -179.207 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.24 -32.99 74.8 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.924 -1.11 . . . . 0.0 110.713 -178.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 39.0 tp -74.1 -31.01 62.62 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.85 -1.156 . . . . 0.0 109.942 -179.127 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -84.01 -50.71 7.75 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 120.46 -1.4 . . . . 0.0 109.823 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 43.1 m -64.99 -42.52 94.44 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.066 -1.022 . . . . 0.0 110.447 -179.155 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.7 ttpt -72.59 -45.42 59.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.185 -0.947 . . . . 0.0 111.514 -178.221 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.2 tm-20 -53.77 -40.53 66.31 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 120.503 -1.373 . . . . 0.0 110.573 -178.679 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.6 mt -53.61 -25.25 16.69 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.871 -1.143 . . . . 0.0 110.131 -179.392 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -60.23 -24.98 65.29 Favored 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.21 -0.931 . . . . 0.0 110.018 -179.135 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 83.6 mttt -99.74 41.38 1.16 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.172 -0.955 . . . . 0.0 110.181 -179.263 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 59.2 t -150.06 -59.33 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 121.04 -1.038 . . . . 0.0 109.526 179.72 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -88.99 -131.37 0.08 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.217 -0.927 . . . . 0.0 109.905 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.521 ' C ' ' H ' ' A' ' 53' ' ' LYS . 1.7 p-10 -142.68 111.57 5.8 Favored Pre-proline 0 N--CA 1.495 1.818 0 O-C-N 121.266 -0.896 . . . . 0.0 108.61 -179.275 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -69.95 42.92 0.37 Allowed 'Trans proline' 0 C--O 1.213 -0.774 0 N-CA-C 109.662 -0.938 . . . . 0.0 109.662 -179.328 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.521 ' H ' ' C ' ' A' ' 51' ' ' ASP . 55.3 mttt 72.78 9.44 5.54 Favored 'General case' 0 N--CA 1.501 2.086 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.566 179.126 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -86.55 -15.21 40.66 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.021 -1.049 . . . . 0.0 108.817 179.117 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -157.89 132.82 8.59 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.364 -0.835 . . . . 0.0 109.467 179.306 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 49.42 -170.63 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.192 -0.943 . . . . 0.0 109.425 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -145.88 112.75 6.03 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.198 -0.939 . . . . 0.0 108.576 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -160.5 4.24 0.07 Allowed 'General case' 0 C--N 1.302 -1.5 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 179.717 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.519 ' O ' ' SD ' ' A' ' 62' ' ' MET . 0.5 OUTLIER -84.48 -11.66 55.73 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.531 -0.731 . . . . 0.0 109.046 -179.887 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.541 ' O ' ' N ' ' A' ' 62' ' ' MET . 26.3 ttm180 -97.29 -58.67 1.96 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.176 -0.953 . . . . 0.0 109.247 179.635 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.595 ' H ' ' CD ' ' A' ' 61' ' ' GLU . 24.9 mp0 -36.92 -23.53 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.689 -0.632 . . . . 0.0 112.092 -178.484 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.568 ' O ' ' N ' ' A' ' 64' ' ' GLU . 0.1 OUTLIER -109.02 4.13 22.85 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 120.971 -1.081 . . . . 0.0 110.605 -179.646 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.42 ' N ' ' SD ' ' A' ' 62' ' ' MET . 15.9 pt-20 -39.19 -23.01 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.109 0 CA-C-O 121.405 0.621 . . . . 0.0 110.154 -179.39 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.568 ' N ' ' O ' ' A' ' 62' ' ' MET . 31.3 mm-40 -67.01 -24.02 65.98 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.506 -0.747 . . . . 0.0 109.589 179.305 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -69.0 -28.0 66.2 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.255 -0.903 . . . . 0.0 110.102 -179.242 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 25.0 mtm180 -60.44 -47.99 83.7 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.172 -0.955 . . . . 0.0 109.219 -179.632 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.636 HD12 ' C ' ' A' ' 67' ' ' LEU . 0.7 OUTLIER -74.5 -27.62 60.63 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.276 -0.89 . . . . 0.0 110.075 -179.518 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.475 ' O ' ' NE ' ' A' ' 68' ' ' ARG . 8.7 tpm_? -65.71 -37.96 87.87 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.841 -1.162 . . . . 0.0 109.37 -179.697 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.6 mtt -84.16 -50.69 7.68 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.224 -0.922 . . . . 0.0 109.131 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.496 HH11 ' HG2' ' A' ' 70' ' ' ARG . 7.1 ttt-85 -52.14 -32.75 37.08 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.979 -1.076 . . . . 0.0 110.02 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 -86.42 -53.48 4.97 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 120.921 -1.112 . . . . 0.0 110.814 -178.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 11.2 t-80 -54.88 -34.6 63.17 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.911 -1.118 . . . . 0.0 110.006 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 54.6 t -74.52 -53.88 15.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 120.672 -1.267 . . . . 0.0 109.738 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.452 ' SD ' ' NH1' ' A' ' 70' ' ' ARG . 29.8 mtp -65.41 -15.67 62.84 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.065 -1.022 . . . . 0.0 110.225 -179.702 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 42.4 tttp -85.23 -37.98 19.46 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.453 -1.404 . . . . 0.0 110.526 -179.633 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ASN . . . . . 0.478 ' OD1' ' N ' ' A' ' 77' ' ' VAL . 41.4 p-10 -105.18 -24.3 12.77 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.123 -0.985 . . . . 0.0 112.558 -178.027 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.478 ' N ' ' OD1' ' A' ' 76' ' ' ASN . 34.1 t -91.18 -36.75 8.39 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.422 0 O-C-N 120.235 -1.541 . . . . 0.0 110.032 -179.362 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -66.7 105.06 1.45 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.411 -1.431 . . . . 0.0 107.606 178.098 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.41 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -83.5 -53.49 5.65 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.327 -0.858 . . . . 0.0 111.587 -177.733 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.471 ' O ' ' N ' ' A' ' 82' ' ' ASP . 43.6 m-20 -98.59 23.91 8.08 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.15 -0.968 . . . . 0.0 109.46 -179.345 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.429 ' C ' ' O ' ' A' ' 80' ' ' ASN . 33.4 mm-40 31.37 35.07 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 178.786 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.548 ' C ' ' H ' ' A' ' 84' ' ' LEU . 81.3 m-20 -84.99 12.54 7.38 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 178.532 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.531 ' CG ' HH11 ' A' ' 83' ' ' ARG . 3.9 mtt-85 65.03 -4.13 0.53 Allowed 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 -178.485 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.548 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.6 mp -119.31 133.9 55.49 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 179.157 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 92.9 t -112.85 129.54 68.29 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 O-C-N 121.643 -0.66 . . . . 0.0 110.143 -178.73 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 25.6 p -102.02 174.8 5.77 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 178.161 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -75.07 -32.8 61.57 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.999 -1.063 . . . . 0.0 109.192 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -64.05 -66.51 0.53 Allowed 'General case' 0 C--N 1.294 -1.818 0 O-C-N 120.922 -1.111 . . . . 0.0 111.514 -178.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.423 ' HG2' ' H ' ' A' ' 89' ' ' GLU . 4.2 mm-40 -59.27 -33.64 71.3 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.909 -1.12 . . . . 0.0 110.435 -177.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -66.29 -50.84 62.31 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 120.736 -1.228 . . . . 0.0 109.404 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.9 mp -46.74 -46.39 20.33 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.308 -0.87 . . . . 0.0 108.853 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -52.93 -58.31 7.37 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.221 -0.925 . . . . 0.0 110.277 -179.734 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 25.4 m -44.31 -27.47 0.43 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.239 -0.913 . . . . 0.0 109.952 -179.402 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 31.8 p -100.02 -57.97 2.02 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.314 -0.866 . . . . 0.0 108.741 179.096 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -46.49 121.89 3.75 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.268 -0.895 . . . . 0.0 109.58 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 14.0 tpt180 -170.99 65.11 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.216 -0.927 . . . . 0.0 109.546 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -45.15 110.03 0.21 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.341 -0.85 . . . . 0.0 110.003 -179.639 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -79.02 75.21 5.54 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.204 -0.935 . . . . 0.0 109.556 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 64.3 t80 . . . . . 0 N--CA 1.494 1.75 0 CA-C-O 117.998 -1.001 . . . . 0.0 109.335 -179.936 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 21.2 mt . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.535 ' O ' ' N ' ' A' ' 4' ' ' VAL . 55.8 mttp -140.92 81.89 1.81 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.274 -0.891 . . . . 0.0 109.174 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 62.25 -72.12 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.57 -0.706 . . . . 0.0 109.655 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.535 ' N ' ' O ' ' A' ' 2' ' ' LYS . 23.5 t -49.36 125.14 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.244 -0.91 . . . . 0.0 109.563 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 12.4 m-90 -74.97 -126.62 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.169 -0.957 . . . . 0.0 109.439 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -167.52 -75.54 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.149 -0.969 . . . . 0.0 109.647 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.405 ' CG ' ' N ' ' A' ' 8' ' ' LEU . 30.4 tt0 -169.68 165.32 10.09 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.2 -0.937 . . . . 0.0 109.354 -179.797 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.474 ' O ' ' N ' ' A' ' 10' ' ' GLY . 0.2 OUTLIER -144.28 101.71 3.74 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.204 -0.935 . . . . 0.0 109.134 179.787 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -63.18 77.37 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.311 -0.868 . . . . 0.0 109.604 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.474 ' N ' ' O ' ' A' ' 8' ' ' LEU . . . -151.24 38.11 0.84 Allowed Glycine 0 N--CA 1.494 2.505 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.602 HD22 ' N ' ' A' ' 11' ' ' LEU . 3.4 mm? 51.07 96.94 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.316 -1.108 . . . . 0.0 109.236 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -53.94 148.92 19.18 Favored Pre-proline 0 N--CA 1.49 1.55 0 O-C-N 121.208 -0.932 . . . . 0.0 108.963 -179.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -60.55 -46.28 18.1 Favored 'Trans proline' 0 C--N 1.323 -0.78 0 C-N-CA 120.961 1.107 . . . . 0.0 109.774 179.614 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -149.11 -54.34 0.18 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.084 -1.01 . . . . 0.0 109.536 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.436 ' HG3' HH11 ' A' ' 15' ' ' ARG . 3.4 ptm180 -49.15 134.04 18.18 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.236 -0.915 . . . . 0.0 109.587 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -82.17 -120.86 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.346 -0.847 . . . . 0.0 109.307 179.88 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -146.38 69.11 12.57 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.172 -0.955 . . . . 0.0 109.259 -179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -62.96 -20.49 71.66 Favored 'Trans proline' 0 C--N 1.319 -1.001 0 C-N-CA 121.545 1.496 . . . . 0.0 110.269 -179.415 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -55.81 -36.64 67.66 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.312 -0.868 . . . . 0.0 111.135 -179.598 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 58.4 m -74.04 -43.27 58.46 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 120.679 -1.263 . . . . 0.0 110.562 -178.539 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.502 ' CE2' ' CD2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -54.85 -33.97 62.37 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 179.909 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -69.76 -34.52 73.9 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.422 -0.799 . . . . 0.0 109.816 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 97.4 mt -71.87 -60.68 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 O-C-N 120.832 -1.167 . . . . 0.0 108.907 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 tp -46.01 -37.93 7.2 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.313 -0.867 . . . . 0.0 111.048 -179.715 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.502 ' CD2' ' CE2' ' A' ' 21' ' ' PHE . 0.3 OUTLIER -79.17 -15.11 58.57 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.433 -1.417 . . . . 0.0 110.082 -179.526 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -79.84 96.27 6.28 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.02 -1.05 . . . . 0.0 108.717 179.347 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.3 mt -74.55 -51.98 21.06 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 O-C-N 121.455 -0.778 . . . . 0.0 110.736 -178.634 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 13.0 m-20 -86.78 8.57 22.16 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.787 -1.195 . . . . 0.0 109.948 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.443 ' O ' ' OG ' ' A' ' 29' ' ' SER . 5.2 t 44.32 57.47 4.31 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.166 -0.959 . . . . 0.0 110.496 178.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -100.31 0.2 39.66 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.079 -1.013 . . . . 0.0 108.654 179.461 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.67 -2.51 67.71 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -144.31 160.22 15.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.052 -1.263 . . . . 0.0 108.621 178.052 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 17.6 mt -110.89 128.96 55.98 Favored 'General case' 0 N--CA 1.512 2.626 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.446 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.448 ' C ' ' H ' ' A' ' 36' ' ' GLN . 24.6 p-10 -105.12 166.83 10.12 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.504 -0.748 . . . . 0.0 109.643 -179.544 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -52.27 -6.34 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.578 -0.701 . . . . 0.0 110.79 -179.663 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.448 ' H ' ' C ' ' A' ' 34' ' ' ASP . 40.8 mm-40 -85.77 -42.66 14.0 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.807 -1.183 . . . . 0.0 109.862 -179.819 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -80.71 -31.18 36.23 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.0 tp -76.37 -36.82 57.95 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.43 -0.794 . . . . 0.0 109.281 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -74.62 -51.35 14.73 Favored 'General case' 0 N--CA 1.484 1.275 0 O-C-N 120.935 -1.103 . . . . 0.0 109.429 179.385 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.21 -29.53 69.87 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.325 -0.859 . . . . 0.0 110.33 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 41.6 tp -76.71 -27.7 55.57 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.167 -0.958 . . . . 0.0 110.542 -178.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -82.88 -40.06 20.75 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 120.354 -1.466 . . . . 0.0 110.006 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 17.7 m -69.94 -55.16 10.38 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.78 -1.2 . . . . 0.0 109.842 -179.55 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.4 -45.39 93.74 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.303 -0.873 . . . . 0.0 111.059 -178.401 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -60.31 -27.82 67.62 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.429 -1.419 . . . . 0.0 109.795 -179.23 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.488 ' C ' ' H ' ' A' ' 48' ' ' LYS . 11.6 tp -68.93 -23.49 64.17 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.132 -0.98 . . . . 0.0 108.644 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.58 4.12 0.11 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.421 -0.799 . . . . 0.0 109.795 178.498 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.514 ' NZ ' ' CB ' ' A' ' 48' ' ' LYS . 7.8 mtmp? -108.91 172.42 6.86 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 179.086 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.8 t 66.34 -42.32 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.259 -0.901 . . . . 0.0 109.701 -179.083 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.465 ' H ' ' C ' ' A' ' 48' ' ' LYS . 44.7 m-85 -96.35 -167.01 1.5 Allowed 'General case' 0 N--CA 1.496 1.872 0 O-C-N 120.971 -1.08 . . . . 0.0 109.586 -179.849 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.514 ' C ' ' H ' ' A' ' 53' ' ' LYS . 5.3 p-10 -142.46 73.17 20.77 Favored Pre-proline 0 N--CA 1.498 1.936 0 O-C-N 121.404 -0.81 . . . . 0.0 109.188 -179.722 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -66.66 15.72 0.11 Allowed 'Trans proline' 0 C--N 1.318 -1.035 0 C-N-CA 121.709 1.606 . . . . 0.0 110.66 -179.354 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.514 ' H ' ' C ' ' A' ' 51' ' ' ASP . 30.3 mmtp -125.7 27.42 6.45 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.467 -0.77 . . . . 0.0 109.436 -179.838 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -171.68 36.96 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.157 -0.965 . . . . 0.0 109.797 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -156.3 134.19 11.13 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.05 -1.031 . . . . 0.0 109.449 -179.737 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 75.8 mt-10 -65.91 -174.08 0.21 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.309 -0.869 . . . . 0.0 109.595 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.642 ' O ' ' N ' ' A' ' 59' ' ' MET . 8.4 m-20 58.54 88.85 0.06 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.111 -0.993 . . . . 0.0 109.523 -179.866 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.532 ' O ' ' N ' ' A' ' 60' ' ' ARG . 16.6 p-10 -42.39 80.2 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.933 0 CA-C-O 121.322 0.582 . . . . 0.0 111.672 -178.669 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.642 ' N ' ' O ' ' A' ' 57' ' ' ASP . 70.6 mtp 45.69 14.8 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.441 -0.787 . . . . 0.0 109.852 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.532 ' N ' ' O ' ' A' ' 58' ' ' ASP . 49.4 ttt180 -52.63 -54.19 36.56 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 179.462 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.522 ' C ' ' H ' ' A' ' 63' ' ' GLU . 0.8 OUTLIER -57.18 165.66 1.32 Allowed 'General case' 0 C--N 1.3 -1.553 0 O-C-N 120.553 -1.342 . . . . 0.0 107.56 178.363 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.462 ' C ' ' N ' ' A' ' 64' ' ' GLU . 14.2 tpt 61.57 -13.12 0.05 Allowed 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.236 -0.915 . . . . 0.0 110.544 -179.858 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.522 ' H ' ' C ' ' A' ' 61' ' ' GLU . 13.8 pt-20 -54.31 -11.37 0.5 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.267 -1.52 . . . . 0.0 108.383 179.373 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.462 ' N ' ' C ' ' A' ' 62' ' ' MET . 63.3 mm-40 -71.42 -62.62 1.34 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.547 -0.72 . . . . 0.0 109.379 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.474 ' OE1' ' NE ' ' A' ' 68' ' ' ARG . 4.1 tp10 -44.57 -38.69 4.39 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.651 -0.656 . . . . 0.0 109.917 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? -46.94 -35.98 7.14 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 179.664 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 33.4 mt -82.93 -26.54 31.32 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.527 -0.733 . . . . 0.0 109.619 179.302 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.474 ' NE ' ' OE1' ' A' ' 65' ' ' GLU . 1.3 tmm_? -65.9 -39.0 90.21 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.9 -1.125 . . . . 0.0 109.735 -179.304 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.7 mtt -84.97 -50.37 7.54 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.192 -0.943 . . . . 0.0 109.553 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.509 ' NH1' ' SD ' ' A' ' 74' ' ' MET . 11.0 ttt-85 -54.21 -27.85 37.07 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.759 -1.213 . . . . 0.0 110.21 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -84.27 -51.78 6.74 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 120.801 -1.187 . . . . 0.0 110.75 -179.367 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -54.28 -38.67 66.12 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.088 -1.007 . . . . 0.0 110.823 -179.472 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 55.3 t -75.09 -54.49 14.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 O-C-N 120.343 -1.473 . . . . 0.0 110.117 -179.522 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.509 ' SD ' ' NH1' ' A' ' 70' ' ' ARG . 27.5 mtp -62.81 -14.11 41.56 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.227 -0.921 . . . . 0.0 110.291 -179.137 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 42.8 tttm -89.59 -39.45 13.25 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.641 -1.287 . . . . 0.0 110.842 -178.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ASN . . . . . 0.477 ' OD1' ' N ' ' A' ' 77' ' ' VAL . 36.9 p-10 -103.61 -27.58 12.24 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.126 -0.984 . . . . 0.0 112.279 -178.053 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.477 ' N ' ' OD1' ' A' ' 76' ' ' ASN . 21.6 t -85.21 -29.29 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.233 0 O-C-N 120.144 -1.598 . . . . 0.0 109.118 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.497 ' OD2' ' NE2' ' A' ' 81' ' ' GLN . 15.2 p-10 -63.28 106.17 0.85 Allowed 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.915 -1.115 . . . . 0.0 108.462 178.52 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' THR . . . . . 0.502 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -86.72 -53.49 4.91 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.107 -1.621 . . . . 0.0 110.73 -178.542 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.577 ' ND2' ' OE1' ' A' ' 89' ' ' GLU . 31.8 m-20 -104.12 24.87 10.75 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.301 -0.874 . . . . 0.0 109.737 -179.71 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLN . . . . . 0.497 ' NE2' ' OD2' ' A' ' 78' ' ' ASP . 18.3 mm-40 34.31 30.14 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.862 0 O-C-N 122.041 -0.412 . . . . 0.0 111.932 178.362 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.552 ' C ' ' H ' ' A' ' 84' ' ' LEU . 18.5 p-10 -82.08 9.95 7.57 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.637 -1.29 . . . . 0.0 107.667 178.882 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.517 ' CG ' HH11 ' A' ' 83' ' ' ARG . 4.1 mtt-85 64.34 -4.31 0.43 Allowed 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 -178.751 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.552 ' H ' ' C ' ' A' ' 82' ' ' ASP . 6.6 mp -118.38 134.37 55.11 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 178.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 94.6 t -112.4 130.45 66.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.047 0 O-C-N 121.564 -0.71 . . . . 0.0 110.336 -178.359 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 16.9 p -105.93 166.41 10.5 Favored 'General case' 0 N--CA 1.499 1.999 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 178.327 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.9 tp -64.54 -36.63 84.84 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.273 -0.892 . . . . 0.0 109.344 179.675 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.536 ' CD ' ' H ' ' A' ' 88' ' ' GLU . 8.8 mp0 -61.49 -68.16 0.34 Allowed 'General case' 0 C--N 1.293 -1.874 0 O-C-N 120.751 -1.218 . . . . 0.0 111.806 -177.88 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLU . . . . . 0.577 ' OE1' ' ND2' ' A' ' 80' ' ' ASN . 1.0 OUTLIER -58.71 -33.66 70.44 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 120.738 -1.226 . . . . 0.0 110.479 -177.91 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -64.34 -51.39 63.6 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.865 -1.147 . . . . 0.0 108.821 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 2.7 mp -48.93 -42.71 38.13 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.789 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 89' ' ' GLU . . . -47.99 -61.38 2.0 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.257 -0.902 . . . . 0.0 109.701 179.616 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 95.1 p -48.04 -33.05 7.42 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.282 -0.886 . . . . 0.0 110.302 -179.693 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 14.2 p -98.96 14.63 28.43 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.212 -0.93 . . . . 0.0 109.483 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 4.6 mm100 -138.93 123.24 18.18 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 179.542 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.542 ' CG ' HH11 ' A' ' 96' ' ' ARG . 0.0 OUTLIER -171.04 -28.41 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.093 -1.005 . . . . 0.0 109.721 -179.786 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.7 pttt -179.09 162.82 1.26 Allowed 'General case' 0 C--N 1.307 -1.27 0 O-C-N 121.448 -0.782 . . . . 0.0 109.593 179.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.428 ' O ' ' OE2' ' A' ' 98' ' ' GLU . 0.4 OUTLIER -170.21 102.92 0.28 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.322 -0.862 . . . . 0.0 109.348 179.808 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 . . . . . 0 N--CA 1.491 1.575 0 CA-C-O 118.004 -0.998 . . . . 0.0 109.59 -179.813 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 . . . . . 0 N--CA 1.493 1.704 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -63.82 -18.69 65.0 Favored 'Trans proline' 0 C--N 1.319 -1.02 0 C-N-CA 121.519 1.479 . . . . 0.0 110.004 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -56.21 -39.61 72.75 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.331 -0.855 . . . . 0.0 111.176 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 71.9 m -70.91 -38.91 72.99 Favored 'General case' 0 C--N 1.308 -1.217 0 O-C-N 120.619 -1.301 . . . . 0.0 110.668 -178.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.426 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.04 -34.33 65.78 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 179.94 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.428 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 22.9 t80 -68.79 -35.17 76.7 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.396 -0.815 . . . . 0.0 109.665 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 97.9 mt -69.91 -60.4 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 O-C-N 120.796 -1.19 . . . . 0.0 108.974 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.7 tp -45.86 -38.6 7.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.286 -0.884 . . . . 0.0 110.709 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 25.4 m170 -78.9 -11.86 60.01 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.298 -1.501 . . . . 0.0 109.974 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.428 ' OD1' ' O ' ' A' ' 22' ' ' PHE . 55.1 m-20 -81.65 92.79 6.63 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.872 -1.142 . . . . 0.0 108.965 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.41 HD13 HG21 ' A' ' 27' ' ' ILE . 26.1 mt -75.74 -51.57 20.26 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.371 0 O-C-N 121.331 -0.856 . . . . 0.0 110.877 -178.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.528 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -87.94 12.88 12.1 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 120.876 -1.14 . . . . 0.0 110.105 -179.663 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.0 t 43.27 55.68 4.58 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.255 -0.903 . . . . 0.0 110.533 179.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 13.8 p30 -97.92 -6.23 32.7 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.117 -0.99 . . . . 0.0 108.511 179.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.85 -3.74 63.61 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 109.664 -1.375 . . . . 0.0 109.664 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -140.93 163.16 22.03 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 O-C-N 121.263 -1.14 . . . . 0.0 108.486 178.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 72.3 mt -120.47 121.53 38.68 Favored 'General case' 0 N--CA 1.515 2.819 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 178.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -103.89 179.51 4.25 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.108 -0.995 . . . . 0.0 110.18 -179.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.1 tm-20 -55.71 -14.55 2.31 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.61 -0.681 . . . . 0.0 111.232 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.538 ' NE2' ' O ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -82.68 -28.06 30.86 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.283 -1.511 . . . . 0.0 109.679 179.663 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.7 mm-40 -81.39 -37.32 28.37 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.743 -1.223 . . . . 0.0 109.411 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.536 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 2.3 mt -73.58 -32.01 63.9 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 120.992 -1.067 . . . . 0.0 108.539 178.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -59.94 -47.87 84.03 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 120.909 -1.119 . . . . 0.0 108.874 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.31 -28.92 62.35 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.267 -0.895 . . . . 0.0 110.897 -179.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.55 ' O ' HD23 ' A' ' 41' ' ' LEU . 0.8 OUTLIER -72.22 -25.77 61.77 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 120.923 -1.111 . . . . 0.0 110.227 -178.952 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.536 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 38.1 m-85 -81.5 -51.38 8.34 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.538 -1.351 . . . . 0.0 109.275 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 64.3 m . . . . . 0 N--CA 1.489 1.517 0 O-C-N 121.147 -0.97 . . . . 0.0 110.32 -179.782 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 36.1 mtm180 . . . . . 0 N--CA 1.492 1.675 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 24.6 mt -67.29 -28.21 67.82 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.124 -0.985 . . . . 0.0 109.691 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.509 ' HG2' HH11 ' A' ' 68' ' ' ARG . 0.0 OUTLIER -63.23 -37.69 88.22 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.189 -0.944 . . . . 0.0 109.552 -179.649 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 7.2 mtt -84.67 -49.72 8.27 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.194 -0.941 . . . . 0.0 109.569 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -52.35 -32.19 37.13 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.857 -1.152 . . . . 0.0 110.427 -179.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -84.13 -52.35 6.35 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.086 -1.008 . . . . 0.0 111.004 -178.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 16.3 t60 -55.33 -41.77 72.9 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.003 -1.061 . . . . 0.0 110.179 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 71.3 t -70.53 -50.48 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 120.69 -1.256 . . . . 0.0 109.203 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.435 ' O ' ' OD1' ' A' ' 78' ' ' ASP . 6.3 mmt -63.63 -19.87 65.23 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.21 -0.931 . . . . 0.0 110.23 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -99.33 -38.65 8.76 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 120.791 -1.193 . . . . 0.0 111.004 -178.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . 0.695 ' N ' HD22 ' A' ' 76' ' ' ASN . 0.7 OUTLIER -93.47 -11.75 31.33 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 120.784 -1.198 . . . . 0.0 111.985 -178.264 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 98.1 t -114.64 -33.18 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.495 0 CA-C-N 120.3 1.409 . . . . 0.0 110.313 179.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.435 ' OD1' ' O ' ' A' ' 74' ' ' MET . 10.4 p-10 -51.33 109.65 0.36 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.598 -1.313 . . . . 0.0 108.821 179.058 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.579 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -87.78 -61.93 1.61 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 120.842 -1.161 . . . . 0.0 110.032 -178.13 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.824 ' H ' HD22 ' A' ' 80' ' ' ASN . 0.1 OUTLIER -102.96 18.19 22.22 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.289 -0.882 . . . . 0.0 109.786 -179.703 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.434 ' OE1' ' OD2' ' A' ' 78' ' ' ASP . 0.2 OUTLIER 42.58 75.4 0.09 Allowed 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.485 -0.759 . . . . 0.0 111.112 178.091 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.577 ' C ' ' H ' ' A' ' 84' ' ' LEU . 28.3 t70 -131.24 16.38 5.03 Favored 'General case' 0 N--CA 1.499 1.978 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 35.1 mtm180 60.82 -3.67 0.15 Allowed 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 -178.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.577 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.0 mp -124.59 134.57 52.9 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 78.4 t -111.58 125.87 68.93 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.985 0 O-C-N 121.654 -0.654 . . . . 0.0 109.666 -178.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 62.2 p -96.88 163.35 13.01 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.188 -0.945 . . . . 0.0 108.98 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.0 tp -66.3 -36.68 83.57 Favored 'General case' 0 N--CA 1.492 1.665 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 74.8 mt-10 -60.27 -68.69 0.27 Allowed 'General case' 0 C--N 1.295 -1.779 0 O-C-N 121.62 -0.675 . . . . 0.0 110.915 -178.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.579 ' CB ' HG21 ' A' ' 79' ' ' THR . 29.8 mm-40 -59.74 -30.24 68.7 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.236 -0.915 . . . . 0.0 110.547 -178.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -64.82 -50.93 64.78 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.936 -1.103 . . . . 0.0 109.663 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 68.1 mt -49.97 -43.32 50.2 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.156 -0.965 . . . . 0.0 108.998 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -51.78 -60.95 2.59 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.222 -0.923 . . . . 0.0 110.033 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 98.8 p -45.12 -26.32 0.45 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.193 -0.942 . . . . 0.0 110.089 -179.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 23.3 p . . . . . 0 N--CA 1.499 1.997 0 O-C-N 121.328 -0.858 . . . . 0.0 109.468 179.634 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.9 m120 . . . . . 0 N--CA 1.498 1.93 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -57.7 -14.73 18.31 Favored 'Trans proline' 0 C--N 1.323 -0.806 0 C-N-CA 121.034 1.156 . . . . 0.0 110.266 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -55.9 -33.61 64.8 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.373 -0.829 . . . . 0.0 110.493 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 53.0 m -74.4 -41.81 60.28 Favored 'General case' 0 C--N 1.307 -1.268 0 O-C-N 120.89 -1.131 . . . . 0.0 110.385 -178.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.617 ' CE2' ' NE2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -55.86 -34.45 65.48 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -69.61 -36.05 75.83 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.392 -0.818 . . . . 0.0 109.791 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.471 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.7 mt -70.7 -60.48 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.232 0 O-C-N 120.711 -1.243 . . . . 0.0 109.056 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.9 tp -45.37 -36.67 4.37 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.245 -0.91 . . . . 0.0 110.692 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.617 ' NE2' ' CE2' ' A' ' 21' ' ' PHE . 0.4 OUTLIER -77.33 -15.67 59.29 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.4 -1.437 . . . . 0.0 109.451 179.787 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.471 ' N ' ' O ' ' A' ' 23' ' ' ILE . 68.6 m-20 -78.8 87.58 4.67 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.119 -0.988 . . . . 0.0 108.92 179.243 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 19.9 mt -71.4 -52.43 26.59 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 O-C-N 121.277 -0.89 . . . . 0.0 110.806 -178.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.694 ' N ' HD22 ' A' ' 28' ' ' ASN . 0.9 OUTLIER -86.38 11.6 12.0 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.826 -1.171 . . . . 0.0 109.84 -179.787 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 27.6 p 44.42 56.31 5.09 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.201 -0.937 . . . . 0.0 110.245 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.407 ' OD1' ' O ' ' A' ' 32' ' ' VAL . 41.8 p-10 -98.07 -5.94 32.78 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.236 -0.915 . . . . 0.0 108.603 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 79.97 -1.7 78.27 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.914 -1.274 . . . . 0.0 109.914 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.407 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 0.9 OUTLIER -143.59 163.55 15.71 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 121.072 -1.252 . . . . 0.0 108.545 178.412 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.451 HD21 ' OD1' ' A' ' 26' ' ' ASP . 39.7 mt -113.22 125.63 54.53 Favored 'General case' 0 N--CA 1.514 2.734 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 178.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.426 ' OD1' ' OE2' ' A' ' 37' ' ' GLU . 42.6 p-10 -103.69 173.85 6.12 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.316 -0.865 . . . . 0.0 109.73 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 61.2 mt-10 -55.8 -8.86 0.46 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.547 -0.72 . . . . 0.0 110.157 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -83.35 -43.24 16.16 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.86 -1.15 . . . . 0.0 108.786 179.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.53 ' OE1' ' N ' ' A' ' 37' ' ' GLU . 0.3 OUTLIER -70.54 -29.26 65.68 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 179.34 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.407 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 10.2 mp -83.1 -39.43 21.13 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.234 -0.916 . . . . 0.0 108.936 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -64.07 -49.58 71.76 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.788 -1.195 . . . . 0.0 108.728 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.97 -28.4 67.42 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.418 -0.801 . . . . 0.0 110.559 -179.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 32.5 tp -76.26 -28.52 57.12 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.991 -1.068 . . . . 0.0 110.88 -178.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.407 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 29.6 m-85 -74.46 -49.03 23.9 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 120.058 -1.651 . . . . 0.0 108.442 179.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 59.4 m . . . . . 0 N--CA 1.488 1.446 0 O-C-N 121.288 -0.883 . . . . 0.0 110.246 -179.915 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.518 ' CG ' HH11 ' A' ' 66' ' ' ARG . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.304 0.573 . . . . 0.0 109.711 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.63 ' C ' HD12 ' A' ' 67' ' ' LEU . 0.6 OUTLIER -73.58 -27.36 61.27 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.348 -0.845 . . . . 0.0 109.722 -179.525 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? -59.9 -39.88 86.9 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.06 -1.025 . . . . 0.0 109.387 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 10.6 mtt -86.09 -50.1 7.28 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.011 -1.055 . . . . 0.0 109.297 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 62.4 ttt180 -54.65 -46.79 74.05 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.976 -1.078 . . . . 0.0 110.761 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -74.34 -53.0 10.55 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.95 -1.094 . . . . 0.0 111.303 -178.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -54.4 -41.15 68.93 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.954 -1.091 . . . . 0.0 110.248 -179.196 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 71.9 t -73.13 -53.45 18.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 120.765 -1.209 . . . . 0.0 109.581 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.428 ' O ' ' CG ' ' A' ' 78' ' ' ASP . 28.7 mtp -64.35 -17.42 63.7 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.121 -0.987 . . . . 0.0 109.916 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 26.2 ttpt -95.73 -37.31 10.83 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 120.783 -1.198 . . . . 0.0 110.385 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . 0.707 ' N ' HD22 ' A' ' 76' ' ' ASN . 0.7 OUTLIER -98.01 -10.49 24.33 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.018 -1.051 . . . . 0.0 112.065 -178.458 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 95.1 t -114.93 -32.93 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.595 0 O-C-N 120.407 -1.433 . . . . 0.0 110.337 179.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.501 ' C ' ' NE2' ' A' ' 81' ' ' GLN . 19.0 p-10 -49.28 111.99 0.57 Allowed 'General case' 0 N--CA 1.498 1.929 0 O-C-N 120.642 -1.286 . . . . 0.0 108.645 178.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -90.06 -68.77 0.76 Allowed 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.145 -0.972 . . . . 0.0 110.645 -177.53 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.509 ' O ' ' N ' ' A' ' 82' ' ' ASP . 7.0 m120 -97.27 25.61 5.43 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.02 -1.05 . . . . 0.0 108.34 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.846 ' NE2' ' H ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER 35.19 29.12 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.087 178.106 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.509 ' N ' ' O ' ' A' ' 80' ' ' ASN . 59.7 t0 -82.81 14.59 3.13 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 178.196 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.518 HH11 ' CG ' ' A' ' 83' ' ' ARG . 4.1 mtt-85 61.87 3.69 0.97 Allowed 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -178.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.495 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.7 mp -125.2 134.24 52.44 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 71.6 t -111.69 130.5 65.16 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 O-C-N 121.618 -0.676 . . . . 0.0 109.55 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 60.1 p -103.59 165.16 11.2 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.325 -0.859 . . . . 0.0 108.859 179.057 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.8 tp -66.37 -36.05 81.88 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.246 -0.909 . . . . 0.0 108.624 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -58.05 -69.32 0.18 Allowed 'General case' 0 C--N 1.295 -1.787 0 O-C-N 121.292 -0.88 . . . . 0.0 111.123 -178.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -62.73 -30.94 71.8 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.196 -0.94 . . . . 0.0 110.903 -178.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -60.8 -51.04 71.02 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.789 -1.195 . . . . 0.0 109.39 -179.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -51.16 -48.64 61.83 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 179.124 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -44.33 -49.3 9.56 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.441 -0.787 . . . . 0.0 110.465 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 46.6 m -60.43 -29.91 69.3 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.065 -1.022 . . . . 0.0 110.558 -178.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 30.3 p . . . . . 0 N--CA 1.501 2.099 0 O-C-N 121.112 -0.992 . . . . 0.0 110.308 -179.506 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 24.5 m120 . . . . . 0 N--CA 1.492 1.628 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -59.23 -11.67 13.85 Favored 'Trans proline' 0 C--N 1.32 -0.926 0 C-N-CA 121.272 1.314 . . . . 0.0 110.252 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.1 ttpm? -57.3 -40.92 78.87 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.285 -0.885 . . . . 0.0 110.718 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 48.6 m -66.33 -39.71 89.42 Favored 'General case' 0 C--N 1.307 -1.261 0 O-C-N 120.863 -1.148 . . . . 0.0 110.248 -178.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -55.96 -34.7 65.95 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -68.77 -35.34 76.95 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.317 -0.864 . . . . 0.0 109.741 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.6 mt -72.58 -61.56 1.65 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 O-C-N 120.764 -1.21 . . . . 0.0 108.865 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.7 tp -46.38 -35.83 5.85 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.198 -0.939 . . . . 0.0 110.765 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.521 ' O ' ' ND1' ' A' ' 25' ' ' HIS . 0.9 OUTLIER -78.88 -14.57 59.16 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.46 -1.4 . . . . 0.0 109.691 -179.971 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.435 ' OD1' HD21 ' A' ' 33' ' ' LEU . 94.5 m-20 -78.97 92.9 5.0 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.98 -1.075 . . . . 0.0 108.875 179.108 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.416 HD13 HG21 ' A' ' 27' ' ' ILE . 23.1 mt -75.09 -52.28 19.24 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.322 0 O-C-N 121.235 -0.916 . . . . 0.0 110.724 -178.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.506 ' N ' HD22 ' A' ' 28' ' ' ASN . 2.2 m120 -87.42 12.69 11.54 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 120.848 -1.158 . . . . 0.0 110.086 -179.51 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.4 m 43.94 55.92 4.98 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.204 -0.935 . . . . 0.0 110.611 178.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.418 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 12.0 t70 -98.19 -3.09 38.32 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.106 -0.996 . . . . 0.0 108.66 179.357 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 75.65 0.62 63.9 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -179.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -143.41 164.53 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.235 -1.156 . . . . 0.0 108.683 178.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.435 HD21 ' OD1' ' A' ' 26' ' ' ASP . 66.0 mt -114.63 128.98 56.61 Favored 'General case' 0 N--CA 1.516 2.866 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 178.189 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 40.4 p-10 -107.96 163.88 12.75 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.297 -0.877 . . . . 0.0 109.843 -179.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.417 ' OE2' ' O ' ' A' ' 35' ' ' GLU . 0.4 OUTLIER -51.67 -11.36 0.14 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.51 -0.744 . . . . 0.0 110.379 -179.612 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.2 mm100 -82.57 -36.59 26.09 Favored 'General case' 0 C--N 1.297 -1.704 0 O-C-N 120.801 -1.187 . . . . 0.0 109.559 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -72.86 -33.6 66.21 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.086 -1.009 . . . . 0.0 109.234 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.4 mt -82.22 -36.27 27.39 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.16 -0.962 . . . . 0.0 109.249 178.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -60.83 -41.86 96.61 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 120.758 -1.213 . . . . 0.0 108.944 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.81 -29.56 62.23 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.248 -0.908 . . . . 0.0 110.515 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.545 ' O ' HD23 ' A' ' 41' ' ' LEU . 0.8 OUTLIER -76.66 -24.96 53.27 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.026 -1.046 . . . . 0.0 110.18 -179.536 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -78.91 -49.88 12.1 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.592 -1.318 . . . . 0.0 108.934 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 34.5 m . . . . . 0 N--CA 1.49 1.528 0 O-C-N 121.217 -0.927 . . . . 0.0 110.371 -179.845 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 8.2 mtm180 . . . . . 0 N--CA 1.493 1.724 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 54.2 mt -67.33 -28.13 67.72 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.229 -0.92 . . . . 0.0 110.148 -179.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 6.3 mmm180 -64.3 -42.64 96.27 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.905 -1.122 . . . . 0.0 109.758 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 4.6 mtt -84.29 -50.1 8.15 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.015 -1.053 . . . . 0.0 109.698 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -55.37 -38.06 68.36 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.064 -1.023 . . . . 0.0 110.846 -179.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -82.16 -51.84 7.57 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 120.75 -1.219 . . . . 0.0 110.764 -179.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.414 ' O ' ' ND2' ' A' ' 76' ' ' ASN . 43.8 t-80 -53.86 -37.28 63.51 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.021 -1.049 . . . . 0.0 110.099 -179.473 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 79.4 t -75.07 -54.0 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 120.703 -1.248 . . . . 0.0 109.677 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.44 ' O ' ' CG ' ' A' ' 78' ' ' ASP . 18.9 mtp -65.92 -13.66 60.11 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.221 -0.924 . . . . 0.0 110.302 -179.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -89.37 -38.93 13.77 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.357 -1.464 . . . . 0.0 110.713 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . 0.685 HD22 ' H ' ' A' ' 77' ' ' VAL . 0.0 OUTLIER -102.66 -22.53 13.95 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.106 -0.996 . . . . 0.0 112.285 -178.187 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.685 ' H ' HD22 ' A' ' 76' ' ' ASN . 42.1 t -94.69 -34.65 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 O-C-N 120.308 -1.495 . . . . 0.0 109.485 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.44 ' CG ' ' O ' ' A' ' 74' ' ' MET . 17.9 p-10 -48.64 101.7 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.864 -1.148 . . . . 0.0 109.158 178.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -76.19 -65.47 0.92 Allowed 'General case' 0 C--N 1.295 -1.781 0 O-C-N 120.975 -1.078 . . . . 0.0 110.703 -178.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.465 ' O ' ' N ' ' A' ' 82' ' ' ASP . 7.5 t-20 -105.51 25.73 10.36 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 121.185 -0.947 . . . . 0.0 109.357 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.427 ' CA ' HE21 ' A' ' 81' ' ' GLN . 0.1 OUTLIER 37.88 29.01 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 121.17 0.51 . . . . 0.0 111.092 178.929 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.534 ' C ' ' H ' ' A' ' 84' ' ' LEU . 17.3 p-10 -84.02 12.91 5.57 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 178.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 15.6 mmt180 65.09 -3.22 0.63 Allowed 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 -178.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.534 ' H ' ' C ' ' A' ' 82' ' ' ASP . 6.5 mp -122.03 134.59 54.79 Favored 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 107.289 -1.374 . . . . 0.0 107.289 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 74.5 t -113.69 131.67 64.85 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.109 0 O-C-N 121.643 -0.661 . . . . 0.0 109.691 -178.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 64.6 p -99.61 166.12 11.29 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.043 -1.035 . . . . 0.0 109.543 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.9 tp -67.3 -36.78 82.21 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 179.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.555 ' H ' ' CD ' ' A' ' 88' ' ' GLU . 13.7 mp0 -56.64 -67.62 0.29 Allowed 'General case' 0 C--N 1.294 -1.835 0 O-C-N 121.434 -0.791 . . . . 0.0 110.642 -178.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -62.84 -38.0 89.06 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.268 -0.895 . . . . 0.0 111.347 -178.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -57.06 -50.94 71.2 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.476 -1.39 . . . . 0.0 109.572 -178.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 80.4 mt -50.11 -47.74 53.78 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.102 -0.999 . . . . 0.0 109.008 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -51.06 -59.61 3.99 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.394 -0.817 . . . . 0.0 109.945 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 46.3 t -45.35 -25.93 0.46 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.138 -0.976 . . . . 0.0 110.428 -179.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 43.6 p . . . . . 0 N--CA 1.5 2.072 0 O-C-N 121.133 -0.979 . . . . 0.0 109.866 -179.794 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.671 HD22 ' N ' ' A' ' 17' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -59.37 -16.77 36.69 Favored 'Trans proline' 0 C--N 1.32 -0.937 0 C-N-CA 121.436 1.424 . . . . 0.0 111.228 -178.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 51.4 tttm -66.81 -36.53 82.6 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.906 -1.121 . . . . 0.0 111.077 -179.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.3 m -74.12 -41.6 61.34 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.617 -1.302 . . . . 0.0 110.367 -178.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.417 ' CD2' ' NE2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -55.28 -34.26 63.93 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 179.97 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -68.98 -35.96 77.32 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.347 -0.845 . . . . 0.0 109.686 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 97.2 mt -71.34 -61.07 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.225 0 O-C-N 120.827 -1.171 . . . . 0.0 109.007 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.9 tp -46.63 -38.02 9.06 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.31 -0.869 . . . . 0.0 110.751 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.417 ' NE2' ' CD2' ' A' ' 21' ' ' PHE . 0.4 OUTLIER -74.99 -16.24 60.63 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.327 -1.483 . . . . 0.0 109.712 179.871 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -78.71 91.0 4.63 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.981 -1.074 . . . . 0.0 108.527 179.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 87.5 mt -75.75 -43.04 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.35 0 O-C-N 121.421 -0.799 . . . . 0.0 110.869 -178.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.513 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -95.24 12.66 28.14 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.015 -1.053 . . . . 0.0 110.083 -179.687 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 49.9 p 43.92 53.05 6.47 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.198 -0.939 . . . . 0.0 110.519 178.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -97.19 -3.78 40.27 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.09 -1.006 . . . . 0.0 108.886 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 76.94 -1.36 63.34 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.1 156.33 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 O-C-N 121.287 -1.125 . . . . 0.0 108.298 178.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 31.1 mt -114.42 128.86 56.55 Favored 'General case' 0 N--CA 1.512 2.664 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 178.426 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.434 ' OD1' ' OE2' ' A' ' 37' ' ' GLU . 45.0 p-10 -106.21 174.27 5.96 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.31 -0.869 . . . . 0.0 110.436 -179.029 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -52.08 -11.63 0.18 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.808 -0.557 . . . . 0.0 110.12 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 4.0 mm100 -83.13 -43.0 16.7 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.884 -1.135 . . . . 0.0 109.048 179.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.527 ' OE1' ' N ' ' A' ' 37' ' ' GLU . 0.3 OUTLIER -73.48 -29.93 62.83 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.312 -0.867 . . . . 0.0 108.789 179.377 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.5 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 10.2 mp -82.13 -40.03 22.45 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.545 -0.722 . . . . 0.0 109.435 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -70.23 -37.34 74.97 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 120.831 -1.168 . . . . 0.0 109.725 -179.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.62 -28.5 61.83 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.256 -0.903 . . . . 0.0 111.028 -179.069 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 mp -76.13 -27.9 57.23 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.85 -1.156 . . . . 0.0 110.525 -178.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.5 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 8.0 m-85 -80.91 -45.38 16.84 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 120.655 -1.278 . . . . 0.0 109.545 -179.281 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 51.4 m . . . . . 0 N--CA 1.491 1.589 0 O-C-N 121.129 -0.982 . . . . 0.0 111.098 -178.983 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.1 ttm180 . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.575 ' C ' HD12 ' A' ' 67' ' ' LEU . 0.7 OUTLIER -81.7 -28.36 33.49 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.114 -0.991 . . . . 0.0 109.873 -179.629 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.8 tmm_? -60.59 -36.74 79.29 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.127 -0.983 . . . . 0.0 109.648 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 36.6 mtt -85.73 -37.47 19.33 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.063 -1.023 . . . . 0.0 109.737 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -61.75 -41.51 97.76 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.012 -1.055 . . . . 0.0 111.115 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.465 ' N ' ' CD ' ' A' ' 71' ' ' GLU . 1.3 mp0 -84.02 -52.46 6.29 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 120.965 -1.084 . . . . 0.0 111.147 -178.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 28.0 m170 -53.86 -39.81 65.97 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.894 -1.129 . . . . 0.0 110.121 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.402 ' HA ' HD21 ' A' ' 76' ' ' ASN . 72.9 t -75.12 -51.2 22.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 120.756 -1.215 . . . . 0.0 109.932 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 19.6 mtp -67.82 -14.74 63.2 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.934 -1.103 . . . . 0.0 110.094 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 23.6 ttpp -85.24 -32.55 22.54 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.373 -1.454 . . . . 0.0 110.506 -179.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . 0.665 HD22 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -111.96 -23.31 10.6 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.18 -0.95 . . . . 0.0 112.647 -177.92 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.665 ' H ' HD22 ' A' ' 76' ' ' ASN . 32.5 t -95.13 -38.25 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.49 0 O-C-N 120.458 -1.401 . . . . 0.0 110.61 -178.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.23 102.57 0.86 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.443 -1.411 . . . . 0.0 107.433 178.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.404 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -81.33 -52.8 6.91 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.356 -0.84 . . . . 0.0 111.777 -177.475 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.447 ' O ' ' N ' ' A' ' 82' ' ' ASP . 56.8 t-20 -100.0 23.46 9.82 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.199 -0.938 . . . . 0.0 109.641 -179.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.427 ' C ' ' O ' ' A' ' 80' ' ' ASN . 1.3 mm100 32.68 35.73 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 CA-C-O 121.079 0.466 . . . . 0.0 112.088 178.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.542 ' C ' ' H ' ' A' ' 84' ' ' LEU . 48.9 t0 -85.45 12.3 8.69 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 178.473 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.528 ' HG2' HH11 ' A' ' 83' ' ' ARG . 4.3 mtt-85 64.9 -4.29 0.49 Allowed 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 -178.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.542 ' H ' ' C ' ' A' ' 82' ' ' ASP . 14.7 mt -120.64 134.85 55.25 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 178.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 71.6 t -112.04 129.62 67.18 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.561 -0.712 . . . . 0.0 109.831 -178.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 32.5 p -105.63 159.15 16.19 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 178.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.2 tp -59.33 -35.6 74.14 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.41 -0.807 . . . . 0.0 109.397 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.527 ' H ' ' CD ' ' A' ' 88' ' ' GLU . 6.2 mp0 -60.7 -68.34 0.31 Allowed 'General case' 0 C--N 1.296 -1.757 0 O-C-N 121.24 -0.912 . . . . 0.0 111.828 -177.303 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.404 ' CB ' HG21 ' A' ' 79' ' ' THR . 6.3 mm-40 -63.03 -32.0 73.27 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.033 -1.042 . . . . 0.0 110.563 -177.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -61.37 -51.89 66.93 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.892 -1.13 . . . . 0.0 109.753 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 68.2 mt -50.48 -48.57 56.68 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.25 -0.906 . . . . 0.0 109.256 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -46.66 -49.43 19.27 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.304 -0.873 . . . . 0.0 109.963 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 48.3 t -56.76 -27.55 59.67 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.199 -0.938 . . . . 0.0 109.882 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 29.4 p . . . . . 0 N--CA 1.5 2.06 0 O-C-N 121.229 -0.919 . . . . 0.0 109.778 179.994 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -58.76 -15.82 28.21 Favored 'Trans proline' 0 C--N 1.319 -0.994 0 C-N-CA 121.532 1.488 . . . . 0.0 110.33 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 69.0 tttt -57.38 -36.01 70.7 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.36 -0.838 . . . . 0.0 110.824 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 38.9 m -70.27 -39.79 74.74 Favored 'General case' 0 N--CA 1.483 1.2 0 O-C-N 120.58 -1.325 . . . . 0.0 110.083 -178.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.524 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.08 -50.38 71.18 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.083 -1.081 . . . . 0.0 108.083 179.767 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.524 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 41.7 t80 -54.11 -35.16 61.85 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.539 -0.725 . . . . 0.0 110.406 -179.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.531 ' O ' ' N ' ' A' ' 25' ' ' HIS . 97.2 mt -73.9 -61.99 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.204 0 O-C-N 120.694 -1.254 . . . . 0.0 108.974 -179.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.2 tp -46.22 -12.87 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.021 -1.049 . . . . 0.0 110.898 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.531 ' N ' ' O ' ' A' ' 23' ' ' ILE . 0.7 OUTLIER -102.24 -15.77 16.52 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 120.535 -1.353 . . . . 0.0 110.205 179.952 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.492 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 58.5 p30 -75.36 70.03 2.22 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.81 -1.181 . . . . 0.0 109.362 179.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 63.7 mt -50.2 -52.34 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 O-C-N 121.297 -0.877 . . . . 0.0 110.897 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.512 ' N ' HD22 ' A' ' 28' ' ' ASN . 2.1 m120 -87.89 14.35 9.0 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 120.726 -1.234 . . . . 0.0 110.376 -179.297 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.403 ' C ' ' O ' ' A' ' 28' ' ' ASN . 8.5 t 41.37 48.27 3.23 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.217 -0.927 . . . . 0.0 110.616 178.53 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -92.9 0.69 57.46 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.948 -1.095 . . . . 0.0 108.855 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 74.82 -0.26 57.77 Favored Glycine 0 N--CA 1.487 2.046 0 N-CA-C 109.343 -1.503 . . . . 0.0 109.343 -179.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -135.97 166.11 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 O-C-N 121.429 -1.042 . . . . 0.0 108.784 178.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.41 HD21 ' CG ' ' A' ' 25' ' ' HIS . 0.1 OUTLIER -106.13 117.04 33.0 Favored 'General case' 0 N--CA 1.509 2.515 0 N-CA-C 107.44 -1.319 . . . . 0.0 107.44 177.969 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.413 ' OD1' ' N ' ' A' ' 34' ' ' ASP . 0.3 OUTLIER -90.55 165.18 13.91 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.535 -0.728 . . . . 0.0 110.361 -178.397 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -74.99 -39.84 61.03 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.541 -0.725 . . . . 0.0 110.786 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.501 ' NE2' ' C ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -63.01 -24.44 67.92 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 120.676 -1.265 . . . . 0.0 108.653 -179.779 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -84.82 -33.0 23.01 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 178.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.8 tp -75.84 -32.13 59.65 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 178.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 48.9 tt0 -67.43 -41.47 84.75 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 120.961 -1.087 . . . . 0.0 109.068 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.57 -45.42 53.44 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.271 -0.893 . . . . 0.0 110.769 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.423 HD22 ' CE1' ' A' ' 25' ' ' HIS . 39.7 tp -57.86 -23.26 52.14 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.175 -0.953 . . . . 0.0 109.619 -179.458 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -80.05 -51.22 9.29 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 120.967 -1.083 . . . . 0.0 109.057 -179.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 29.5 m . . . . . 0 N--CA 1.49 1.571 0 O-C-N 121.122 -0.986 . . . . 0.0 109.994 -179.658 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 57.9 mtt180 . . . . . 0 N--CA 1.491 1.605 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.401 ' O ' ' OE1' ' A' ' 71' ' ' GLU . 42.1 mt -74.33 -29.86 61.78 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.109 -0.994 . . . . 0.0 110.128 -178.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.7 tpp180 -74.43 -38.29 63.06 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.194 -0.941 . . . . 0.0 110.233 -178.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 30.6 mtt -86.36 -46.82 9.92 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 120.956 -1.09 . . . . 0.0 110.096 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 45.1 ttm180 -60.17 -36.98 78.81 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.858 -1.151 . . . . 0.0 110.386 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.401 ' OE1' ' O ' ' A' ' 67' ' ' LEU . 64.2 mt-10 -74.97 -47.78 27.6 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.758 -1.214 . . . . 0.0 110.32 -179.489 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.513 ' CE1' ' OD1' ' A' ' 76' ' ' ASN . 52.0 t-80 -58.04 -38.81 76.95 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.025 -1.047 . . . . 0.0 110.278 -179.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 77.9 t -71.86 -55.27 14.06 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 120.785 -1.197 . . . . 0.0 109.815 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 10.4 mtp -64.08 -21.97 66.74 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.054 -1.029 . . . . 0.0 110.107 -179.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -91.03 -32.96 15.71 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.497 -1.377 . . . . 0.0 110.252 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . 0.513 ' OD1' ' CE1' ' A' ' 72' ' ' HIS . 25.3 m120 -100.78 -9.48 21.69 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.008 -1.057 . . . . 0.0 111.691 -178.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 99.4 t -118.62 -33.59 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.515 0 O-C-N 120.667 -1.271 . . . . 0.0 110.698 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -48.94 113.78 0.86 Allowed 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.719 -1.238 . . . . 0.0 108.502 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.403 HG23 ' H ' ' A' ' 79' ' ' THR . 0.4 OUTLIER -91.23 -65.54 1.0 Allowed 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.286 -0.884 . . . . 0.0 112.422 -176.11 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -107.16 25.03 11.9 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 120.886 -1.134 . . . . 0.0 110.655 -178.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.408 HE21 ' CA ' ' A' ' 81' ' ' GLN . 0.6 OUTLIER 45.34 78.89 0.06 Allowed 'General case' 0 C--N 1.298 -1.657 0 O-C-N 121.514 -0.741 . . . . 0.0 111.679 177.52 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.558 ' C ' ' H ' ' A' ' 84' ' ' LEU . 26.3 t0 -144.81 19.17 1.64 Allowed 'General case' 0 C--N 1.296 -1.754 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 47.0 mtm180 58.15 -0.34 0.11 Allowed 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -179.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.558 ' H ' ' C ' ' A' ' 82' ' ' ASP . 1.8 mp -125.16 135.57 52.75 Favored 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 107.478 -1.304 . . . . 0.0 107.478 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 60.8 t -113.85 130.45 67.96 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.104 0 O-C-N 121.676 -0.64 . . . . 0.0 109.339 -179.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 66.9 p -94.64 163.22 13.47 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.034 -1.041 . . . . 0.0 109.386 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.737 ' C ' HD13 ' A' ' 87' ' ' LEU . 1.2 tm? -68.6 -38.58 80.73 Favored 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 108.002 -1.111 . . . . 0.0 108.002 179.723 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -60.19 -69.49 0.22 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.58 -0.7 . . . . 0.0 111.218 -179.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -56.46 -30.56 63.04 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.032 -1.042 . . . . 0.0 110.354 -178.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -62.03 -51.21 68.93 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.852 -1.155 . . . . 0.0 110.106 -179.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 89.1 mt -52.22 -38.97 59.57 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.963 -1.085 . . . . 0.0 108.963 178.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.445 ' O ' ' N ' ' A' ' 94' ' ' THR . . . -57.05 -62.75 1.53 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.266 -0.896 . . . . 0.0 109.937 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 45.9 t -44.09 -22.46 0.06 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.383 -0.823 . . . . 0.0 110.14 -179.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.445 ' N ' ' O ' ' A' ' 92' ' ' ALA . 44.4 p . . . . . 0 N--CA 1.498 1.936 0 O-C-N 121.349 -0.844 . . . . 0.0 109.785 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.541 HD22 ' C ' ' A' ' 17' ' ' ASN . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.54 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -65.29 -17.93 59.41 Favored 'Trans proline' 0 C--N 1.317 -1.081 0 C-N-CA 121.497 1.465 . . . . 0.0 110.09 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.6 tttp -57.3 -34.73 69.01 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.361 -0.837 . . . . 0.0 110.981 -179.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 47.9 m -72.17 -41.23 67.29 Favored 'General case' 0 N--CA 1.485 1.282 0 O-C-N 120.695 -1.253 . . . . 0.0 110.226 -178.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.562 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -55.86 -43.88 77.54 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.03 -1.044 . . . . 0.0 108.463 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.562 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 45.3 t80 -61.25 -35.61 77.72 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.45 -0.781 . . . . 0.0 110.355 -179.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.401 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.6 mt -73.38 -61.0 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.194 0 O-C-N 120.746 -1.221 . . . . 0.0 109.162 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 22.1 tp -46.33 -34.69 4.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.178 -0.952 . . . . 0.0 110.708 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.45 ' ND1' ' N ' ' A' ' 25' ' ' HIS . 0.3 OUTLIER -79.73 -16.05 56.37 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.314 -1.491 . . . . 0.0 109.705 179.859 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.401 ' N ' ' O ' ' A' ' 23' ' ' ILE . 10.1 t0 -78.42 92.27 4.58 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.036 -1.04 . . . . 0.0 108.798 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 6.4 mt -73.37 -49.66 35.75 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 O-C-N 121.527 -0.733 . . . . 0.0 111.123 -178.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.595 ' N ' HD22 ' A' ' 28' ' ' ASN . 1.5 m120 -88.13 8.1 28.49 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.78 -1.2 . . . . 0.0 110.344 -179.445 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.4 p 45.48 60.31 3.14 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.061 -1.024 . . . . 0.0 110.537 179.144 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -101.55 -1.78 32.11 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.286 -0.884 . . . . 0.0 108.891 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 77.59 -1.95 64.88 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.959 -1.256 . . . . 0.0 109.959 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.21 165.41 29.25 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.213 0 O-C-N 121.41 -1.053 . . . . 0.0 108.302 178.303 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.7 tp -116.93 123.17 46.32 Favored 'General case' 0 N--CA 1.513 2.708 0 N-CA-C 107.853 -1.165 . . . . 0.0 107.853 178.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.418 ' OD1' ' OE2' ' A' ' 37' ' ' GLU . 36.2 p-10 -107.77 172.87 6.59 Favored 'General case' 0 N--CA 1.509 2.493 0 CA-C-O 122.179 0.99 . . . . 0.0 111.493 -178.288 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -58.8 -10.59 2.48 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.368 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -83.03 -48.95 10.07 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.728 -1.232 . . . . 0.0 108.814 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.512 ' OE1' ' N ' ' A' ' 37' ' ' GLU . 0.3 OUTLIER -67.55 -30.26 69.85 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 179.04 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.8 tp -82.09 -33.15 29.91 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.56 -0.712 . . . . 0.0 109.375 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -72.75 -44.21 61.91 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 120.857 -1.152 . . . . 0.0 109.199 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.27 -30.26 62.04 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.266 -0.896 . . . . 0.0 111.011 -178.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 41' ' ' LEU . 40.4 mt -75.56 -21.94 57.45 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 120.836 -1.165 . . . . 0.0 109.464 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -77.48 -50.26 13.02 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.068 -1.02 . . . . 0.0 108.742 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.5 m . . . . . 0 N--CA 1.49 1.532 0 O-C-N 121.427 -0.796 . . . . 0.0 110.575 -179.266 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 29.5 mtm180 . . . . . 0 N--CA 1.491 1.622 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 33.2 mt -81.61 -28.51 33.7 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.312 -0.867 . . . . 0.0 109.636 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -72.58 -37.2 68.26 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.243 -0.91 . . . . 0.0 110.02 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 12.6 mtt -85.63 -35.39 20.99 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 120.99 -1.069 . . . . 0.0 109.567 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 64.4 ttt180 -72.0 -33.55 68.17 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.761 -1.212 . . . . 0.0 109.801 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -78.48 -46.56 19.37 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.884 -1.135 . . . . 0.0 109.923 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 42.2 t-80 -60.28 -34.3 73.56 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.153 -0.967 . . . . 0.0 110.154 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 68.9 t -75.0 -55.91 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 O-C-N 120.614 -1.304 . . . . 0.0 109.894 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 5.7 mtt -64.0 -17.45 63.33 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.953 -1.092 . . . . 0.0 110.542 -179.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.5 tptm -82.72 -39.05 22.47 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.2 -1.562 . . . . 0.0 110.436 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . 0.657 HD22 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -103.87 -21.89 13.58 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.101 -1.0 . . . . 0.0 112.483 -177.949 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.657 ' H ' HD22 ' A' ' 76' ' ' ASN . 40.5 t -94.99 -35.48 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.414 0 O-C-N 120.404 -1.435 . . . . 0.0 109.507 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -47.57 106.58 0.09 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.043 -1.035 . . . . 0.0 108.889 178.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.56 -72.52 0.33 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.267 -0.895 . . . . 0.0 113.123 -176.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.807 ' H ' HD22 ' A' ' 80' ' ' ASN . 0.0 OUTLIER -106.81 26.88 9.49 Favored 'General case' 0 N--CA 1.513 2.69 0 O-C-N 120.661 -1.274 . . . . 0.0 110.802 -177.288 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.422 HE21 ' CA ' ' A' ' 81' ' ' GLN . 0.5 OUTLIER 44.7 71.08 0.28 Allowed 'General case' 0 C--N 1.293 -1.869 0 O-C-N 121.433 -0.792 . . . . 0.0 111.185 178.37 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.549 ' C ' ' H ' ' A' ' 84' ' ' LEU . 1.1 m-20 -136.14 18.86 3.2 Favored 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 106.665 -1.606 . . . . 0.0 106.665 177.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 74.0 mtt180 60.69 -2.37 0.18 Allowed 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -178.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.549 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.9 mt -119.96 133.89 55.41 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 53.2 t -109.23 131.66 59.44 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 58.8 p -97.77 157.53 16.02 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 120.926 -1.109 . . . . 0.0 109.732 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.734 ' C ' HD13 ' A' ' 87' ' ' LEU . 0.9 OUTLIER -63.13 -36.62 84.2 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 179.425 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.545 ' H ' ' CD ' ' A' ' 88' ' ' GLU . 20.5 mp0 -58.32 -71.84 0.1 Allowed 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.612 -0.68 . . . . 0.0 112.39 -179.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -61.3 -32.49 72.34 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.882 -1.136 . . . . 0.0 110.233 -177.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -57.27 -48.71 78.18 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 120.934 -1.104 . . . . 0.0 109.258 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.454 ' O ' ' N ' ' A' ' 94' ' ' THR . 54.7 mt -52.05 -47.83 64.91 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.979 -1.076 . . . . 0.0 108.822 178.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.414 ' C ' ' O ' ' A' ' 91' ' ' LEU . . . -41.57 -57.29 2.3 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.62 -0.675 . . . . 0.0 109.923 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 40.8 t -53.08 -33.72 53.37 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.299 -0.875 . . . . 0.0 109.486 179.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.454 ' N ' ' O ' ' A' ' 91' ' ' LEU . 11.6 p . . . . . 0 N--CA 1.495 1.815 0 O-C-N 121.441 -0.787 . . . . 0.0 109.296 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.7 p-10 . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -63.55 -20.67 69.97 Favored 'Trans proline' 0 C--N 1.318 -1.031 0 C-N-CA 121.449 1.432 . . . . 0.0 110.006 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -55.28 -33.64 63.4 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.179 -0.95 . . . . 0.0 110.773 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.1 m -74.17 -41.64 61.16 Favored 'General case' 0 N--CA 1.484 1.259 0 O-C-N 120.741 -1.225 . . . . 0.0 110.429 -178.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -55.89 -34.65 65.72 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.906 -1.121 . . . . 0.0 108.301 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -70.32 -34.86 73.18 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.402 -0.811 . . . . 0.0 110.089 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.419 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.7 mt -72.4 -60.84 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 O-C-N 120.827 -1.171 . . . . 0.0 109.261 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.2 tp -45.6 -33.55 2.9 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.196 -0.94 . . . . 0.0 110.932 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 26.9 m170 -83.75 -14.41 51.59 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 120.261 -1.525 . . . . 0.0 109.66 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 23' ' ' ILE . 91.7 m-20 -75.52 94.79 3.2 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.068 -1.02 . . . . 0.0 108.916 179.143 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.411 HD13 HG21 ' A' ' 27' ' ' ILE . 28.4 mt -76.81 -49.93 22.45 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.308 0 O-C-N 121.406 -0.809 . . . . 0.0 110.955 -178.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.524 ' O ' ' ND2' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -89.55 7.12 37.9 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 120.706 -1.246 . . . . 0.0 110.106 -179.698 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 24.6 p 44.35 51.28 7.7 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.097 -1.002 . . . . 0.0 110.624 178.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -93.19 5.37 51.76 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.081 -1.012 . . . . 0.0 108.423 179.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 73.61 2.7 61.0 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.669 -1.372 . . . . 0.0 109.669 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -141.94 166.34 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 O-C-N 121.261 -1.141 . . . . 0.0 108.665 178.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.1 tp -113.93 112.36 23.2 Favored 'General case' 0 N--CA 1.512 2.631 0 N-CA-C 107.478 -1.305 . . . . 0.0 107.478 178.074 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.58 178.41 6.79 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.503 -0.748 . . . . 0.0 110.645 -178.129 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -73.53 -42.98 61.04 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.467 -0.77 . . . . 0.0 111.25 -178.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.497 ' NE2' ' C ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -60.41 -24.46 65.18 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 120.513 -1.367 . . . . 0.0 108.591 -179.732 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -85.35 -33.28 22.08 Favored 'General case' 0 N--CA 1.498 1.954 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 178.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.1 tp -71.48 -35.49 70.84 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.55 -0.719 . . . . 0.0 109.336 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -74.3 -51.58 14.8 Favored 'General case' 0 C--N 1.306 -1.32 0 O-C-N 121.163 -0.96 . . . . 0.0 110.825 -179.143 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.8 -33.66 76.38 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.879 -1.138 . . . . 0.0 110.876 -178.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 40.1 tp -73.17 -27.83 61.87 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.956 -1.09 . . . . 0.0 110.089 -179.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -82.18 -47.9 11.93 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 120.716 -1.24 . . . . 0.0 110.156 -179.347 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 18.4 m . . . . . 0 C--N 1.3 -1.583 0 O-C-N 120.942 -1.099 . . . . 0.0 110.392 -179.216 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? . . . . . 0 N--CA 1.493 1.687 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 38.2 mt -83.37 -27.27 29.79 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.629 -0.669 . . . . 0.0 109.533 179.066 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 -68.42 -36.89 79.73 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.928 -1.108 . . . . 0.0 109.682 -179.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.4 mmt -84.57 -50.76 7.41 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.033 -1.042 . . . . 0.0 109.64 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 41.4 ttp180 -54.69 -38.29 66.83 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.878 -1.139 . . . . 0.0 110.309 -179.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -78.35 -53.09 7.67 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.978 -1.077 . . . . 0.0 110.508 -179.029 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 43.1 t60 -56.42 -33.23 65.63 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.019 -1.05 . . . . 0.0 109.506 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 58.4 t -75.04 -54.69 13.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 120.734 -1.228 . . . . 0.0 109.499 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 32.0 mtp -63.58 -16.3 60.47 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.309 -0.869 . . . . 0.0 110.269 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.502 ' C ' HD22 ' A' ' 76' ' ' ASN . 42.0 tttp -95.56 -38.24 10.5 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.644 -1.285 . . . . 0.0 110.132 -179.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . 0.66 HD22 ' N ' ' A' ' 76' ' ' ASN . 0.8 OUTLIER -98.21 -11.12 23.04 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 120.975 -1.078 . . . . 0.0 112.145 -178.015 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 74.0 t -110.32 -34.87 2.53 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.45 0 O-C-N 120.467 -1.396 . . . . 0.0 109.638 179.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -59.29 104.13 0.23 Allowed 'General case' 0 N--CA 1.494 1.764 0 O-C-N 120.562 -1.336 . . . . 0.0 107.778 177.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.42 HG23 ' H ' ' A' ' 79' ' ' THR . 0.1 OUTLIER -83.16 -53.63 5.64 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.17 -0.956 . . . . 0.0 111.32 -178.22 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -101.87 24.68 9.6 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.24 -0.913 . . . . 0.0 109.666 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 33.08 37.95 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 178.579 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.568 ' C ' ' H ' ' A' ' 84' ' ' LEU . 16.5 p-10 -91.03 14.61 13.5 Favored 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 178.286 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 37.5 mtm180 64.02 -3.88 0.43 Allowed 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.568 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.4 mp -120.52 134.55 55.26 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 179.41 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 82.7 t -112.23 130.12 66.51 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.945 0 O-C-N 121.606 -0.684 . . . . 0.0 109.815 -178.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 26.4 p -103.43 162.35 13.1 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.246 -0.909 . . . . 0.0 108.667 178.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.8 tp -63.35 -35.54 80.73 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.264 -0.898 . . . . 0.0 109.063 179.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -60.73 -68.37 0.31 Allowed 'General case' 0 C--N 1.294 -1.824 0 O-C-N 121.128 -0.982 . . . . 0.0 111.623 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -61.46 -30.73 70.77 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.1 -1.0 . . . . 0.0 110.537 -178.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -64.58 -51.64 61.69 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.932 -1.105 . . . . 0.0 109.523 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 52.0 mt -48.39 -42.53 32.12 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.297 -0.877 . . . . 0.0 109.421 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -55.19 -57.77 10.43 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.064 -1.022 . . . . 0.0 110.373 -179.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 84.8 p -48.08 -61.87 1.76 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.165 -0.959 . . . . 0.0 110.951 -179.119 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.756 0 O-C-N 121.105 -0.997 . . . . 0.0 110.302 -178.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.694 ' ND2' ' H ' ' A' ' 20' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.738 -0.468 . . . . 0.0 109.738 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -65.34 -23.05 59.32 Favored 'Trans proline' 0 C--N 1.317 -1.13 0 C-N-CA 121.371 1.381 . . . . 0.0 109.761 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 55.7 tttp -56.77 -41.49 77.73 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.401 -0.812 . . . . 0.0 110.803 -179.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.694 ' H ' ' ND2' ' A' ' 17' ' ' ASN . 29.3 m -64.82 -40.18 94.78 Favored 'General case' 0 N--CA 1.485 1.321 0 O-C-N 120.76 -1.213 . . . . 0.0 110.355 -178.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -55.33 -41.82 72.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.942 -1.099 . . . . 0.0 108.263 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -62.54 -33.13 74.29 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.395 -0.816 . . . . 0.0 110.149 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.411 ' O ' ' N ' ' A' ' 25' ' ' HIS . 96.6 mt -75.84 -62.61 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 O-C-N 120.725 -1.235 . . . . 0.0 109.129 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.9 tp -47.51 -16.2 0.06 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.068 -1.02 . . . . 0.0 111.257 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.54 ' O ' ' ND1' ' A' ' 25' ' ' HIS . 0.7 OUTLIER -100.77 -15.74 17.55 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.479 -1.388 . . . . 0.0 109.833 179.896 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -76.32 89.55 3.17 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.863 -1.148 . . . . 0.0 108.462 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 10.9 mt -71.85 -52.19 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 O-C-N 121.448 -0.782 . . . . 0.0 111.134 -178.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.568 ' N ' HD22 ' A' ' 28' ' ' ASN . 1.7 m120 -86.32 4.48 38.95 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.856 -1.153 . . . . 0.0 110.029 -179.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 18.8 p 46.22 57.65 5.13 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.082 -1.011 . . . . 0.0 110.319 179.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -99.8 -0.07 40.55 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.274 -0.891 . . . . 0.0 108.737 179.4 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.85 3.76 87.84 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 110.101 -1.2 . . . . 0.0 110.101 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.12 165.35 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.121 0 O-C-N 121.16 -1.2 . . . . 0.0 108.328 178.037 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.405 HD21 ' CD2' ' A' ' 25' ' ' HIS . 4.4 tp -120.43 115.43 23.47 Favored 'General case' 0 N--CA 1.513 2.703 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 178.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.442 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 27.6 p-10 -98.29 -174.21 2.78 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.244 -0.91 . . . . 0.0 111.567 -178.1 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -72.16 -21.23 61.48 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -178.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.496 ' NE2' ' C ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -77.06 -25.86 52.89 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 120.008 -1.683 . . . . 0.0 109.349 -179.682 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -87.82 -31.84 19.36 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.946 -1.096 . . . . 0.0 108.415 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.2 tp -77.73 -33.58 52.92 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.598 -0.689 . . . . 0.0 109.17 179.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -71.85 -44.97 62.94 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.033 -1.042 . . . . 0.0 109.557 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.13 -43.45 64.66 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.043 -1.035 . . . . 0.0 111.3 -178.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.405 ' CD2' ' CD2' ' A' ' 25' ' ' HIS . 35.7 tp -62.39 -24.94 67.66 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.747 -1.221 . . . . 0.0 109.243 -179.404 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.53 -36.34 63.17 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 120.982 -1.074 . . . . 0.0 108.822 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 17.6 m . . . . . 0 C--N 1.302 -1.489 0 O-C-N 121.468 -0.77 . . . . 0.0 111.747 -178.436 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 6.4 mmm180 . . . . . 0 N--CA 1.494 1.744 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 27.3 mt -79.28 -26.88 42.28 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.276 -0.89 . . . . 0.0 110.211 -179.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.11 -39.67 82.74 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.025 -1.047 . . . . 0.0 110.368 -178.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 9.8 mtt -86.08 -48.7 8.39 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 120.906 -1.121 . . . . 0.0 110.099 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.485 ' HG2' HH11 ' A' ' 70' ' ' ARG . 2.7 ttt-85 -55.0 -36.22 65.19 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.771 -1.206 . . . . 0.0 109.767 179.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -71.91 -50.7 26.91 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 120.847 -1.158 . . . . 0.0 110.276 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 45.0 t-80 -56.23 -35.18 67.08 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.045 -1.034 . . . . 0.0 110.529 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.417 ' HA ' HD21 ' A' ' 76' ' ' ASN . 70.2 t -71.54 -55.12 14.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 120.613 -1.304 . . . . 0.0 109.776 -179.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.6 mmt -61.53 -22.13 64.87 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.228 -0.92 . . . . 0.0 110.069 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.408 ' HZ2' ' HB3' ' A' ' 75' ' ' LYS . 0.2 OUTLIER -84.34 -37.04 22.08 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.505 -1.372 . . . . 0.0 111.162 -179.141 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . 0.656 HD22 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -102.01 -24.99 13.91 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 120.961 -1.087 . . . . 0.0 112.611 -177.933 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.656 ' H ' HD22 ' A' ' 76' ' ' ASN . 32.6 t -92.86 -33.22 5.27 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.5 0 O-C-N 120.29 -1.506 . . . . 0.0 110.038 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -65.72 99.12 0.43 Allowed 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 178.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.407 HG23 ' H ' ' A' ' 79' ' ' THR . 0.1 OUTLIER -82.68 -56.86 3.6 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.077 -1.014 . . . . 0.0 112.324 -177.099 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.541 ' O ' ' N ' ' A' ' 82' ' ' ASP . 4.9 m120 -98.28 23.83 7.91 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.063 -1.023 . . . . 0.0 109.591 -178.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.469 ' C ' ' H ' ' A' ' 83' ' ' ARG . 0.2 OUTLIER 35.65 25.83 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.58 0 CA-C-N 116.31 -0.404 . . . . 0.0 112.015 178.662 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.541 ' N ' ' O ' ' A' ' 80' ' ' ASN . 81.6 m-20 -81.54 11.07 4.93 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 106.696 -1.594 . . . . 0.0 106.696 178.11 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.469 ' H ' ' C ' ' A' ' 81' ' ' GLN . 70.0 mtt180 65.72 -5.74 0.48 Allowed 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 115.131 -0.941 . . . . 0.0 108.737 -178.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.518 ' H ' ' C ' ' A' ' 82' ' ' ASP . 10.9 mt -114.35 134.04 55.25 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 107.481 -1.303 . . . . 0.0 107.481 178.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 70.4 t -112.15 129.8 66.98 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.875 0 O-C-N 121.51 -0.744 . . . . 0.0 109.391 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 17.5 p -106.17 173.88 6.12 Favored 'General case' 0 N--CA 1.5 2.07 0 N-CA-C 108.166 -1.049 . . . . 0.0 108.166 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.6 tp -69.94 -35.22 74.36 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.213 -0.929 . . . . 0.0 109.422 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -61.04 -67.9 0.36 Allowed 'General case' 0 C--N 1.291 -1.952 0 O-C-N 120.897 -1.127 . . . . 0.0 111.578 -177.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -63.12 -30.88 71.94 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.183 -0.948 . . . . 0.0 110.713 -178.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -59.72 -52.36 65.82 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.887 -1.133 . . . . 0.0 109.551 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 87.2 mt -50.79 -48.0 59.64 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.234 -0.916 . . . . 0.0 108.963 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.89 -55.12 10.6 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.39 -0.819 . . . . 0.0 110.173 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 51.1 m -57.32 -28.53 63.16 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.978 -1.076 . . . . 0.0 110.633 -178.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 29.4 p . . . . . 0 N--CA 1.501 2.118 0 O-C-N 120.993 -1.067 . . . . 0.0 109.881 -179.723 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 45.1 t-20 . . . . . 0 N--CA 1.491 1.61 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -60.03 -15.04 31.17 Favored 'Trans proline' 0 C--N 1.318 -1.055 0 C-N-CA 121.352 1.368 . . . . 0.0 110.115 -179.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 58.5 tttp -55.7 -42.2 74.9 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.496 -0.752 . . . . 0.0 111.171 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 58.5 m -69.19 -40.65 77.95 Favored 'General case' 0 N--CA 1.484 1.27 0 O-C-N 120.619 -1.301 . . . . 0.0 110.619 -178.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.615 ' CE2' ' NE2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -54.68 -33.86 61.46 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 179.883 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -69.68 -34.89 74.58 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.493 -0.755 . . . . 0.0 109.977 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.458 ' O ' ' N ' ' A' ' 26' ' ' ASP . 97.8 mt -69.36 -59.92 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 O-C-N 120.866 -1.146 . . . . 0.0 109.1 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.7 tp -44.75 -36.47 3.2 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.468 -0.77 . . . . 0.0 110.577 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.615 ' NE2' ' CE2' ' A' ' 21' ' ' PHE . 56.1 m-70 -81.25 -11.88 59.26 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.273 -1.517 . . . . 0.0 109.609 179.631 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.458 ' N ' ' O ' ' A' ' 23' ' ' ILE . 73.3 m-20 -79.91 90.68 5.34 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.02 -1.05 . . . . 0.0 108.812 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.417 HD13 HG21 ' A' ' 27' ' ' ILE . 22.2 mt -75.75 -52.61 17.68 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.354 0 O-C-N 121.283 -0.885 . . . . 0.0 110.878 -178.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.532 ' N ' HD22 ' A' ' 28' ' ' ASN . 1.9 m120 -86.69 11.22 13.49 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.844 -1.16 . . . . 0.0 109.896 -179.569 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 25.0 p 43.6 52.65 6.11 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.333 -0.855 . . . . 0.0 110.554 179.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -95.0 -2.31 50.62 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.08 -1.012 . . . . 0.0 108.332 179.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 76.79 -1.87 61.23 Favored Glycine 0 N--CA 1.488 2.166 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.442 ' O ' HD12 ' A' ' 33' ' ' LEU . 0.9 OUTLIER -143.67 164.9 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.106 0 O-C-N 121.274 -1.133 . . . . 0.0 108.605 178.541 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.442 HD12 ' O ' ' A' ' 32' ' ' VAL . 2.6 mp -121.36 125.6 47.38 Favored 'General case' 0 N--CA 1.519 3.006 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 178.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -108.03 -176.82 3.16 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.06 -1.025 . . . . 0.0 110.26 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -59.5 -13.21 8.1 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.676 -0.64 . . . . 0.0 111.042 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.547 ' NE2' ' O ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -81.17 -27.68 35.31 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.53 -1.356 . . . . 0.0 109.25 179.724 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -83.9 -37.46 22.35 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.961 -1.087 . . . . 0.0 109.652 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.537 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 1.5 mt -75.59 -30.7 59.7 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.712 -1.243 . . . . 0.0 108.476 178.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -61.73 -45.64 93.05 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 178.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.93 -28.42 61.51 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.395 -0.816 . . . . 0.0 110.733 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.405 HD23 ' O ' ' A' ' 41' ' ' LEU . 0.6 OUTLIER -73.96 -27.11 60.83 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 120.874 -1.141 . . . . 0.0 110.313 -178.983 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.537 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 37.9 m-85 -80.98 -49.91 10.35 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.677 -1.265 . . . . 0.0 108.989 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 49.0 m . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.16 -0.963 . . . . 0.0 111.169 -179.302 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.548 ' CG ' HH11 ' A' ' 66' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.525 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 22.8 mt -76.92 -27.4 54.88 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.385 -0.822 . . . . 0.0 109.87 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.524 ' CG ' HH11 ' A' ' 68' ' ' ARG . 0.0 OUTLIER -73.81 -38.1 64.69 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.023 -1.048 . . . . 0.0 109.88 -179.556 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 23.7 mtt -86.47 -41.59 14.27 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 120.673 -1.267 . . . . 0.0 109.182 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -68.3 -39.74 81.96 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.14 -0.975 . . . . 0.0 110.479 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -84.51 -51.52 6.84 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.987 -1.071 . . . . 0.0 111.419 -178.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.479 ' O ' ' ND2' ' A' ' 76' ' ' ASN . 56.9 t60 -53.76 -40.75 66.47 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.875 -1.141 . . . . 0.0 110.292 -178.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.422 ' HA ' HD21 ' A' ' 76' ' ' ASN . 69.2 t -73.94 -47.23 43.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 120.716 -1.24 . . . . 0.0 109.616 -179.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.502 ' SD ' ' OD2' ' A' ' 78' ' ' ASP . 3.4 mmt -69.5 -17.16 63.57 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.126 -0.984 . . . . 0.0 110.275 -179.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.495 ' HB3' ' HZ3' ' A' ' 75' ' ' LYS . 6.4 ttpm? -90.64 -34.64 15.36 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.362 -1.461 . . . . 0.0 111.159 -178.733 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . 0.633 HD22 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -106.37 -26.49 11.46 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 120.95 -1.094 . . . . 0.0 113.079 -177.67 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.633 ' H ' HD22 ' A' ' 76' ' ' ASN . 40.9 t -94.44 -31.03 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.551 0 O-C-N 120.286 -1.509 . . . . 0.0 110.503 -179.018 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.502 ' OD2' ' SD ' ' A' ' 74' ' ' MET . 1.6 m-20 -69.06 103.53 1.89 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 120.447 -1.408 . . . . 0.0 107.652 178.538 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.429 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -83.23 -53.19 5.95 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.217 -0.927 . . . . 0.0 111.45 -177.829 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.462 ' O ' ' N ' ' A' ' 82' ' ' ASP . 8.7 t-20 -101.16 23.92 10.18 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 121.201 -0.937 . . . . 0.0 109.578 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.411 ' C ' ' O ' ' A' ' 80' ' ' ASN . 1.3 mm100 31.63 35.97 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 178.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.552 ' C ' ' H ' ' A' ' 84' ' ' LEU . 26.2 t0 -85.27 11.9 9.15 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 178.399 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 36.0 mtm180 65.34 -4.77 0.51 Allowed 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 -178.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.552 ' H ' ' C ' ' A' ' 82' ' ' ASP . 4.4 mp -121.08 134.61 55.27 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 179.117 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 76.1 t -113.85 130.17 68.45 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 O-C-N 121.514 -0.741 . . . . 0.0 110.321 -178.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 47.4 p -100.04 173.76 6.49 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 178.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.1 tp -73.6 -36.91 65.56 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.206 -0.934 . . . . 0.0 109.229 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 -63.6 -60.27 3.55 Favored 'General case' 0 C--N 1.29 -2.013 0 O-C-N 120.823 -1.173 . . . . 0.0 111.678 -177.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.429 ' CB ' HG21 ' A' ' 79' ' ' THR . 13.4 mm-40 -63.66 -32.54 74.06 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.644 -1.285 . . . . 0.0 110.139 -178.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -66.01 -52.43 49.41 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.677 -1.265 . . . . 0.0 109.35 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.4 mp -46.85 -45.6 20.35 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.241 -0.912 . . . . 0.0 108.877 179.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -52.42 -57.6 9.35 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.199 -0.938 . . . . 0.0 110.214 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 40.6 m -45.09 -27.83 0.64 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.242 -0.911 . . . . 0.0 109.977 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 29.3 p . . . . . 0 N--CA 1.497 1.912 0 O-C-N 121.35 -0.844 . . . . 0.0 108.723 178.866 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.5 m120 . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -62.84 -18.76 66.28 Favored 'Trans proline' 0 C--N 1.318 -1.071 0 C-N-CA 121.573 1.515 . . . . 0.0 110.013 -179.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -55.17 -36.84 66.29 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.404 -0.81 . . . . 0.0 110.924 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.5 m -72.21 -40.91 67.47 Favored 'General case' 0 N--CA 1.484 1.266 0 O-C-N 120.802 -1.186 . . . . 0.0 110.523 -178.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -56.24 -34.85 66.74 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.9 -1.125 . . . . 0.0 108.038 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -69.68 -33.6 72.79 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.453 -0.779 . . . . 0.0 109.884 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 98.2 mt -72.85 -60.54 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 O-C-N 120.838 -1.164 . . . . 0.0 109.278 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.51 ' O ' HD13 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -45.92 -39.26 8.52 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.297 -0.877 . . . . 0.0 110.798 -179.415 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -78.78 -15.86 57.88 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.332 -1.48 . . . . 0.0 110.155 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -78.38 96.42 5.33 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.984 -1.073 . . . . 0.0 108.64 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.402 HD13 HG21 ' A' ' 27' ' ' ILE . 14.9 mt -75.9 -48.36 29.42 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.363 0 O-C-N 121.501 -0.749 . . . . 0.0 111.032 -178.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.513 ' O ' ' ND2' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -89.31 8.04 32.53 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.853 -1.154 . . . . 0.0 110.003 -179.696 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 46.4 p 44.59 54.75 6.28 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.112 -0.993 . . . . 0.0 110.59 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.462 ' OD1' ' N ' ' A' ' 30' ' ' ASP . 21.0 p-10 -94.77 -3.18 49.59 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.054 -1.029 . . . . 0.0 108.71 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 79.41 -5.69 59.58 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -132.43 165.57 31.76 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 178.507 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.1 tp -116.66 123.5 47.42 Favored 'General case' 0 N--CA 1.515 2.82 0 N-CA-C 107.68 -1.229 . . . . 0.0 107.68 178.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 35.4 p-10 -103.94 179.59 4.23 Favored 'General case' 0 N--CA 1.507 2.379 0 CA-C-O 122.06 0.933 . . . . 0.0 111.038 -178.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -68.19 -8.2 36.72 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.389 -179.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.9 mm100 -85.66 -47.11 10.12 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 120.812 -1.18 . . . . 0.0 109.292 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -73.91 -29.4 62.03 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.333 -0.854 . . . . 0.0 108.814 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.0 tp -79.23 -40.56 30.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.45 -0.781 . . . . 0.0 109.792 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 47.5 mm-40 -74.65 -44.15 51.8 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.598 -1.314 . . . . 0.0 109.59 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.83 -32.57 71.05 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 120.971 -1.081 . . . . 0.0 110.632 -179.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 55.6 tp -76.59 -27.67 55.9 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.906 -1.121 . . . . 0.0 110.481 -178.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -81.73 -50.25 9.49 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 120.686 -1.259 . . . . 0.0 109.27 -179.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 20.7 m . . . . . 0 N--CA 1.489 1.496 0 O-C-N 121.34 -0.85 . . . . 0.0 110.758 -178.971 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 38.7 ttt180 . . . . . 0 N--CA 1.49 1.558 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.414 ' O ' ' OE1' ' A' ' 71' ' ' GLU . 24.6 mt -81.88 -28.3 33.0 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.038 -1.039 . . . . 0.0 110.043 -179.59 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.9 -40.41 87.73 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.036 -1.04 . . . . 0.0 109.788 -179.309 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.4 mtm -84.75 -50.23 7.77 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.058 -1.026 . . . . 0.0 109.895 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.4 ttp180 -54.04 -27.69 33.79 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.795 -1.191 . . . . 0.0 109.982 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.414 ' OE1' ' O ' ' A' ' 67' ' ' LEU . 37.5 mt-10 -80.23 -51.22 9.2 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.853 -1.154 . . . . 0.0 110.103 -179.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -54.59 -34.48 62.03 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.092 -1.005 . . . . 0.0 110.547 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 72.6 t -73.2 -54.02 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 120.665 -1.272 . . . . 0.0 109.938 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.422 ' O ' ' CG ' ' A' ' 78' ' ' ASP . 2.0 mmt -62.41 -17.77 60.01 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.16 -0.962 . . . . 0.0 109.786 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.47 ' HB2' ' HZ3' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -94.29 -38.57 10.94 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.633 -1.292 . . . . 0.0 111.014 -178.926 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . 0.51 HD22 ' N ' ' A' ' 76' ' ' ASN . 1.0 OUTLIER -98.06 -9.16 26.42 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.101 -1.0 . . . . 0.0 112.254 -177.707 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 84.6 t -116.1 -34.1 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.579 0 O-C-N 120.614 -1.304 . . . . 0.0 110.42 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.425 ' OD2' ' OE1' ' A' ' 81' ' ' GLN . 14.5 p-10 -48.93 108.0 0.16 Allowed 'General case' 0 N--CA 1.497 1.925 0 O-C-N 120.684 -1.26 . . . . 0.0 109.099 178.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -83.15 -66.62 0.87 Allowed 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.015 -1.053 . . . . 0.0 110.791 -178.024 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.53 ' O ' ' N ' ' A' ' 82' ' ' ASP . 10.5 m120 -104.62 25.2 10.59 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.109 -0.994 . . . . 0.0 109.351 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.468 ' C ' ' H ' ' A' ' 83' ' ' ARG . 0.2 OUTLIER 37.23 26.28 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.176 0.512 . . . . 0.0 111.135 178.937 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.531 ' C ' ' H ' ' A' ' 84' ' ' LEU . 56.4 t0 -81.32 12.84 3.27 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 178.405 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.468 ' H ' ' C ' ' A' ' 81' ' ' GLN . 72.6 mtt180 65.67 -5.29 0.51 Allowed 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 -178.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.531 ' H ' ' C ' ' A' ' 82' ' ' ASP . 9.9 mt -116.08 133.71 55.73 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 178.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 69.8 t -111.05 130.95 63.57 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.031 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 51.5 p -104.86 159.37 15.85 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.26 -0.9 . . . . 0.0 109.378 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.0 tp -61.3 -36.61 80.57 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -57.02 -68.55 0.21 Allowed 'General case' 0 C--N 1.294 -1.839 0 O-C-N 121.534 -0.728 . . . . 0.0 110.866 -178.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.422 ' O ' ' HB3' ' A' ' 92' ' ' ALA . 56.8 mm-40 -63.94 -34.91 79.04 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.193 -0.942 . . . . 0.0 110.938 -178.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -58.3 -49.84 75.74 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.589 -1.319 . . . . 0.0 109.102 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 71.1 mt -51.71 -46.13 63.82 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.098 -1.001 . . . . 0.0 108.844 178.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.422 ' HB3' ' O ' ' A' ' 89' ' ' GLU . . . -43.94 -51.36 7.71 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.458 -0.776 . . . . 0.0 110.094 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 93.7 p -58.0 -32.19 67.68 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.313 -0.867 . . . . 0.0 110.734 -179.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 22.2 p . . . . . 0 N--CA 1.502 2.172 0 O-C-N 120.999 -1.063 . . . . 0.0 110.271 -179.333 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 . . . . . 0 N--CA 1.498 1.927 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -58.98 -8.74 6.54 Favored 'Trans proline' 0 C--N 1.318 -1.07 0 C-N-CA 121.192 1.262 . . . . 0.0 109.877 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.0 tttp -60.87 -37.18 81.25 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.455 -0.778 . . . . 0.0 110.533 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 48.3 m -70.53 -39.14 74.22 Favored 'General case' 0 C--N 1.308 -1.228 0 O-C-N 120.854 -1.154 . . . . 0.0 110.261 -178.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.447 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.11 -39.95 72.98 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.972 -1.08 . . . . 0.0 108.264 179.692 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.447 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 35.9 t80 -64.97 -36.76 85.44 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.319 -0.863 . . . . 0.0 110.543 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.442 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.9 mt -71.5 -61.32 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 O-C-N 120.735 -1.228 . . . . 0.0 109.491 -179.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.474 HD13 ' O ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -46.72 -37.42 8.42 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.098 -1.001 . . . . 0.0 110.178 -179.93 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 12.5 m-70 -74.69 -14.74 60.78 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.552 -1.342 . . . . 0.0 109.56 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.442 ' N ' ' O ' ' A' ' 23' ' ' ILE . 65.9 m-20 -76.26 93.22 3.38 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.948 -1.095 . . . . 0.0 108.859 179.052 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 33.0 mt -75.1 -53.18 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 O-C-N 121.135 -0.978 . . . . 0.0 110.731 -178.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.551 ' N ' HD22 ' A' ' 28' ' ' ASN . 1.7 m120 -86.42 13.86 7.61 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 120.844 -1.16 . . . . 0.0 109.955 -179.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.402 ' O ' ' OG ' ' A' ' 29' ' ' SER . 6.7 t 42.54 51.43 4.86 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.416 -0.803 . . . . 0.0 110.516 178.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -94.44 -4.07 48.94 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.11 -0.994 . . . . 0.0 108.33 179.257 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 77.25 -2.11 62.64 Favored Glycine 0 N--CA 1.489 2.167 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.423 ' O ' HD12 ' A' ' 33' ' ' LEU . 0.9 OUTLIER -140.5 164.82 21.39 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.04 0 O-C-N 121.41 -1.053 . . . . 0.0 108.601 178.929 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.423 HD12 ' O ' ' A' ' 32' ' ' VAL . 3.4 mp -118.43 129.77 55.58 Favored 'General case' 0 N--CA 1.52 3.035 0 N-CA-C 107.872 -1.159 . . . . 0.0 107.872 177.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.452 ' O ' ' N ' ' A' ' 36' ' ' GLN . 26.2 p-10 -108.01 168.62 9.16 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.3 -0.875 . . . . 0.0 110.325 -179.076 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -50.8 -8.79 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.552 -0.717 . . . . 0.0 110.458 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.452 ' N ' ' O ' ' A' ' 34' ' ' ASP . 3.1 mm100 -84.09 -38.28 20.98 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 120.973 -1.079 . . . . 0.0 109.026 178.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -77.99 -29.61 49.74 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.211 -0.931 . . . . 0.0 109.012 179.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.543 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 10.4 mp -78.02 -40.53 38.65 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.107 -0.996 . . . . 0.0 108.368 179.369 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -69.03 -44.64 72.31 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.967 -1.083 . . . . 0.0 109.474 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.88 -27.9 65.19 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.323 -0.86 . . . . 0.0 110.59 -179.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 22.4 tp -75.32 -25.77 58.11 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.501 -1.374 . . . . 0.0 110.706 -178.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.543 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 11.4 m-85 -82.88 -39.9 20.94 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 120.296 -1.502 . . . . 0.0 110.287 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 84.8 m . . . . . 0 N--CA 1.492 1.646 0 O-C-N 120.717 -1.239 . . . . 0.0 111.406 -178.442 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 33.5 ttp180 . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 121.397 0.617 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.637 ' C ' HD12 ' A' ' 67' ' ' LEU . 0.6 OUTLIER -79.65 -26.73 40.99 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.31 -0.868 . . . . 0.0 109.716 -179.65 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.77 -38.65 85.97 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.886 -1.134 . . . . 0.0 109.664 -179.685 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 25.9 mtt -83.79 -50.41 8.15 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.927 -1.108 . . . . 0.0 109.864 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 52.8 ttt180 -50.43 -26.57 5.19 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 120.6 -1.312 . . . . 0.0 110.496 -179.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 -85.16 -51.78 6.39 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.774 -1.203 . . . . 0.0 110.684 -179.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.528 ' CE1' ' OD1' ' A' ' 76' ' ' ASN . 59.2 t-80 -54.82 -39.87 68.96 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.963 -1.086 . . . . 0.0 110.337 -179.281 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 68.9 t -73.29 -53.57 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 120.704 -1.248 . . . . 0.0 109.865 -179.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.445 ' O ' ' CG ' ' A' ' 78' ' ' ASP . 4.0 mmt -63.99 -22.8 67.08 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.014 -1.053 . . . . 0.0 109.815 -179.304 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.403 ' NZ ' ' CB ' ' A' ' 75' ' ' LYS . 7.3 ttpm? -89.42 -35.9 15.76 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.641 -1.287 . . . . 0.0 110.727 -178.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . 0.528 ' OD1' ' CE1' ' A' ' 72' ' ' HIS . 5.5 m120 -100.15 -8.95 23.05 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.027 -1.046 . . . . 0.0 112.339 -178.263 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 90.1 t -118.4 -31.56 1.74 Allowed 'Isoleucine or valine' 0 N--CA 1.513 2.684 0 O-C-N 120.497 -1.377 . . . . 0.0 111.063 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.445 ' CG ' ' O ' ' A' ' 74' ' ' MET . 17.1 p-10 -48.9 103.42 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.928 0 O-C-N 120.499 -1.375 . . . . 0.0 109.158 179.396 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -78.58 -63.55 1.38 Allowed 'General case' 0 C--N 1.298 -1.647 0 O-C-N 120.754 -1.216 . . . . 0.0 110.259 -178.518 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.445 ' ND2' ' O ' ' A' ' 80' ' ' ASN . 1.0 OUTLIER -107.98 26.91 9.79 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.142 -0.974 . . . . 0.0 109.745 179.836 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.433 ' OE1' ' OD2' ' A' ' 78' ' ' ASP . 0.2 OUTLIER 36.64 31.32 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.864 0 CA-C-O 121.203 0.525 . . . . 0.0 111.333 178.817 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.553 ' C ' ' H ' ' A' ' 84' ' ' LEU . 89.9 m-20 -87.34 15.66 6.19 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 178.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.504 ' HG2' HH11 ' A' ' 83' ' ' ARG . 6.5 mtt-85 63.17 -2.94 0.39 Allowed 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 -178.574 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.553 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.8 mp -122.73 134.12 54.46 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 179.309 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 75.6 t -112.61 129.52 68.04 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.111 0 O-C-N 121.634 -0.666 . . . . 0.0 109.407 -179.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 64.5 p -94.57 167.22 11.62 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 120.967 -1.083 . . . . 0.0 109.121 179.187 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.747 ' C ' HD13 ' A' ' 87' ' ' LEU . 1.0 OUTLIER -70.14 -38.36 75.48 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.685 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -58.94 -69.37 0.2 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.415 -0.803 . . . . 0.0 111.431 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.406 ' N ' ' CD ' ' A' ' 89' ' ' GLU . 4.9 mp0 -56.49 -32.28 64.86 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.008 -1.058 . . . . 0.0 110.497 -178.417 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -61.79 -48.93 78.42 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 120.799 -1.188 . . . . 0.0 110.135 -179.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 91' ' ' LEU . 87.4 mt -51.32 -48.39 62.38 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.809 -1.182 . . . . 0.0 108.899 179.172 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -46.22 -59.88 2.64 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.4 -0.812 . . . . 0.0 110.295 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 44.1 t -48.88 -28.05 3.5 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.156 -0.965 . . . . 0.0 110.511 -179.03 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 43.9 p . . . . . 0 N--CA 1.499 2.018 0 O-C-N 121.093 -1.004 . . . . 0.0 108.987 179.645 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.449 ' C ' HD22 ' A' ' 17' ' ' ASN . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.587 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -64.65 -23.53 63.51 Favored 'Trans proline' 0 C--N 1.318 -1.045 0 C-N-CA 121.468 1.445 . . . . 0.0 109.751 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 61.1 tttp -59.21 -40.06 84.62 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.365 -0.834 . . . . 0.0 110.937 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 52.5 m -68.3 -41.5 80.8 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 120.767 -1.208 . . . . 0.0 110.525 -178.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -55.54 -36.86 67.24 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.026 -1.046 . . . . 0.0 108.371 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -66.87 -35.61 80.42 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.46 -0.775 . . . . 0.0 110.149 -179.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 97.5 mt -71.36 -60.99 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 O-C-N 120.702 -1.249 . . . . 0.0 108.985 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 tp -46.21 -37.51 7.23 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.334 -0.854 . . . . 0.0 110.795 -179.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.524 ' O ' ' ND1' ' A' ' 25' ' ' HIS . 0.9 OUTLIER -76.28 -16.22 59.83 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.517 -1.364 . . . . 0.0 109.548 -179.943 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -79.54 94.82 5.69 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.17 -0.956 . . . . 0.0 108.891 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 18.5 mt -75.93 -52.21 18.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 O-C-N 121.322 -0.861 . . . . 0.0 110.819 -178.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.695 ' H ' ' ND2' ' A' ' 28' ' ' ASN . 0.1 OUTLIER -84.57 -2.52 57.51 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.969 -1.082 . . . . 0.0 110.032 -179.615 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.496 ' N ' HD22 ' A' ' 28' ' ' ASN . 1.4 m 57.2 53.16 8.04 Favored 'General case' 0 C--N 1.294 -1.828 0 O-C-N 121.19 -0.944 . . . . 0.0 110.345 178.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -96.21 -1.07 48.99 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.163 -0.961 . . . . 0.0 108.468 179.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 76.45 -0.09 65.45 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.46 160.35 16.94 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 O-C-N 121.262 -1.14 . . . . 0.0 108.578 178.064 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 80.3 mt -107.85 128.6 54.75 Favored 'General case' 0 N--CA 1.511 2.616 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 178.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.415 ' C ' ' H ' ' A' ' 36' ' ' GLN . 39.2 p-10 -106.58 165.02 11.59 Favored 'General case' 0 N--CA 1.501 2.086 0 CA-C-O 121.757 0.789 . . . . 0.0 110.175 -179.279 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.414 ' O ' ' OE2' ' A' ' 39' ' ' GLU . 62.6 mt-10 -52.76 -8.56 0.09 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.771 -0.581 . . . . 0.0 110.325 -179.614 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.415 ' H ' ' C ' ' A' ' 34' ' ' ASP . 3.0 mm100 -86.33 -48.88 8.1 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.812 -1.18 . . . . 0.0 109.707 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 59.3 mt-10 -71.12 -29.19 64.94 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.277 -0.889 . . . . 0.0 109.18 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.4 tp -77.83 -39.04 44.92 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.506 -0.746 . . . . 0.0 109.885 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.53 ' OE1' ' N ' ' A' ' 39' ' ' GLU . 0.2 OUTLIER -74.68 -40.37 61.43 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.847 -1.158 . . . . 0.0 109.916 179.993 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.65 -39.31 73.71 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.075 -1.016 . . . . 0.0 111.686 -178.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 41.3 tp -73.07 -25.53 60.94 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 120.833 -1.167 . . . . 0.0 110.214 -178.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 1.4 m-30 -84.82 -49.65 8.24 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 120.853 -1.154 . . . . 0.0 109.388 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 16.2 m . . . . . 0 N--CA 1.49 1.56 0 O-C-N 120.994 -1.066 . . . . 0.0 110.054 -179.498 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 43.5 mtm180 . . . . . 0 N--CA 1.493 1.706 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 72.3 mt -57.85 -41.78 83.08 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.097 -1.002 . . . . 0.0 110.124 -178.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -70.21 -37.24 75.01 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.286 -0.884 . . . . 0.0 109.867 -179.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -82.52 -32.29 28.77 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.144 -0.972 . . . . 0.0 108.87 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 40.7 ttp180 -73.85 -49.74 23.63 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.02 -1.05 . . . . 0.0 109.915 179.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -60.58 -49.43 77.58 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.925 -1.11 . . . . 0.0 110.182 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 8.0 t60 -54.58 -36.41 64.37 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.169 -0.957 . . . . 0.0 110.259 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 69.5 t -75.5 -54.94 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 120.611 -1.306 . . . . 0.0 109.916 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.414 ' O ' ' CG ' ' A' ' 78' ' ' ASP . 4.1 mmt -63.32 -19.03 64.26 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.032 -1.043 . . . . 0.0 110.188 -179.163 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 72.7 tttt -93.43 -39.72 10.75 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.903 -1.123 . . . . 0.0 111.215 -178.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . 0.599 ' N ' HD22 ' A' ' 76' ' ' ASN . 1.0 OUTLIER -101.46 -9.47 21.05 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 121.081 -1.012 . . . . 0.0 112.33 -177.706 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 87.1 t -110.62 -35.38 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.471 0 O-C-N 120.475 -1.391 . . . . 0.0 109.692 179.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.424 ' OD2' ' OE1' ' A' ' 81' ' ' GLN . 11.9 p-10 -49.1 109.12 0.23 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.763 -1.211 . . . . 0.0 108.649 178.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.593 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -85.3 -62.54 1.51 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 120.914 -1.116 . . . . 0.0 110.397 -177.661 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.498 ' ND2' ' O ' ' A' ' 80' ' ' ASN . 0.7 OUTLIER -104.46 17.43 24.14 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.238 -0.914 . . . . 0.0 109.805 -179.557 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.424 ' OE1' ' OD2' ' A' ' 78' ' ' ASP . 0.3 OUTLIER 43.79 75.01 0.1 Allowed 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.414 -0.804 . . . . 0.0 111.013 177.967 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.583 ' C ' ' H ' ' A' ' 84' ' ' LEU . 45.8 t0 -132.33 19.44 4.4 Favored 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 107.899 -1.149 . . . . 0.0 107.899 178.525 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.525 HH11 ' CG ' ' A' ' 83' ' ' ARG . 5.1 mtt-85 59.62 -3.51 0.11 Allowed 'General case' 0 N--CA 1.491 1.621 0 CA-C-O 121.478 0.656 . . . . 0.0 109.236 -178.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.583 ' H ' ' C ' ' A' ' 82' ' ' ASP . 11.2 mt -123.39 134.96 53.93 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 179.569 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 74.4 t -110.4 128.43 66.68 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.036 0 O-C-N 121.493 -0.754 . . . . 0.0 109.124 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 60.9 p -102.37 156.54 17.52 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.264 -0.898 . . . . 0.0 109.346 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.1 tp -59.06 -39.27 81.55 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.484 -0.76 . . . . 0.0 108.955 179.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -58.8 -68.57 0.25 Allowed 'General case' 0 C--N 1.295 -1.803 0 O-C-N 121.607 -0.683 . . . . 0.0 110.993 -177.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.593 ' CB ' HG21 ' A' ' 79' ' ' THR . 34.6 mm-40 -61.52 -30.28 70.53 Favored 'General case' 0 C--N 1.299 -1.618 0 O-C-N 121.233 -0.917 . . . . 0.0 110.717 -178.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -63.13 -51.68 65.53 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.902 -1.124 . . . . 0.0 109.68 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 78.7 mt -50.33 -45.07 54.58 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.263 -0.898 . . . . 0.0 109.376 179.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -51.52 -57.79 8.08 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.236 -0.915 . . . . 0.0 110.162 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 37.7 t -46.34 -34.34 4.5 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.24 -0.913 . . . . 0.0 110.518 -179.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 44.0 p . . . . . 0 N--CA 1.495 1.797 0 O-C-N 121.003 -1.06 . . . . 0.0 109.063 179.845 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.8 m120 . . . . . 0 N--CA 1.489 1.5 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -59.48 -11.76 14.95 Favored 'Trans proline' 0 C--N 1.319 -1.006 0 C-N-CA 121.445 1.43 . . . . 0.0 110.274 -179.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 48.4 tttm -56.05 -48.22 76.43 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.337 -0.852 . . . . 0.0 110.495 179.685 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 46.2 m -59.66 -37.98 80.19 Favored 'General case' 0 C--N 1.306 -1.296 0 O-C-N 120.963 -1.086 . . . . 0.0 110.444 -178.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.401 ' CD2' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.35 -47.71 78.27 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.915 -1.116 . . . . 0.0 108.126 179.717 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.401 ' N ' ' CD2' ' A' ' 21' ' ' PHE . 20.7 t80 -54.51 -32.7 58.56 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.527 -0.733 . . . . 0.0 109.896 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.48 ' O ' ' N ' ' A' ' 25' ' ' HIS . 96.5 mt -75.04 -61.94 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.223 0 O-C-N 120.814 -1.179 . . . . 0.0 109.676 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 24' ' ' LEU . 20.5 mt -47.74 -13.23 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.785 -1.197 . . . . 0.0 110.742 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.503 ' O ' ' ND1' ' A' ' 25' ' ' HIS . 1.0 OUTLIER -104.62 -14.02 15.76 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.526 -1.359 . . . . 0.0 110.582 -179.417 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.472 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 20.6 p-10 -79.59 70.33 6.05 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 120.827 -1.17 . . . . 0.0 109.238 179.662 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.414 HD12 ' OE2' ' A' ' 37' ' ' GLU . 8.1 mt -50.1 -53.18 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 O-C-N 121.041 -1.037 . . . . 0.0 111.127 -179.13 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.761 ' H ' ' ND2' ' A' ' 28' ' ' ASN . 0.0 OUTLIER -85.85 -1.85 57.67 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.891 -1.131 . . . . 0.0 110.095 -179.412 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.403 ' N ' HD22 ' A' ' 28' ' ' ASN . 19.9 p 53.34 50.82 16.69 Favored 'General case' 0 C--N 1.292 -1.895 0 O-C-N 121.289 -0.882 . . . . 0.0 110.49 178.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -95.11 3.41 54.79 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 74.47 1.13 60.31 Favored Glycine 0 N--CA 1.489 2.213 0 N-CA-C 109.776 -1.329 . . . . 0.0 109.776 -179.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.67 163.39 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.093 0 O-C-N 121.131 -1.217 . . . . 0.0 108.931 178.371 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 68.4 mt -113.7 124.83 53.24 Favored 'General case' 0 N--CA 1.513 2.709 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 178.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -105.61 163.0 13.01 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.614 -0.679 . . . . 0.0 109.931 -179.3 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -49.23 -32.29 10.34 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.418 -0.801 . . . . 0.0 111.625 -178.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -64.61 -33.06 75.05 Favored 'General case' 0 C--N 1.293 -1.877 0 O-C-N 120.558 -1.339 . . . . 0.0 109.244 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.414 ' OE2' HD12 ' A' ' 27' ' ' ILE . 33.8 mm-40 -74.34 -38.14 63.34 Favored 'General case' 0 N--CA 1.496 1.852 0 C-N-CA 119.269 -0.972 . . . . 0.0 108.831 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.9 mt -81.58 -39.18 24.96 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.141 -0.975 . . . . 0.0 109.264 178.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -59.97 -39.93 87.33 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 120.628 -1.295 . . . . 0.0 108.775 179.096 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.21 -29.39 62.77 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.295 -0.878 . . . . 0.0 110.369 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.524 ' O ' HD23 ' A' ' 41' ' ' LEU . 0.8 OUTLIER -76.45 -24.3 53.89 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.195 -0.941 . . . . 0.0 110.289 -179.173 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -82.7 -50.5 8.65 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.672 -1.267 . . . . 0.0 109.646 -179.454 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 31.3 m . . . . . 0 N--CA 1.491 1.606 0 O-C-N 121.368 -0.833 . . . . 0.0 111.233 -179.036 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 5.9 mtm180 . . . . . 0 N--CA 1.493 1.681 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 64.8 mt -75.05 -28.81 60.55 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.163 -0.961 . . . . 0.0 109.422 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.51 ' HG2' HH11 ' A' ' 68' ' ' ARG . 0.0 OUTLIER -64.67 -40.69 95.85 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.112 -0.992 . . . . 0.0 109.498 -179.683 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 9.1 mtm -86.07 -50.3 7.14 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 120.988 -1.07 . . . . 0.0 109.367 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 24.8 ttt-85 -58.51 -41.71 86.05 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.915 -1.116 . . . . 0.0 110.576 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -74.9 -52.18 11.93 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 120.808 -1.183 . . . . 0.0 110.671 -179.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 17.6 t60 -54.32 -41.13 68.65 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.942 -1.099 . . . . 0.0 110.294 -179.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.442 ' HA ' HD21 ' A' ' 76' ' ' ASN . 75.3 t -71.34 -49.07 50.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 120.689 -1.257 . . . . 0.0 109.522 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 16.9 mtp -67.81 -19.85 65.12 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.201 -0.937 . . . . 0.0 110.877 -179.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 35.1 pttt -88.11 -32.2 18.81 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 120.302 -1.499 . . . . 0.0 110.721 -179.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . 0.629 HD22 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -104.91 -27.07 11.93 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.104 -0.997 . . . . 0.0 112.587 -178.09 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.629 ' H ' HD22 ' A' ' 76' ' ' ASN . 40.2 t -92.61 -33.7 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 O-C-N 120.253 -1.53 . . . . 0.0 110.236 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -66.04 105.24 1.3 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.467 -1.396 . . . . 0.0 108.001 178.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.475 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -83.48 -54.16 5.17 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.298 -0.876 . . . . 0.0 111.417 -178.176 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.427 ' O ' ' C ' ' A' ' 81' ' ' GLN . 6.1 m120 -100.12 24.84 8.12 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.287 -0.883 . . . . 0.0 109.642 -179.438 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.427 ' C ' ' O ' ' A' ' 80' ' ' ASN . 0.9 OUTLIER 32.45 37.05 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 178.857 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.569 ' C ' ' H ' ' A' ' 84' ' ' LEU . 26.0 t0 -88.69 13.73 11.66 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 178.414 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 40.8 mtp180 61.93 -2.52 0.29 Allowed 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 -178.476 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.569 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.5 mp -122.92 134.53 54.36 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 106.695 -1.594 . . . . 0.0 106.695 178.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 69.0 t -112.84 129.98 67.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.049 0 O-C-N 121.687 -0.633 . . . . 0.0 110.21 -178.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 30.1 p -101.78 173.9 6.2 Favored 'General case' 0 N--CA 1.499 1.999 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.9 tp -73.14 -34.76 66.27 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.164 -0.96 . . . . 0.0 109.236 179.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -61.32 -68.24 0.33 Allowed 'General case' 0 C--N 1.293 -1.852 0 O-C-N 121.034 -1.041 . . . . 0.0 111.379 -177.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.475 ' CB ' HG21 ' A' ' 79' ' ' THR . 6.4 mm-40 -60.01 -31.36 69.86 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.242 -0.911 . . . . 0.0 110.719 -178.325 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -64.26 -52.37 59.0 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.912 -1.118 . . . . 0.0 110.136 -179.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 77.5 mt -49.97 -42.49 48.91 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.124 -0.985 . . . . 0.0 109.301 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -53.39 -57.64 9.92 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.297 -0.877 . . . . 0.0 110.304 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 42.9 t -48.31 -28.9 3.4 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.122 -0.986 . . . . 0.0 109.992 -179.158 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 33.2 p . . . . . 0 N--CA 1.5 2.026 0 O-C-N 121.242 -0.911 . . . . 0.0 108.993 179.677 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.677 HD22 ' N ' ' A' ' 17' ' ' ASN . 0.6 OUTLIER . . . . . 0 N--CA 1.493 1.68 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -68.3 -20.33 42.88 Favored 'Trans proline' 0 C--N 1.318 -1.066 0 C-N-CA 121.585 1.523 . . . . 0.0 110.54 -179.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -68.32 -49.42 60.48 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.176 -0.953 . . . . 0.0 111.362 -178.244 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.1 m -63.89 -41.34 97.74 Favored 'General case' 0 N--CA 1.485 1.283 0 O-C-N 120.723 -1.236 . . . . 0.0 110.53 -178.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.47 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.05 -39.56 72.21 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.948 -1.095 . . . . 0.0 108.357 -179.803 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.47 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 53.1 t80 -63.35 -34.0 76.76 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.188 -0.945 . . . . 0.0 110.074 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.47 ' O ' ' N ' ' A' ' 26' ' ' ASP . 97.0 mt -69.92 -59.83 3.11 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 O-C-N 120.714 -1.241 . . . . 0.0 109.099 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.7 tp -45.15 -38.91 5.6 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.325 -0.859 . . . . 0.0 110.377 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.405 ' ND1' HD21 ' A' ' 41' ' ' LEU . 13.7 m-70 -75.15 -17.01 60.49 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 120.428 -1.42 . . . . 0.0 109.402 179.488 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.47 ' N ' ' O ' ' A' ' 23' ' ' ILE . 75.7 m-20 -80.02 92.25 5.57 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.094 -1.004 . . . . 0.0 109.066 179.624 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.1 mt -76.3 -45.17 35.36 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.429 0 O-C-N 121.318 -0.863 . . . . 0.0 110.635 -178.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.512 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -94.04 8.21 42.28 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.788 -1.195 . . . . 0.0 110.12 -179.626 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 54.3 p 44.67 64.16 1.45 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.152 -0.967 . . . . 0.0 110.749 178.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -104.39 4.93 33.93 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.257 -0.902 . . . . 0.0 108.914 179.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 70.93 -0.05 31.53 Favored Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -139.2 165.32 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.033 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 177.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.437 HD12 ' HA ' ' A' ' 33' ' ' LEU . 6.2 tp -106.76 110.16 22.26 Favored 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 178.27 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -80.55 147.87 30.61 Favored 'General case' 0 N--CA 1.498 1.93 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.305 -178.477 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -52.32 -38.52 58.78 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.45 -0.781 . . . . 0.0 110.406 -179.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.9 mm100 -64.02 -34.21 77.49 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 120.927 -1.108 . . . . 0.0 108.605 179.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -73.46 -33.86 65.08 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 179.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.2 tp -76.5 -37.22 57.12 Favored 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -72.63 -49.7 30.16 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.957 -1.089 . . . . 0.0 110.119 -179.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.17 -50.46 61.04 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.895 -1.128 . . . . 0.0 110.902 -178.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.405 HD21 ' ND1' ' A' ' 25' ' ' HIS . 40.2 tp -56.16 -26.03 48.92 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.075 -1.015 . . . . 0.0 110.035 -178.702 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -83.13 -49.3 9.64 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 120.896 -1.127 . . . . 0.0 109.379 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 30.1 m . . . . . 0 C--N 1.301 -1.537 0 O-C-N 120.943 -1.098 . . . . 0.0 110.22 -179.303 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 24.9 ttp180 . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 121.272 0.558 . . . . 0.0 109.649 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.644 ' C ' HD12 ' A' ' 67' ' ' LEU . 0.5 OUTLIER -78.83 -26.85 44.22 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.19 -0.944 . . . . 0.0 109.948 -179.622 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.515 ' HG2' HH11 ' A' ' 68' ' ' ARG . 0.0 OUTLIER -65.55 -38.76 90.54 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 120.959 -1.088 . . . . 0.0 109.889 -179.452 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 9.0 mtt -85.05 -29.56 24.83 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.121 -0.987 . . . . 0.0 109.857 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -72.95 -40.86 65.03 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.861 -1.149 . . . . 0.0 110.29 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -73.02 -47.28 46.34 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 120.793 -1.192 . . . . 0.0 110.501 -179.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 35.4 t-80 -55.75 -40.87 73.13 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.147 -0.971 . . . . 0.0 110.863 -179.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.413 ' HA ' HD21 ' A' ' 76' ' ' ASN . 66.0 t -72.6 -54.18 16.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 120.551 -1.343 . . . . 0.0 110.126 -179.466 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.7 mmt -61.11 -19.72 61.81 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.141 -0.975 . . . . 0.0 110.018 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 43.4 tttp -82.64 -40.05 21.27 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.662 -1.273 . . . . 0.0 111.399 -178.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . 0.677 HD22 ' N ' ' A' ' 77' ' ' VAL . 0.0 OUTLIER -102.91 -20.77 14.14 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 120.983 -1.073 . . . . 0.0 112.35 -177.842 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.677 ' N ' HD22 ' A' ' 76' ' ' ASN . 31.3 t -97.83 -32.02 3.91 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.391 0 O-C-N 120.455 -1.403 . . . . 0.0 110.025 -179.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -53.28 107.76 0.27 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.724 -1.235 . . . . 0.0 109.302 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -81.18 -69.11 0.63 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.339 -0.85 . . . . 0.0 112.815 -177.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.466 ' O ' ' N ' ' A' ' 82' ' ' ASP . 9.5 m120 -107.88 27.8 8.86 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 120.879 -1.138 . . . . 0.0 110.748 -177.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.481 ' C ' ' H ' ' A' ' 83' ' ' ARG . 0.3 OUTLIER 42.13 23.24 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.751 0 O-C-N 121.58 -0.7 . . . . 0.0 111.245 178.794 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.504 ' C ' ' H ' ' A' ' 84' ' ' LEU . 37.3 t0 -82.78 13.97 3.51 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 177.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.481 ' H ' ' C ' ' A' ' 81' ' ' GLN . 44.0 mtm180 64.05 -2.25 0.59 Allowed 'General case' 0 N--CA 1.486 1.363 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.797 -179.036 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.504 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.3 mt -115.46 133.57 55.9 Favored 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 179.013 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 78.1 t -109.58 130.98 61.7 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 53.8 p -107.03 153.27 22.85 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.138 -0.976 . . . . 0.0 109.81 -179.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.4 tp -55.36 -34.62 64.43 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 179.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -57.09 -69.42 0.16 Allowed 'General case' 0 C--N 1.296 -1.743 0 O-C-N 121.43 -0.794 . . . . 0.0 111.862 -178.095 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -68.97 -33.24 73.37 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.862 -1.149 . . . . 0.0 110.895 -177.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -56.38 -50.93 70.13 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 120.765 -1.21 . . . . 0.0 108.777 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 52.9 mt -51.65 -49.72 61.77 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.187 -0.945 . . . . 0.0 109.337 179.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -44.48 -46.07 9.53 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.415 -0.803 . . . . 0.0 109.85 -179.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 53.5 p -57.27 -34.97 69.19 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.363 -0.836 . . . . 0.0 109.712 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 22.2 p . . . . . 0 N--CA 1.497 1.915 0 O-C-N 121.199 -0.938 . . . . 0.0 109.222 179.68 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -63.9 -21.97 68.81 Favored 'Trans proline' 0 C--N 1.318 -1.051 0 C-N-CA 121.402 1.401 . . . . 0.0 109.895 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -58.26 -37.38 74.83 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.165 -0.959 . . . . 0.0 110.801 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 52.7 m -71.52 -40.98 69.75 Favored 'General case' 0 C--N 1.307 -1.263 0 O-C-N 120.742 -1.224 . . . . 0.0 110.565 -178.568 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -55.85 -35.16 66.12 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.88 -1.137 . . . . 0.0 107.969 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -68.2 -33.3 74.18 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.423 -0.798 . . . . 0.0 109.268 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.505 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 96.7 mt -73.13 -61.51 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.217 0 O-C-N 120.882 -1.136 . . . . 0.0 108.992 179.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.515 HD13 ' O ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -44.37 -27.69 0.46 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.889 -1.132 . . . . 0.0 110.725 -179.644 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.528 ' ND1' ' N ' ' A' ' 25' ' ' HIS . 0.2 OUTLIER -90.21 -13.73 34.91 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.142 -1.599 . . . . 0.0 110.31 179.887 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.505 ' OD1' ' O ' ' A' ' 23' ' ' ILE . 20.3 p-10 -74.45 62.37 0.99 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.779 -1.2 . . . . 0.0 109.553 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 64.4 mt -48.83 -52.06 10.48 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 O-C-N 120.929 -1.107 . . . . 0.0 110.977 -179.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.523 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -90.1 12.47 17.71 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.818 -1.176 . . . . 0.0 110.056 -179.459 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.402 ' C ' ' O ' ' A' ' 28' ' ' ASN . 26.5 p 42.23 50.91 4.55 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.261 -0.9 . . . . 0.0 110.699 178.683 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.408 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 10.9 t70 -95.04 -3.89 47.45 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.03 -1.044 . . . . 0.0 108.53 179.365 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.61 4.51 87.72 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 -179.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.78 164.19 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 O-C-N 121.177 -1.19 . . . . 0.0 108.876 178.521 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.0 mp -115.43 121.06 41.61 Favored 'General case' 0 N--CA 1.518 2.934 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 177.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.544 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 0.2 OUTLIER -105.68 172.91 6.55 Favored 'General case' 0 N--CA 1.505 2.286 0 CA-C-O 121.766 0.794 . . . . 0.0 111.108 -177.82 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -53.92 -40.6 66.84 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.493 -0.755 . . . . 0.0 112.156 -178.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.493 ' NE2' ' C ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -61.88 -24.45 66.94 Favored 'General case' 0 C--N 1.295 -1.764 0 O-C-N 120.161 -1.587 . . . . 0.0 108.717 -179.799 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -81.09 -40.89 23.41 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.12 -0.987 . . . . 0.0 109.653 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.49 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 6.4 mt -75.81 -30.41 59.02 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.885 -1.134 . . . . 0.0 108.716 178.544 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -60.72 -46.2 91.32 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 120.887 -1.133 . . . . 0.0 108.699 178.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.44 -29.58 62.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.455 -0.778 . . . . 0.0 110.706 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -72.67 -25.76 61.38 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.057 -1.027 . . . . 0.0 110.248 -178.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.49 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 38.1 m-85 -80.67 -49.27 11.45 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 120.862 -1.149 . . . . 0.0 109.732 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 28.2 m . . . . . 0 N--CA 1.49 1.573 0 O-C-N 121.142 -0.974 . . . . 0.0 111.266 -178.963 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 37.4 mtm180 . . . . . 0 N--CA 1.492 1.636 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 30.1 mt -68.92 -27.67 65.97 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.203 -0.936 . . . . 0.0 109.586 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.3 -41.04 94.5 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.289 -0.882 . . . . 0.0 109.526 -179.62 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.9 mtt -85.8 -50.11 7.4 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.944 -1.098 . . . . 0.0 109.382 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.547 ' CG ' HH11 ' A' ' 70' ' ' ARG . 0.9 OUTLIER -56.1 -45.16 79.55 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.027 -1.045 . . . . 0.0 110.669 -179.703 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -75.55 -52.36 10.8 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.0 -1.063 . . . . 0.0 111.146 -178.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.515 ' O ' ' ND2' ' A' ' 76' ' ' ASN . 13.8 t60 -55.49 -39.77 70.86 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.062 -1.024 . . . . 0.0 110.455 -179.249 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.418 ' HA ' HD21 ' A' ' 76' ' ' ASN . 72.1 t -71.87 -53.79 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 120.654 -1.279 . . . . 0.0 109.782 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.439 ' O ' ' OD1' ' A' ' 78' ' ' ASP . 3.0 mmt -64.67 -15.5 61.41 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.242 -0.911 . . . . 0.0 110.335 -179.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -93.86 -38.78 11.05 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.719 -1.238 . . . . 0.0 111.084 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . 0.629 HD22 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -100.61 -26.24 13.89 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 120.947 -1.096 . . . . 0.0 112.039 -178.178 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.629 ' H ' HD22 ' A' ' 76' ' ' ASN . 40.3 t -90.63 -36.14 7.97 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.279 0 O-C-N 120.268 -1.52 . . . . 0.0 109.197 179.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.439 ' OD1' ' O ' ' A' ' 74' ' ' MET . 10.0 p-10 -49.27 109.49 0.27 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.808 -1.182 . . . . 0.0 108.659 178.534 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.603 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -86.94 -64.18 1.19 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.994 -1.066 . . . . 0.0 110.318 -177.567 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.81 ' H ' HD22 ' A' ' 80' ' ' ASN . 0.1 OUTLIER -102.41 16.28 26.73 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.244 -0.91 . . . . 0.0 109.574 -179.651 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.43 ' OE1' ' OD2' ' A' ' 78' ' ' ASP . 0.4 OUTLIER 42.96 74.0 0.13 Allowed 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.495 -0.753 . . . . 0.0 111.09 178.127 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.581 ' C ' ' H ' ' A' ' 84' ' ' LEU . 38.9 t0 -129.45 18.36 5.84 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 178.313 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 78.2 mtt180 61.88 -4.71 0.18 Allowed 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 -178.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.581 ' H ' ' C ' ' A' ' 82' ' ' ASP . 9.8 mt -124.26 134.45 53.23 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 75.0 t -109.91 129.42 64.87 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.529 -0.732 . . . . 0.0 109.083 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 65.4 p -101.79 162.15 13.13 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.195 -0.941 . . . . 0.0 109.187 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.8 tp -63.8 -37.64 88.12 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -58.33 -68.72 0.23 Allowed 'General case' 0 C--N 1.293 -1.872 0 O-C-N 121.468 -0.77 . . . . 0.0 110.894 -178.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.603 ' CB ' HG21 ' A' ' 79' ' ' THR . 8.3 mm-40 -61.95 -30.55 70.99 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.324 -0.86 . . . . 0.0 110.863 -178.368 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -64.26 -51.6 62.8 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.763 -1.21 . . . . 0.0 109.539 -179.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 67.4 mt -49.12 -44.31 42.26 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.224 -0.923 . . . . 0.0 109.224 179.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -51.16 -58.81 5.15 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.326 -0.859 . . . . 0.0 110.054 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 43.2 t -45.61 -29.99 1.38 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.135 -0.978 . . . . 0.0 109.968 -179.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 29.9 p . . . . . 0 N--CA 1.497 1.914 0 O-C-N 121.241 -0.912 . . . . 0.0 108.856 179.323 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.496 HD22 ' C ' ' A' ' 17' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -64.82 -17.19 58.74 Favored 'Trans proline' 0 C--N 1.318 -1.066 0 C-N-CA 121.535 1.49 . . . . 0.0 110.299 -179.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 43.4 tttm -57.48 -36.84 71.98 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.247 -0.908 . . . . 0.0 110.767 -179.269 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.4 m -69.13 -39.37 78.92 Favored 'General case' 0 C--N 1.306 -1.291 0 O-C-N 120.804 -1.185 . . . . 0.0 110.091 -179.125 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.419 ' CE2' ' CD2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -56.72 -40.5 75.78 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.091 -1.006 . . . . 0.0 108.508 -179.951 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -64.11 -36.28 83.51 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.358 -0.839 . . . . 0.0 110.583 -179.318 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.415 ' O ' ' N ' ' A' ' 26' ' ' ASP . 84.0 mt -73.96 -61.33 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.247 0 O-C-N 120.71 -1.244 . . . . 0.0 109.323 -179.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 34.9 tp -46.31 -30.78 2.2 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.098 -1.001 . . . . 0.0 110.743 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.419 ' CD2' ' CE2' ' A' ' 21' ' ' PHE . 1.1 m80 -84.75 -14.73 47.38 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.27 -1.519 . . . . 0.0 109.424 179.537 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.415 ' N ' ' O ' ' A' ' 23' ' ' ILE . 95.0 m-20 -74.81 94.18 2.73 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.151 -0.968 . . . . 0.0 108.895 179.131 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.413 HD13 HG21 ' A' ' 27' ' ' ILE . 25.7 mt -76.64 -51.6 18.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.346 0 O-C-N 121.414 -0.804 . . . . 0.0 110.964 -178.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.52 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.9 OUTLIER -87.65 7.91 27.81 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 120.753 -1.217 . . . . 0.0 110.03 -179.494 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 24.8 p 44.03 48.88 7.41 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.165 -0.959 . . . . 0.0 110.528 178.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.511 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 19.6 p-10 -91.98 0.01 57.48 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.128 -0.982 . . . . 0.0 108.489 179.1 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 79.28 -2.77 69.51 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 109.791 -1.324 . . . . 0.0 109.791 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -138.61 164.16 26.83 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 O-C-N 121.286 -1.126 . . . . 0.0 108.673 178.374 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.7 tp -113.92 110.04 19.46 Favored 'General case' 0 N--CA 1.511 2.576 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 177.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.72 -176.09 5.13 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.472 -0.768 . . . . 0.0 110.751 -177.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -73.46 -44.49 57.96 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.523 -0.736 . . . . 0.0 111.372 -178.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.51 ' NE2' ' C ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -59.29 -25.0 63.75 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 120.455 -1.403 . . . . 0.0 108.323 -179.768 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -85.02 -33.68 22.47 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 179.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.4 tp -74.65 -32.27 62.22 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.42 -0.8 . . . . 0.0 109.283 179.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.24 -46.51 60.9 Favored 'General case' 0 C--N 1.305 -1.342 0 O-C-N 121.28 -0.888 . . . . 0.0 109.733 -179.524 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.53 -35.51 73.2 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.103 -0.998 . . . . 0.0 110.514 -179.305 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.6 mt -69.3 -25.76 64.39 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.938 -1.101 . . . . 0.0 109.325 -179.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.412 ' CZ ' ' SD ' ' A' ' 69' ' ' MET . 0.1 OUTLIER -81.58 -51.81 7.86 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 120.881 -1.137 . . . . 0.0 109.781 -179.13 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 68.6 m . . . . . 0 C--N 1.301 -1.538 0 O-C-N 121.218 -0.926 . . . . 0.0 111.345 -178.392 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . 0.422 ' CG ' HH11 ' A' ' 66' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 121.21 0.529 . . . . 0.0 109.915 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.633 ' C ' HD12 ' A' ' 67' ' ' LEU . 0.6 OUTLIER -79.68 -27.34 40.78 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.228 -0.92 . . . . 0.0 110.037 -179.149 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -62.05 -39.27 91.8 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.98 -1.075 . . . . 0.0 109.883 -179.347 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . 0.412 ' SD ' ' CZ ' ' A' ' 42' ' ' PHE . 17.8 ttm -86.11 -33.02 21.02 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.05 -1.031 . . . . 0.0 109.859 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 66.4 ttt180 -65.07 -30.33 71.28 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.593 -1.317 . . . . 0.0 109.363 179.17 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 67.0 mt-10 -77.81 -48.18 17.14 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.205 -0.934 . . . . 0.0 109.975 -179.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.519 ' CD2' ' OD1' ' A' ' 76' ' ' ASN . 29.4 t60 -59.63 -35.15 73.81 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.16 -0.962 . . . . 0.0 110.007 -179.488 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 69.6 t -74.47 -54.17 15.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 120.708 -1.245 . . . . 0.0 109.381 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.486 ' SD ' ' OD2' ' A' ' 78' ' ' ASP . 2.7 mmt -58.78 -22.41 58.15 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.087 -1.008 . . . . 0.0 109.298 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.8 ttpt -94.4 -27.66 15.93 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.801 -1.187 . . . . 0.0 110.759 -179.237 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . 0.519 ' OD1' ' CD2' ' A' ' 72' ' ' HIS . 12.9 m120 -105.95 -12.1 15.94 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.159 -0.963 . . . . 0.0 112.643 -177.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 57.3 t -118.13 -34.86 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.533 0 O-C-N 120.372 -1.455 . . . . 0.0 111.397 -178.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.486 ' OD2' ' SD ' ' A' ' 74' ' ' MET . 0.9 OUTLIER -67.15 99.48 0.68 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.241 -1.537 . . . . 0.0 107.574 178.929 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.417 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -80.77 -52.25 7.73 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.213 -0.93 . . . . 0.0 111.891 -177.476 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.529 ' O ' ' N ' ' A' ' 82' ' ' ASP . 9.5 t-20 -99.63 24.1 8.69 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.061 -1.024 . . . . 0.0 109.532 -179.406 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.443 ' C ' ' H ' ' A' ' 83' ' ' ARG . 0.9 OUTLIER 32.95 30.51 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.754 0 CA-C-O 120.985 0.421 . . . . 0.0 112.062 178.697 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.545 ' C ' ' H ' ' A' ' 84' ' ' LEU . 87.0 m-20 -81.03 10.6 4.95 Favored 'General case' 0 C--N 1.299 -1.613 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 178.406 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.443 ' H ' ' C ' ' A' ' 81' ' ' GLN . 25.3 mtp180 65.12 -4.03 0.55 Allowed 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 -178.391 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.545 ' H ' ' C ' ' A' ' 82' ' ' ASP . 4.6 mp -118.48 134.47 55.05 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 178.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 88.9 t -112.3 129.39 67.91 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.076 0 O-C-N 121.617 -0.677 . . . . 0.0 109.541 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 22.0 p -103.36 167.22 9.95 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.262 -0.898 . . . . 0.0 108.722 178.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.726 ' C ' HD13 ' A' ' 87' ' ' LEU . 1.2 tm? -65.15 -35.47 81.21 Favored 'General case' 0 C--N 1.297 -1.705 0 O-C-N 121.383 -0.823 . . . . 0.0 108.782 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -61.75 -70.06 0.21 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.946 -1.096 . . . . 0.0 112.811 -178.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.417 ' CB ' HG21 ' A' ' 79' ' ' THR . 1.7 mt-10 -59.37 -32.66 70.33 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.773 -1.204 . . . . 0.0 110.914 -177.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -58.83 -50.92 72.16 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.92 -1.113 . . . . 0.0 109.901 -179.366 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 78.7 mt -52.78 -48.94 66.49 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 120.924 -1.11 . . . . 0.0 109.602 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -46.66 -44.69 18.7 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.27 -0.894 . . . . 0.0 110.077 -179.52 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 46.5 m -62.41 -30.66 71.38 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.279 -0.888 . . . . 0.0 110.266 -179.309 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 44.6 p . . . . . 0 N--CA 1.498 1.956 0 O-C-N 121.018 -1.051 . . . . 0.0 109.081 179.644 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.465 ' C ' HD22 ' A' ' 17' ' ' ASN . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -65.93 -21.92 56.44 Favored 'Trans proline' 0 C--N 1.319 -0.975 0 C-N-CA 121.588 1.525 . . . . 0.0 110.033 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 69.7 tttt -57.3 -35.85 70.35 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.216 -0.928 . . . . 0.0 110.887 -179.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.4 m -71.01 -41.24 71.15 Favored 'General case' 0 C--N 1.306 -1.303 0 O-C-N 120.785 -1.197 . . . . 0.0 110.272 -178.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.482 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.37 -36.91 69.36 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.042 -1.036 . . . . 0.0 108.487 -179.835 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.482 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 36.4 t80 -67.15 -34.81 78.37 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.335 -0.853 . . . . 0.0 110.135 -179.614 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.1 mt -74.54 -61.18 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.241 0 O-C-N 120.731 -1.23 . . . . 0.0 109.39 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.3 tp -46.57 -37.57 8.24 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.066 -1.021 . . . . 0.0 110.811 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.408 ' ND1' ' N ' ' A' ' 25' ' ' HIS . 0.6 OUTLIER -75.99 -18.26 59.37 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.367 -1.458 . . . . 0.0 109.709 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -75.98 90.67 3.01 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.131 -0.981 . . . . 0.0 108.783 179.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.41 HD13 HG21 ' A' ' 27' ' ' ILE . 13.9 mt -71.23 -52.26 28.28 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 O-C-N 121.319 -0.863 . . . . 0.0 110.801 -178.64 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.54 ' N ' HD22 ' A' ' 28' ' ' ASN . 1.8 m120 -84.08 11.6 7.72 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.831 -1.168 . . . . 0.0 109.83 -179.83 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.0 t 43.88 43.76 5.41 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.222 -0.924 . . . . 0.0 110.373 178.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -87.35 -3.41 59.03 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.009 -1.057 . . . . 0.0 108.819 179.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.38 -0.34 75.42 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -142.42 161.5 19.2 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 O-C-N 121.196 -1.179 . . . . 0.0 108.783 178.621 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.6 mp -113.12 131.74 55.72 Favored 'General case' 0 N--CA 1.517 2.91 0 N-CA-C 107.764 -1.198 . . . . 0.0 107.764 177.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 39.8 p-10 -106.51 174.2 5.99 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 121.371 -0.831 . . . . 0.0 109.934 -179.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -59.63 -7.69 1.63 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.431 -0.793 . . . . 0.0 110.088 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.9 mm100 -85.29 -40.22 16.83 Favored 'General case' 0 C--N 1.297 -1.706 0 O-C-N 121.052 -1.03 . . . . 0.0 109.845 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -67.79 -33.03 74.01 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.157 -0.964 . . . . 0.0 109.56 -179.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.459 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 1.4 mt -80.45 -38.48 29.95 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.958 -1.089 . . . . 0.0 109.38 179.192 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.49 ' OE1' ' N ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -59.76 -41.81 91.88 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.882 -1.137 . . . . 0.0 108.794 179.481 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.07 -29.21 61.76 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.236 -0.915 . . . . 0.0 111.142 -179.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.49 ' O ' HD23 ' A' ' 41' ' ' LEU . 0.8 OUTLIER -76.76 -26.63 54.75 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 120.896 -1.127 . . . . 0.0 110.819 -178.654 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.459 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 28.9 m-85 -80.49 -49.19 11.71 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 120.42 -1.425 . . . . 0.0 108.929 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 53.5 m . . . . . 0 N--CA 1.488 1.447 0 O-C-N 121.245 -0.909 . . . . 0.0 110.277 -179.858 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.488 1.455 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 25.0 mt -79.45 -28.72 41.62 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.459 -0.776 . . . . 0.0 109.303 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -65.42 -37.24 86.36 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.211 -0.93 . . . . 0.0 109.677 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 13.7 mtt -85.34 -37.93 19.36 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.922 -1.111 . . . . 0.0 109.677 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.536 ' CG ' HH11 ' A' ' 70' ' ' ARG . 0.0 OUTLIER -66.25 -51.88 53.17 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.022 -1.049 . . . . 0.0 110.393 -179.386 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -69.85 -51.55 32.43 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.152 -0.967 . . . . 0.0 110.934 -178.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.491 ' CE1' ' OD1' ' A' ' 76' ' ' ASN . 62.0 t-80 -55.73 -42.03 74.77 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.921 -1.112 . . . . 0.0 110.516 -178.792 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 77.4 t -73.05 -54.21 16.37 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 120.645 -1.285 . . . . 0.0 109.804 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.462 ' SD ' ' NH1' ' A' ' 70' ' ' ARG . 37.2 mtp -65.36 -19.67 66.05 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.971 -1.081 . . . . 0.0 110.264 -179.098 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.5 ttpp -94.79 -32.66 13.2 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.727 -1.233 . . . . 0.0 110.237 -179.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . 0.491 ' OD1' ' CE1' ' A' ' 72' ' ' HIS . 6.3 m120 -100.57 -8.79 22.64 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.203 -0.936 . . . . 0.0 111.792 -178.464 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 85.5 t -117.13 -38.04 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.539 0 O-C-N 120.593 -1.317 . . . . 0.0 110.376 179.253 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.401 ' OD2' ' O ' ' A' ' 74' ' ' MET . 83.9 m-20 -49.47 112.38 0.63 Allowed 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.606 -1.309 . . . . 0.0 108.983 178.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.59 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -87.58 -59.24 2.3 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.284 -0.885 . . . . 0.0 110.41 -177.903 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.422 ' ND2' ' O ' ' A' ' 80' ' ' ASN . 1.1 t-20 -103.43 25.53 9.51 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.309 -0.869 . . . . 0.0 109.447 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.403 ' C ' ' O ' ' A' ' 80' ' ' ASN . 1.3 mm100 34.63 48.22 0.29 Allowed 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.054 0.454 . . . . 0.0 112.146 178.363 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.578 ' C ' ' H ' ' A' ' 84' ' ' LEU . 12.8 p-10 -99.72 15.33 27.16 Favored 'General case' 0 N--CA 1.495 1.809 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 178.463 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.449 HH11 ' HG3' ' A' ' 83' ' ' ARG . 10.5 mtm-85 63.06 -2.83 0.38 Allowed 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 -178.345 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.578 ' H ' ' C ' ' A' ' 82' ' ' ASP . 4.8 mp -125.62 135.3 52.03 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 179.524 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 70.2 t -112.81 129.71 67.94 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.083 0 O-C-N 121.552 -0.718 . . . . 0.0 109.615 -178.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 68.8 p -98.1 163.01 12.93 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.225 -0.922 . . . . 0.0 109.13 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.733 ' C ' HD13 ' A' ' 87' ' ' LEU . 1.4 tm? -66.04 -38.61 88.81 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 179.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -59.38 -69.71 0.19 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.344 -0.848 . . . . 0.0 111.456 -179.607 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.59 ' CB ' HG21 ' A' ' 79' ' ' THR . 33.5 mm-40 -57.24 -30.07 64.31 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.101 -0.999 . . . . 0.0 110.36 -178.495 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -61.5 -51.22 69.56 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.024 -1.048 . . . . 0.0 110.076 -179.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 92.4 mt -52.81 -44.98 67.03 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.984 -1.073 . . . . 0.0 109.354 179.294 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -46.9 -49.68 20.0 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.185 -0.947 . . . . 0.0 109.911 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 41.9 m -60.5 -26.27 66.7 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.249 -0.907 . . . . 0.0 110.179 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 26.4 p . . . . . 0 N--CA 1.499 1.992 0 O-C-N 121.213 -0.929 . . . . 0.0 110.047 -179.544 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -65.35 -22.44 59.94 Favored 'Trans proline' 0 C--N 1.319 -1.009 0 C-N-CA 121.509 1.473 . . . . 0.0 109.698 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -56.24 -36.07 68.09 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.352 -0.842 . . . . 0.0 110.991 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 69.9 m -73.17 -41.64 63.65 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 120.687 -1.258 . . . . 0.0 110.617 -178.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -56.39 -35.02 67.27 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.919 -1.113 . . . . 0.0 108.184 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -69.25 -34.96 75.6 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.323 -0.861 . . . . 0.0 109.836 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.485 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.9 mt -69.89 -59.69 3.25 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.157 0 O-C-N 120.798 -1.189 . . . . 0.0 109.006 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 tp -44.49 -36.39 2.92 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.353 -0.842 . . . . 0.0 110.735 -179.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.509 ' ND1' ' N ' ' A' ' 25' ' ' HIS . 0.3 OUTLIER -80.57 -14.19 58.42 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.391 -1.443 . . . . 0.0 109.536 179.758 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.485 ' N ' ' O ' ' A' ' 23' ' ' ILE . 82.1 m-20 -78.34 93.29 4.65 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.174 -0.954 . . . . 0.0 109.236 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 75.5 mt -77.3 -51.8 17.78 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.437 0 O-C-N 121.407 -0.808 . . . . 0.0 110.65 -178.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.714 ' H ' ' ND2' ' A' ' 28' ' ' ASN . 0.0 OUTLIER -88.18 -3.12 58.92 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.917 -1.115 . . . . 0.0 110.234 -179.41 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.488 ' N ' HD22 ' A' ' 28' ' ' ASN . 4.5 t 52.86 57.83 5.96 Favored 'General case' 0 C--N 1.295 -1.796 0 O-C-N 121.263 -0.898 . . . . 0.0 110.402 179.111 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -99.9 7.17 45.08 Favored 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 72.88 5.47 64.93 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.876 -1.29 . . . . 0.0 109.876 -179.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -144.18 164.85 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.985 0 O-C-N 121.196 -1.179 . . . . 0.0 108.565 177.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 tp -112.81 128.6 56.48 Favored 'General case' 0 N--CA 1.512 2.643 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 178.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 40.0 p-10 -104.91 163.04 12.82 Favored 'General case' 0 N--CA 1.504 2.265 0 CA-C-O 121.896 0.855 . . . . 0.0 110.606 -178.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.596 ' CD ' ' H ' ' A' ' 35' ' ' GLU . 1.7 mp0 -57.73 -8.95 1.03 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.911 -0.493 . . . . 0.0 111.069 -179.216 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -85.12 -36.64 20.98 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.765 -1.209 . . . . 0.0 109.548 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -81.12 -34.9 32.22 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 179.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.4 tp -72.75 -42.02 64.51 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.614 -0.679 . . . . 0.0 110.029 179.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -71.85 -34.03 68.93 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.553 -1.342 . . . . 0.0 108.892 179.401 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.3 -28.63 62.2 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.256 -0.902 . . . . 0.0 110.285 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.428 ' O ' HD23 ' A' ' 41' ' ' LEU . 0.7 OUTLIER -70.63 -31.2 68.07 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.913 -1.117 . . . . 0.0 109.855 -179.111 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -77.8 -47.98 17.63 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 120.509 -1.37 . . . . 0.0 109.812 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 54.3 m . . . . . 0 N--CA 1.492 1.657 0 O-C-N 121.069 -1.02 . . . . 0.0 111.321 -178.769 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 47.8 mtt180 . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.901 HD12 ' O ' ' A' ' 67' ' ' LEU . 0.0 OUTLIER -82.68 -33.09 27.78 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.024 -1.048 . . . . 0.0 109.832 -178.936 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.4 tpp180 -63.8 -38.82 92.53 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.111 -0.993 . . . . 0.0 110.009 -179.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 4.0 mtt -83.65 -51.12 7.55 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.068 -1.02 . . . . 0.0 109.272 179.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 29.1 ttp180 -51.07 -41.05 59.67 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.842 -1.161 . . . . 0.0 109.79 179.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -74.91 -52.52 11.05 Favored 'General case' 0 C--N 1.305 -1.343 0 O-C-N 120.841 -1.162 . . . . 0.0 111.166 -178.276 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.457 ' CD2' ' OD1' ' A' ' 76' ' ' ASN . 23.5 t60 -55.95 -36.85 68.24 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.92 -1.112 . . . . 0.0 110.059 -179.587 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 78.9 t -75.56 -55.32 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 120.68 -1.263 . . . . 0.0 109.798 -179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 35.7 mtp -62.48 -18.06 61.01 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.304 -0.872 . . . . 0.0 109.889 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 43.3 tttp -94.01 -37.66 11.55 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.656 -1.277 . . . . 0.0 109.929 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . 0.457 ' OD1' ' CD2' ' A' ' 72' ' ' HIS . 11.9 m120 -98.23 -11.05 23.09 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.146 -0.971 . . . . 0.0 112.05 -178.15 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 64.5 t -111.26 -35.76 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.559 0 O-C-N 120.458 -1.401 . . . . 0.0 109.911 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -57.88 109.46 0.73 Allowed 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.477 -1.39 . . . . 0.0 108.123 177.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.543 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -85.06 -55.15 4.2 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.173 -0.955 . . . . 0.0 111.102 -178.158 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.527 ' O ' ' N ' ' A' ' 82' ' ' ASP . 23.9 m120 -101.95 25.15 9.02 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.231 -0.918 . . . . 0.0 109.687 -179.442 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.419 ' C ' ' H ' ' A' ' 83' ' ' ARG . 0.6 OUTLIER 33.83 29.37 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 178.609 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.527 ' N ' ' O ' ' A' ' 80' ' ' ASN . 19.8 p-10 -81.36 9.98 6.36 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 178.428 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.454 HH11 ' HG3' ' A' ' 83' ' ' ARG . 8.4 mtm-85 66.86 -5.43 0.66 Allowed 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 -178.731 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.523 ' H ' ' C ' ' A' ' 82' ' ' ASP . 13.6 mt -116.81 134.89 54.23 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 107.583 -1.265 . . . . 0.0 107.583 178.661 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 82.0 t -111.49 129.92 65.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.976 0 O-C-N 121.576 -0.703 . . . . 0.0 109.948 -178.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 31.9 p -105.53 159.87 15.61 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.6 tp -60.92 -36.78 80.18 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.382 -0.824 . . . . 0.0 109.223 179.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -60.18 -69.56 0.21 Allowed 'General case' 0 C--N 1.295 -1.788 0 O-C-N 121.254 -0.904 . . . . 0.0 111.495 -177.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.543 ' CB ' HG21 ' A' ' 79' ' ' THR . 14.3 mm-40 -60.42 -30.31 69.53 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.161 -0.962 . . . . 0.0 110.334 -178.396 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -64.91 -51.95 59.12 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.874 -1.142 . . . . 0.0 109.893 -179.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 57.3 mt -48.25 -44.87 33.78 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.142 -0.974 . . . . 0.0 109.294 179.651 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -54.69 -60.3 3.54 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.403 -0.811 . . . . 0.0 110.497 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.0 t -42.44 -35.17 0.97 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.445 -0.784 . . . . 0.0 111.349 -178.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 50.7 p . . . . . 0 N--CA 1.496 1.85 0 O-C-N 120.671 -1.268 . . . . 0.0 108.767 179.93 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 . . . . . 0 N--CA 1.492 1.633 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -63.95 -21.37 68.7 Favored 'Trans proline' 0 C--N 1.317 -1.081 0 C-N-CA 121.354 1.37 . . . . 0.0 109.862 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 55.8 tttp -55.41 -38.64 69.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.434 -0.791 . . . . 0.0 111.15 -179.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 49.4 m -70.78 -41.9 71.06 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 120.477 -1.389 . . . . 0.0 110.37 -178.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.514 ' CE2' ' NE2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -54.46 -44.88 72.93 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 179.761 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.421 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 20.9 t80 -57.67 -34.0 68.92 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.468 -0.77 . . . . 0.0 109.548 179.524 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.52 ' O ' ' N ' ' A' ' 25' ' ' HIS . 92.8 mt -72.41 -61.64 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 O-C-N 120.819 -1.175 . . . . 0.0 108.559 179.403 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 tp -45.48 -14.32 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.072 -1.018 . . . . 0.0 110.846 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.52 ' N ' ' O ' ' A' ' 23' ' ' ILE . 0.6 OUTLIER -104.21 -12.69 16.53 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 120.644 -1.285 . . . . 0.0 110.215 179.909 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.477 ' OD1' ' O ' ' A' ' 23' ' ' ILE . 33.7 p-10 -78.64 67.3 4.36 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.87 -1.144 . . . . 0.0 109.446 179.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 69.1 mt -50.53 -51.91 17.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 O-C-N 121.191 -0.943 . . . . 0.0 110.993 -179.3 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.527 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -89.38 12.44 16.28 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 120.721 -1.237 . . . . 0.0 110.128 -179.454 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.419 ' O ' ' OG ' ' A' ' 29' ' ' SER . 6.9 t 41.71 51.78 4.0 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.355 -0.841 . . . . 0.0 110.774 178.661 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -95.28 1.66 54.56 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.987 -1.071 . . . . 0.0 108.395 179.252 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 74.22 -0.17 54.69 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 109.453 -1.459 . . . . 0.0 109.453 -179.659 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -143.84 162.46 15.68 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 O-C-N 121.289 -1.124 . . . . 0.0 108.905 178.666 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 73.0 mt -107.94 110.76 22.58 Favored 'General case' 0 N--CA 1.513 2.715 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 177.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -86.17 -178.33 6.48 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.481 -0.762 . . . . 0.0 110.127 -179.2 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -73.3 -43.06 61.6 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.292 -0.88 . . . . 0.0 111.468 -178.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.503 ' NE2' ' C ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -61.86 -24.57 67.0 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 120.36 -1.463 . . . . 0.0 108.589 -179.885 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 -86.51 -32.42 20.76 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.375 -0.828 . . . . 0.0 109.069 179.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.0 tp -72.38 -34.96 68.33 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.343 -0.848 . . . . 0.0 109.554 179.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -74.71 -51.18 14.97 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.315 -0.866 . . . . 0.0 110.73 -179.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.24 -32.99 74.8 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.924 -1.11 . . . . 0.0 110.713 -178.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 39.0 tp -74.1 -31.01 62.62 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.85 -1.156 . . . . 0.0 109.942 -179.127 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -84.01 -50.71 7.75 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 120.46 -1.4 . . . . 0.0 109.823 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 43.1 m . . . . . 0 N--CA 1.491 1.594 0 O-C-N 121.066 -1.022 . . . . 0.0 110.447 -179.155 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 25.0 mtm180 . . . . . 0 N--CA 1.494 1.768 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.636 ' C ' HD12 ' A' ' 67' ' ' LEU . 0.7 OUTLIER -74.5 -27.62 60.63 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.276 -0.89 . . . . 0.0 110.075 -179.518 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.475 ' O ' ' NE ' ' A' ' 68' ' ' ARG . 8.7 tpm_? -65.71 -37.96 87.87 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.841 -1.162 . . . . 0.0 109.37 -179.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.6 mtt -84.16 -50.69 7.68 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.224 -0.922 . . . . 0.0 109.131 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.496 ' HG2' HH11 ' A' ' 70' ' ' ARG . 7.1 ttt-85 -52.14 -32.75 37.08 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.979 -1.076 . . . . 0.0 110.02 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 -86.42 -53.48 4.97 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 120.921 -1.112 . . . . 0.0 110.814 -178.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 11.2 t-80 -54.88 -34.6 63.17 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.911 -1.118 . . . . 0.0 110.006 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.41 ' HA ' HD21 ' A' ' 76' ' ' ASN . 54.6 t -74.52 -53.88 15.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 120.672 -1.267 . . . . 0.0 109.738 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.452 ' SD ' ' NH1' ' A' ' 70' ' ' ARG . 29.8 mtp -65.41 -15.67 62.84 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.065 -1.022 . . . . 0.0 110.225 -179.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 42.4 tttp -85.23 -37.98 19.46 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.453 -1.404 . . . . 0.0 110.526 -179.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . 0.671 HD22 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -105.18 -24.3 12.77 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.123 -0.985 . . . . 0.0 112.558 -178.027 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.671 ' H ' HD22 ' A' ' 76' ' ' ASN . 34.1 t -91.18 -36.75 8.39 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.422 0 O-C-N 120.235 -1.541 . . . . 0.0 110.032 -179.362 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -66.7 105.06 1.45 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.411 -1.431 . . . . 0.0 107.606 178.098 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.41 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -83.5 -53.49 5.65 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.327 -0.858 . . . . 0.0 111.587 -177.733 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.471 ' O ' ' N ' ' A' ' 82' ' ' ASP . 6.2 m120 -98.59 23.91 8.08 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.15 -0.968 . . . . 0.0 109.46 -179.345 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.429 ' C ' ' O ' ' A' ' 80' ' ' ASN . 1.3 mm100 31.37 35.07 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 178.786 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.548 ' C ' ' H ' ' A' ' 84' ' ' LEU . 81.3 m-20 -84.99 12.54 7.38 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 178.532 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.531 HH11 ' CG ' ' A' ' 83' ' ' ARG . 3.9 mtt-85 65.03 -4.13 0.53 Allowed 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 -178.485 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.548 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.6 mp -119.31 133.9 55.49 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 179.157 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 92.9 t -112.85 129.54 68.29 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 O-C-N 121.643 -0.66 . . . . 0.0 110.143 -178.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 25.6 p -102.02 174.8 5.77 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 178.161 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -75.07 -32.8 61.57 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.999 -1.063 . . . . 0.0 109.192 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -64.05 -66.51 0.53 Allowed 'General case' 0 C--N 1.294 -1.818 0 O-C-N 120.922 -1.111 . . . . 0.0 111.514 -178.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.423 ' HG2' ' H ' ' A' ' 89' ' ' GLU . 4.2 mm-40 -59.27 -33.64 71.3 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.909 -1.12 . . . . 0.0 110.435 -177.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -66.29 -50.84 62.31 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 120.736 -1.228 . . . . 0.0 109.404 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.9 mp -46.74 -46.39 20.33 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.308 -0.87 . . . . 0.0 108.853 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -52.93 -58.31 7.37 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.221 -0.925 . . . . 0.0 110.277 -179.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 25.4 m -44.31 -27.47 0.43 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.239 -0.913 . . . . 0.0 109.952 -179.402 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 31.8 p . . . . . 0 N--CA 1.497 1.879 0 O-C-N 121.314 -0.866 . . . . 0.0 108.741 179.096 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 . . . . . 0 N--CA 1.494 1.761 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -62.96 -20.49 71.66 Favored 'Trans proline' 0 C--N 1.319 -1.001 0 C-N-CA 121.545 1.496 . . . . 0.0 110.269 -179.415 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -55.81 -36.64 67.66 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.312 -0.868 . . . . 0.0 111.135 -179.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 58.4 m -74.04 -43.27 58.46 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 120.679 -1.263 . . . . 0.0 110.562 -178.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.502 ' CE2' ' CD2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -54.85 -33.97 62.37 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 179.909 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -69.76 -34.52 73.9 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.422 -0.799 . . . . 0.0 109.816 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 97.4 mt -71.87 -60.68 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 O-C-N 120.832 -1.167 . . . . 0.0 108.907 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 tp -46.01 -37.93 7.2 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.313 -0.867 . . . . 0.0 111.048 -179.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.502 ' CD2' ' CE2' ' A' ' 21' ' ' PHE . 0.3 OUTLIER -79.17 -15.11 58.57 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.433 -1.417 . . . . 0.0 110.082 -179.526 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -79.84 96.27 6.28 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.02 -1.05 . . . . 0.0 108.717 179.347 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.3 mt -74.55 -51.98 21.06 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 O-C-N 121.455 -0.778 . . . . 0.0 110.736 -178.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.555 ' N ' HD22 ' A' ' 28' ' ' ASN . 1.8 m120 -86.78 8.57 22.16 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.787 -1.195 . . . . 0.0 109.948 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.443 ' O ' ' OG ' ' A' ' 29' ' ' SER . 5.2 t 44.32 57.47 4.31 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.166 -0.959 . . . . 0.0 110.496 178.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -100.31 0.2 39.66 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.079 -1.013 . . . . 0.0 108.654 179.461 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.67 -2.51 67.71 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -144.31 160.22 15.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.052 -1.263 . . . . 0.0 108.621 178.052 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 17.6 mt -110.89 128.96 55.98 Favored 'General case' 0 N--CA 1.512 2.626 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.448 ' C ' ' H ' ' A' ' 36' ' ' GLN . 24.6 p-10 -105.12 166.83 10.12 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.504 -0.748 . . . . 0.0 109.643 -179.544 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -52.27 -6.34 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.578 -0.701 . . . . 0.0 110.79 -179.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.448 ' H ' ' C ' ' A' ' 34' ' ' ASP . 2.3 mm100 -85.77 -42.66 14.0 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.807 -1.183 . . . . 0.0 109.862 -179.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -80.71 -31.18 36.23 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.0 tp -76.37 -36.82 57.95 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.43 -0.794 . . . . 0.0 109.281 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -74.62 -51.35 14.73 Favored 'General case' 0 N--CA 1.484 1.275 0 O-C-N 120.935 -1.103 . . . . 0.0 109.429 179.385 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.21 -29.53 69.87 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.325 -0.859 . . . . 0.0 110.33 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 41.6 tp -76.71 -27.7 55.57 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.167 -0.958 . . . . 0.0 110.542 -178.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -82.88 -40.06 20.75 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 120.354 -1.466 . . . . 0.0 110.006 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 17.7 m . . . . . 0 N--CA 1.489 1.515 0 O-C-N 120.78 -1.2 . . . . 0.0 109.842 -179.55 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? . . . . . 0 N--CA 1.493 1.678 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 33.4 mt -82.93 -26.54 31.32 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.527 -0.733 . . . . 0.0 109.619 179.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 1.3 tmm_? -65.9 -39.0 90.21 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.9 -1.125 . . . . 0.0 109.735 -179.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.7 mtt -84.97 -50.37 7.54 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.192 -0.943 . . . . 0.0 109.553 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.509 ' NH1' ' SD ' ' A' ' 74' ' ' MET . 11.0 ttt-85 -54.21 -27.85 37.07 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.759 -1.213 . . . . 0.0 110.21 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -84.27 -51.78 6.74 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 120.801 -1.187 . . . . 0.0 110.75 -179.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -54.28 -38.67 66.12 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.088 -1.007 . . . . 0.0 110.823 -179.472 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' VAL . . . . . 0.404 ' HA ' HD21 ' A' ' 76' ' ' ASN . 55.3 t -75.09 -54.49 14.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 O-C-N 120.343 -1.473 . . . . 0.0 110.117 -179.522 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.509 ' SD ' ' NH1' ' A' ' 70' ' ' ARG . 27.5 mtp -62.81 -14.11 41.56 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.227 -0.921 . . . . 0.0 110.291 -179.137 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 42.8 tttm -89.59 -39.45 13.25 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.641 -1.287 . . . . 0.0 110.842 -178.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . 0.658 HD22 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -103.61 -27.58 12.24 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.126 -0.984 . . . . 0.0 112.279 -178.053 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.658 ' H ' HD22 ' A' ' 76' ' ' ASN . 21.6 t -85.21 -29.29 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.233 0 O-C-N 120.144 -1.598 . . . . 0.0 109.118 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.462 ' CG ' ' O ' ' A' ' 74' ' ' MET . 15.2 p-10 -63.28 106.17 0.85 Allowed 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.915 -1.115 . . . . 0.0 108.462 178.52 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . 0.502 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -86.72 -53.49 4.91 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.107 -1.621 . . . . 0.0 110.73 -178.542 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.499 ' O ' ' N ' ' A' ' 82' ' ' ASP . 2.8 m120 -104.12 24.87 10.75 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.301 -0.874 . . . . 0.0 109.737 -179.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' GLN . . . . . 0.421 ' CA ' HE21 ' A' ' 81' ' ' GLN . 0.1 OUTLIER 34.31 30.14 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.862 0 O-C-N 122.041 -0.412 . . . . 0.0 111.932 178.362 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.552 ' C ' ' H ' ' A' ' 84' ' ' LEU . 18.5 p-10 -82.08 9.95 7.57 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.637 -1.29 . . . . 0.0 107.667 178.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.517 HH11 ' CG ' ' A' ' 83' ' ' ARG . 4.1 mtt-85 64.34 -4.31 0.43 Allowed 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 -178.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.552 ' H ' ' C ' ' A' ' 82' ' ' ASP . 6.6 mp -118.38 134.37 55.11 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 178.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 94.6 t -112.4 130.45 66.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.047 0 O-C-N 121.564 -0.71 . . . . 0.0 110.336 -178.359 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 16.9 p -105.93 166.41 10.5 Favored 'General case' 0 N--CA 1.499 1.999 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 178.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.9 tp -64.54 -36.63 84.84 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.273 -0.892 . . . . 0.0 109.344 179.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.536 ' H ' ' CD ' ' A' ' 88' ' ' GLU . 8.8 mp0 -61.49 -68.16 0.34 Allowed 'General case' 0 C--N 1.293 -1.874 0 O-C-N 120.751 -1.218 . . . . 0.0 111.806 -177.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLU . . . . . 0.502 ' CB ' HG21 ' A' ' 79' ' ' THR . 1.0 OUTLIER -58.71 -33.66 70.44 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 120.738 -1.226 . . . . 0.0 110.479 -177.91 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -64.34 -51.39 63.6 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.865 -1.147 . . . . 0.0 108.821 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 2.7 mp -48.93 -42.71 38.13 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 89' ' ' GLU . . . -47.99 -61.38 2.0 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.257 -0.902 . . . . 0.0 109.701 179.616 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 95.1 p -48.04 -33.05 7.42 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.282 -0.886 . . . . 0.0 110.302 -179.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.5 2.04 0 O-C-N 121.212 -0.93 . . . . 0.0 109.483 -179.879 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 14.2 mt . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -95.35 95.61 8.58 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.152 -0.968 . . . . 0.0 109.175 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.436 ' O ' ' O ' ' A' ' 4' ' ' VAL . 54.4 tt0 -62.26 -62.31 1.86 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.251 -0.905 . . . . 0.0 109.689 -179.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.436 ' O ' ' O ' ' A' ' 3' ' ' GLU . 4.2 t 59.78 148.73 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.513 -0.742 . . . . 0.0 109.585 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 53.6 m95 -74.44 104.88 5.34 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.101 -0.999 . . . . 0.0 109.544 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -61.74 167.39 3.64 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.266 -0.896 . . . . 0.0 109.358 179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -164.63 90.57 0.55 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.24 -0.913 . . . . 0.0 109.579 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 17.9 mt -66.17 155.73 36.11 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.215 -0.928 . . . . 0.0 109.3 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.532 ' C ' ' H ' ' A' ' 11' ' ' LEU . 34.9 t70 -140.31 152.23 45.68 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.333 -0.854 . . . . 0.0 108.962 179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.406 ' O ' ' CB ' ' A' ' 11' ' ' LEU . . . 64.37 -11.36 0.23 Allowed Glycine 0 N--CA 1.492 2.408 0 O-C-N 120.834 -1.166 . . . . 0.0 110.257 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.532 ' H ' ' C ' ' A' ' 9' ' ' ASP . 5.8 tp 76.66 101.44 0.07 Allowed 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 -178.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.538 ' C ' ' H ' ' A' ' 14' ' ' ASN . 8.7 p30 -46.31 150.13 1.2 Allowed Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.364 -0.835 . . . . 0.0 109.398 -179.139 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -65.01 14.07 0.09 OUTLIER 'Trans proline' 0 C--N 1.323 -0.783 0 C-N-CA 121.242 1.295 . . . . 0.0 110.116 179.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.538 ' H ' ' C ' ' A' ' 12' ' ' ASP . 27.0 t-20 -80.47 63.14 4.82 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.007 -1.058 . . . . 0.0 109.621 -179.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.525 HH11 ' CG ' ' A' ' 15' ' ' ARG . 0.3 OUTLIER -46.96 169.55 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.3 -0.875 . . . . 0.0 109.705 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.412 ' O ' ' O ' ' A' ' 15' ' ' ARG . 35.0 m-85 -53.78 -173.78 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.262 -0.899 . . . . 0.0 109.568 -179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -156.66 66.97 4.24 Favored Pre-proline 0 N--CA 1.493 1.704 0 O-C-N 121.303 -0.873 . . . . 0.0 109.713 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -63.82 -18.69 65.0 Favored 'Trans proline' 0 C--N 1.319 -1.02 0 C-N-CA 121.519 1.479 . . . . 0.0 110.004 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -56.21 -39.61 72.75 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.331 -0.855 . . . . 0.0 111.176 -179.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 71.9 m -70.91 -38.91 72.99 Favored 'General case' 0 C--N 1.308 -1.217 0 O-C-N 120.619 -1.301 . . . . 0.0 110.668 -178.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.426 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.04 -34.33 65.78 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 179.94 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.428 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 22.9 t80 -68.79 -35.17 76.7 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.396 -0.815 . . . . 0.0 109.665 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 97.9 mt -69.91 -60.4 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 O-C-N 120.796 -1.19 . . . . 0.0 108.974 179.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.7 tp -45.86 -38.6 7.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.286 -0.884 . . . . 0.0 110.709 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 25.4 m170 -78.9 -11.86 60.01 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.298 -1.501 . . . . 0.0 109.974 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.428 ' OD1' ' O ' ' A' ' 22' ' ' PHE . 55.1 m-20 -81.65 92.79 6.63 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.872 -1.142 . . . . 0.0 108.965 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.41 HD13 HG21 ' A' ' 27' ' ' ILE . 26.1 mt -75.74 -51.57 20.26 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.371 0 O-C-N 121.331 -0.856 . . . . 0.0 110.877 -178.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.528 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -87.94 12.88 12.1 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 120.876 -1.14 . . . . 0.0 110.105 -179.663 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.0 t 43.27 55.68 4.58 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.255 -0.903 . . . . 0.0 110.533 179.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 13.8 p30 -97.92 -6.23 32.7 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.117 -0.99 . . . . 0.0 108.511 179.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.85 -3.74 63.61 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 109.664 -1.375 . . . . 0.0 109.664 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -140.93 163.16 22.03 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 O-C-N 121.263 -1.14 . . . . 0.0 108.486 178.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 72.3 mt -120.47 121.53 38.68 Favored 'General case' 0 N--CA 1.515 2.819 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 178.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 13.9 p-10 -103.89 179.51 4.25 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.108 -0.995 . . . . 0.0 110.18 -179.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.1 tm-20 -55.71 -14.55 2.31 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.61 -0.681 . . . . 0.0 111.232 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.538 ' NE2' ' O ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -82.68 -28.06 30.86 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.283 -1.511 . . . . 0.0 109.679 179.663 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.7 mm-40 -81.39 -37.32 28.37 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.743 -1.223 . . . . 0.0 109.411 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.536 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 2.3 mt -73.58 -32.01 63.9 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 120.992 -1.067 . . . . 0.0 108.539 178.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -59.94 -47.87 84.03 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 120.909 -1.119 . . . . 0.0 108.874 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.31 -28.92 62.35 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.267 -0.895 . . . . 0.0 110.897 -179.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.55 ' O ' HD23 ' A' ' 41' ' ' LEU . 0.8 OUTLIER -72.22 -25.77 61.77 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 120.923 -1.111 . . . . 0.0 110.227 -178.952 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.536 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 38.1 m-85 -81.5 -51.38 8.34 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.538 -1.351 . . . . 0.0 109.275 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 64.3 m -59.8 -33.32 71.57 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.147 -0.97 . . . . 0.0 110.32 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.3 ttmt -73.9 -36.85 64.78 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.236 -0.915 . . . . 0.0 110.592 -179.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -56.15 -34.5 66.21 Favored 'General case' 0 C--N 1.298 -1.658 0 O-C-N 120.487 -1.383 . . . . 0.0 108.023 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 12.6 mt -67.62 -24.11 65.43 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 119.38 -0.928 . . . . 0.0 108.966 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -70.9 -29.96 66.17 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.276 -0.89 . . . . 0.0 109.273 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.8 mttt -91.25 13.78 16.22 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.247 -0.908 . . . . 0.0 110.233 -179.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 38.6 t -147.51 -58.53 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.893 0 O-C-N 120.97 -1.081 . . . . 0.0 109.544 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.405 ' HB3' ' H ' ' A' ' 51' ' ' ASP . 14.6 m-85 -72.57 -151.32 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.21 -0.931 . . . . 0.0 108.571 179.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.405 ' H ' ' HB3' ' A' ' 50' ' ' TYR . 9.2 t70 -173.42 72.28 0.38 Allowed Pre-proline 0 N--CA 1.5 2.036 0 O-C-N 120.735 -1.228 . . . . 0.0 108.77 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -65.69 174.34 5.62 Favored 'Trans proline' 0 C--N 1.318 -1.035 0 C-N-CA 121.71 1.607 . . . . 0.0 110.468 -179.004 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.596 ' CG ' ' H ' ' A' ' 54' ' ' ASN . 0.0 OUTLIER -165.85 -90.66 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 179.57 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.681 ' N ' HD22 ' A' ' 54' ' ' ASN . 0.0 OUTLIER -147.87 34.09 0.84 Allowed 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.511 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.468 ' CD ' ' H ' ' A' ' 56' ' ' GLU . 12.8 tp10 -115.35 161.56 18.34 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 -179.617 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.468 ' H ' ' CD ' ' A' ' 55' ' ' GLU . 14.2 mp0 -133.45 87.46 2.39 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.322 -0.861 . . . . 0.0 109.07 179.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -171.32 -67.71 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.268 -0.895 . . . . 0.0 109.935 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 38.7 m-20 -56.95 -20.66 24.83 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.215 -0.928 . . . . 0.0 110.122 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 78.2 mmm -97.18 44.03 1.06 Allowed 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.274 -0.891 . . . . 0.0 109.403 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -143.2 -55.3 0.4 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.336 -0.853 . . . . 0.0 109.183 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -59.37 -41.12 88.59 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.984 -1.073 . . . . 0.0 109.588 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.557 ' O ' ' N ' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -70.71 -14.18 62.35 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.214 -0.929 . . . . 0.0 110.32 -179.548 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.416 ' C ' ' O ' ' A' ' 62' ' ' MET . 12.9 pt-20 -37.89 -24.75 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.794 -0.566 . . . . 0.0 110.543 -179.28 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.557 ' N ' ' O ' ' A' ' 62' ' ' MET . 25.4 mm-40 -57.78 -24.08 55.43 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.24 -0.913 . . . . 0.0 109.609 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -76.0 -46.1 31.26 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.248 -0.907 . . . . 0.0 110.013 -179.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 36.1 mtm180 -53.74 -47.48 70.59 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.127 -0.983 . . . . 0.0 109.038 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 24.6 mt -67.29 -28.21 67.82 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.124 -0.985 . . . . 0.0 109.691 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.509 ' HG2' HH11 ' A' ' 68' ' ' ARG . 0.0 OUTLIER -63.23 -37.69 88.22 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.189 -0.944 . . . . 0.0 109.552 -179.649 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 7.2 mtt -84.67 -49.72 8.27 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.194 -0.941 . . . . 0.0 109.569 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.4 ttm180 -52.35 -32.19 37.13 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.857 -1.152 . . . . 0.0 110.427 -179.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -84.13 -52.35 6.35 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.086 -1.008 . . . . 0.0 111.004 -178.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 16.3 t60 -55.33 -41.77 72.9 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.003 -1.061 . . . . 0.0 110.179 -179.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 71.3 t -70.53 -50.48 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 120.69 -1.256 . . . . 0.0 109.203 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.435 ' O ' ' OD1' ' A' ' 78' ' ' ASP . 6.3 mmt -63.63 -19.87 65.23 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.21 -0.931 . . . . 0.0 110.23 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -99.33 -38.65 8.76 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 120.791 -1.193 . . . . 0.0 111.004 -178.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.695 ' N ' HD22 ' A' ' 76' ' ' ASN . 0.7 OUTLIER -93.47 -11.75 31.33 Favored 'General case' 0 N--CA 1.501 2.085 0 O-C-N 120.784 -1.198 . . . . 0.0 111.985 -178.264 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 98.1 t -114.64 -33.18 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.495 0 CA-C-N 120.3 1.409 . . . . 0.0 110.313 179.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.435 ' OD1' ' O ' ' A' ' 74' ' ' MET . 10.4 p-10 -51.33 109.65 0.36 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.598 -1.313 . . . . 0.0 108.821 179.058 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.579 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.2 OUTLIER -87.78 -61.93 1.61 Allowed 'General case' 0 N--CA 1.488 1.464 0 O-C-N 120.842 -1.161 . . . . 0.0 110.032 -178.13 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.824 ' H ' HD22 ' A' ' 80' ' ' ASN . 0.1 OUTLIER -102.96 18.19 22.22 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 121.289 -0.882 . . . . 0.0 109.786 -179.703 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.434 ' OE1' ' OD2' ' A' ' 78' ' ' ASP . 0.2 OUTLIER 42.58 75.4 0.09 Allowed 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.485 -0.759 . . . . 0.0 111.112 178.091 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.577 ' C ' ' H ' ' A' ' 84' ' ' LEU . 28.3 t70 -131.24 16.38 5.03 Favored 'General case' 0 N--CA 1.499 1.978 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 35.1 mtm180 60.82 -3.67 0.15 Allowed 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 -178.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.577 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.0 mp -124.59 134.57 52.9 Favored 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 78.4 t -111.58 125.87 68.93 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.985 0 O-C-N 121.654 -0.654 . . . . 0.0 109.666 -178.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 62.2 p -96.88 163.35 13.01 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.188 -0.945 . . . . 0.0 108.98 179.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.0 tp -66.3 -36.68 83.57 Favored 'General case' 0 N--CA 1.492 1.665 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 74.8 mt-10 -60.27 -68.69 0.27 Allowed 'General case' 0 C--N 1.295 -1.779 0 O-C-N 121.62 -0.675 . . . . 0.0 110.915 -178.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.579 ' CB ' HG21 ' A' ' 79' ' ' THR . 29.8 mm-40 -59.74 -30.24 68.7 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.236 -0.915 . . . . 0.0 110.547 -178.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -64.82 -50.93 64.78 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.936 -1.103 . . . . 0.0 109.663 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.537 ' O ' ' N ' ' A' ' 95' ' ' GLN . 68.1 mt -49.97 -43.32 50.2 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.156 -0.965 . . . . 0.0 108.998 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -51.78 -60.95 2.59 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.222 -0.923 . . . . 0.0 110.033 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 98.8 p -45.12 -26.32 0.45 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.193 -0.942 . . . . 0.0 110.089 -179.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.438 ' OG1' ' N ' ' A' ' 95' ' ' GLN . 23.3 p -100.64 -63.36 1.14 Allowed 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.328 -0.858 . . . . 0.0 109.468 179.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.537 ' N ' ' O ' ' A' ' 91' ' ' LEU . 25.5 mt-30 -42.39 -50.77 5.08 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.457 -0.777 . . . . 0.0 110.672 -179.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 18.6 mmt180 -59.49 85.03 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.878 -1.139 . . . . 0.0 109.439 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.478 ' N ' ' O ' ' A' ' 95' ' ' GLN . 87.3 tttt -48.92 -52.04 26.82 Favored 'General case' 0 C--N 1.305 -1.355 0 O-C-N 121.266 -0.896 . . . . 0.0 109.713 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.546 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 17.2 mp0 -60.65 87.02 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.345 -0.847 . . . . 0.0 109.548 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.403 ' N ' ' O ' ' A' ' 97' ' ' LYS . 79.3 t80 . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 117.963 -1.018 . . . . 0.0 109.37 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 51.6 tp . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.466 ' CD ' ' N ' ' A' ' 2' ' ' LYS . 3.6 mptp? -79.9 172.09 14.24 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.271 -0.893 . . . . 0.0 109.268 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.417 ' O ' ' O ' ' A' ' 2' ' ' LYS . 34.9 tt0 52.88 98.75 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.312 -0.867 . . . . 0.0 109.47 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.469 HG22 ' H ' ' A' ' 6' ' ' GLU . 12.0 p -73.46 141.45 16.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.328 -0.858 . . . . 0.0 109.385 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 5.2 m0 -63.98 -39.01 93.16 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.22 -0.925 . . . . 0.0 109.691 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.469 ' H ' HG22 ' A' ' 4' ' ' VAL . 41.0 tt0 -140.2 -75.7 0.34 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.269 -0.894 . . . . 0.0 109.373 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.502 ' C ' HD12 ' A' ' 8' ' ' LEU . 40.0 tt0 -167.84 -38.57 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.146 -0.971 . . . . 0.0 109.645 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.502 HD12 ' C ' ' A' ' 7' ' ' GLU . 8.8 mp -117.67 111.48 19.21 Favored 'General case' 0 N--CA 1.506 2.34 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 179.056 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 63.0 t0 -76.3 31.93 0.12 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.388 -0.82 . . . . 0.0 109.444 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.445 ' H ' ' C ' ' A' ' 8' ' ' LEU . . . 66.5 60.41 6.28 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.469 -1.452 . . . . 0.0 109.469 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 19.7 mt -61.69 -56.94 14.3 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.261 -1.14 . . . . 0.0 109.454 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.455 ' C ' ' H ' ' A' ' 14' ' ' ASN . 21.0 p30 -151.71 68.86 7.74 Favored Pre-proline 0 N--CA 1.494 1.749 0 O-C-N 121.246 -0.909 . . . . 0.0 109.339 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.545 ' O ' ' N ' ' A' ' 15' ' ' ARG . 3.4 Cg_exo -61.97 0.4 1.25 Allowed 'Trans proline' 0 C--N 1.318 -1.051 0 C-N-CA 121.45 1.433 . . . . 0.0 109.795 -179.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.455 ' H ' ' C ' ' A' ' 12' ' ' ASP . 1.9 m-20 -64.69 64.01 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.461 -0.774 . . . . 0.0 109.809 -179.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.545 ' N ' ' O ' ' A' ' 13' ' ' PRO . 67.2 ttt180 -172.5 121.48 0.42 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.336 -0.853 . . . . 0.0 109.047 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.52 ' CE2' ' O ' ' A' ' 13' ' ' PRO . 66.5 m-85 -158.01 -164.4 1.51 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.087 -1.008 . . . . 0.0 109.849 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -115.81 91.61 31.2 Favored Pre-proline 0 N--CA 1.498 1.93 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -57.7 -14.73 18.31 Favored 'Trans proline' 0 C--N 1.323 -0.806 0 C-N-CA 121.034 1.156 . . . . 0.0 110.266 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -55.9 -33.61 64.8 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.373 -0.829 . . . . 0.0 110.493 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 53.0 m -74.4 -41.81 60.28 Favored 'General case' 0 C--N 1.307 -1.268 0 O-C-N 120.89 -1.131 . . . . 0.0 110.385 -178.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.617 ' CE2' ' NE2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -55.86 -34.45 65.48 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -69.61 -36.05 75.83 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.392 -0.818 . . . . 0.0 109.791 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.471 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.7 mt -70.7 -60.48 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.232 0 O-C-N 120.711 -1.243 . . . . 0.0 109.056 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.9 tp -45.37 -36.67 4.37 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.245 -0.91 . . . . 0.0 110.692 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.617 ' NE2' ' CE2' ' A' ' 21' ' ' PHE . 0.4 OUTLIER -77.33 -15.67 59.29 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.4 -1.437 . . . . 0.0 109.451 179.787 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.471 ' N ' ' O ' ' A' ' 23' ' ' ILE . 68.6 m-20 -78.8 87.58 4.67 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.119 -0.988 . . . . 0.0 108.92 179.243 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 19.9 mt -71.4 -52.43 26.59 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 O-C-N 121.277 -0.89 . . . . 0.0 110.806 -178.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.694 ' N ' HD22 ' A' ' 28' ' ' ASN . 0.9 OUTLIER -86.38 11.6 12.0 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.826 -1.171 . . . . 0.0 109.84 -179.787 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 27.6 p 44.42 56.31 5.09 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.201 -0.937 . . . . 0.0 110.245 179.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.407 ' OD1' ' O ' ' A' ' 32' ' ' VAL . 41.8 p-10 -98.07 -5.94 32.78 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.236 -0.915 . . . . 0.0 108.603 179.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 79.97 -1.7 78.27 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.914 -1.274 . . . . 0.0 109.914 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.407 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 0.9 OUTLIER -143.59 163.55 15.71 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 121.072 -1.252 . . . . 0.0 108.545 178.412 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.451 HD21 ' OD1' ' A' ' 26' ' ' ASP . 39.7 mt -113.22 125.63 54.53 Favored 'General case' 0 N--CA 1.514 2.734 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 178.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.426 ' OD1' ' OE2' ' A' ' 37' ' ' GLU . 42.6 p-10 -103.69 173.85 6.12 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.316 -0.865 . . . . 0.0 109.73 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 61.2 mt-10 -55.8 -8.86 0.46 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.547 -0.72 . . . . 0.0 110.157 -179.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -83.35 -43.24 16.16 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.86 -1.15 . . . . 0.0 108.786 179.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.53 ' OE1' ' N ' ' A' ' 37' ' ' GLU . 0.3 OUTLIER -70.54 -29.26 65.68 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 179.34 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.407 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 10.2 mp -83.1 -39.43 21.13 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.234 -0.916 . . . . 0.0 108.936 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -64.07 -49.58 71.76 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.788 -1.195 . . . . 0.0 108.728 179.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.97 -28.4 67.42 Favored 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.418 -0.801 . . . . 0.0 110.559 -179.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 32.5 tp -76.26 -28.52 57.12 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.991 -1.068 . . . . 0.0 110.88 -178.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.407 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 29.6 m-85 -74.46 -49.03 23.9 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 120.058 -1.651 . . . . 0.0 108.442 179.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 59.4 m -58.0 -35.58 71.42 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.288 -0.883 . . . . 0.0 110.246 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 24.9 ttmt -74.98 -45.45 41.98 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.274 -0.891 . . . . 0.0 111.814 -178.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -53.26 -27.79 24.29 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.144 -1.598 . . . . 0.0 108.564 -179.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 16.4 mt -83.33 -26.95 30.09 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.211 -0.931 . . . . 0.0 109.879 179.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -53.99 -37.58 64.15 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.087 -1.008 . . . . 0.0 109.698 -179.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 15.7 pttp -84.55 22.21 1.34 Allowed 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.058 -1.026 . . . . 0.0 110.293 -179.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 20.3 t -133.36 -57.84 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 O-C-N 121.278 -0.889 . . . . 0.0 109.534 179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 58.5 m-85 -102.38 -159.86 0.75 Allowed 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.255 -0.903 . . . . 0.0 109.191 179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -142.01 70.92 23.67 Favored Pre-proline 0 N--CA 1.497 1.895 0 O-C-N 121.15 -0.969 . . . . 0.0 109.24 -179.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -61.93 174.42 2.42 Favored 'Trans proline' 0 C--N 1.317 -1.121 0 C-N-CA 121.456 1.438 . . . . 0.0 110.065 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 13.0 mmtp -111.21 42.74 1.59 Allowed 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 108.852 -0.796 . . . . 0.0 108.852 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 4.9 m120 55.87 19.25 3.43 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.301 -0.875 . . . . 0.0 109.427 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -147.56 130.78 16.47 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.306 -0.871 . . . . 0.0 109.396 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.485 ' O ' ' N ' ' A' ' 58' ' ' ASP . 64.2 mt-10 -68.2 -19.33 64.75 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.227 -0.92 . . . . 0.0 109.493 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 34.1 p30 -67.36 43.73 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.255 -0.903 . . . . 0.0 109.699 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.485 ' N ' ' O ' ' A' ' 56' ' ' GLU . 16.2 t70 -171.4 -12.14 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.144 -0.972 . . . . 0.0 109.805 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.409 ' H ' ' H ' ' A' ' 58' ' ' ASP . 60.0 mmm -85.0 -7.85 58.97 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.958 -1.089 . . . . 0.0 109.614 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 57.9 mtp180 -60.29 104.52 0.33 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.092 -1.005 . . . . 0.0 109.256 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -174.15 -71.74 0.01 OUTLIER 'General case' 0 C--N 1.296 -1.721 0 N-CA-C 107.866 -1.161 . . . . 0.0 107.866 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.552 ' O ' ' N ' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -93.39 17.79 10.79 Favored 'General case' 0 N--CA 1.492 1.668 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 178.474 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -41.05 -20.36 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.826 0 CA-C-O 121.441 0.639 . . . . 0.0 109.711 -179.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.552 ' N ' ' O ' ' A' ' 62' ' ' MET . 52.7 mt-10 -54.88 -38.64 67.8 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.36 -0.838 . . . . 0.0 109.466 179.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.52 ' OE2' ' NE ' ' A' ' 68' ' ' ARG . 38.1 tp10 -72.46 -34.92 68.09 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.247 -0.908 . . . . 0.0 109.282 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.518 ' CG ' HH11 ' A' ' 66' ' ' ARG . 0.2 OUTLIER -50.85 -48.64 59.98 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.542 -0.724 . . . . 0.0 109.711 -179.893 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.63 ' C ' HD12 ' A' ' 67' ' ' LEU . 0.6 OUTLIER -73.58 -27.36 61.27 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.348 -0.845 . . . . 0.0 109.722 -179.525 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.52 ' NE ' ' OE2' ' A' ' 65' ' ' GLU . 6.8 tmm_? -59.9 -39.88 86.9 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.06 -1.025 . . . . 0.0 109.387 -179.596 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 10.6 mtt -86.09 -50.1 7.28 Favored 'General case' 0 N--CA 1.496 1.875 0 O-C-N 121.011 -1.055 . . . . 0.0 109.297 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 62.4 ttt180 -54.65 -46.79 74.05 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 120.976 -1.078 . . . . 0.0 110.761 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -74.34 -53.0 10.55 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.95 -1.094 . . . . 0.0 111.303 -178.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -54.4 -41.15 68.93 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.954 -1.091 . . . . 0.0 110.248 -179.196 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 71.9 t -73.13 -53.45 18.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 120.765 -1.209 . . . . 0.0 109.581 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.428 ' O ' ' CG ' ' A' ' 78' ' ' ASP . 28.7 mtp -64.35 -17.42 63.7 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.121 -0.987 . . . . 0.0 109.916 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 26.2 ttpt -95.73 -37.31 10.83 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 120.783 -1.198 . . . . 0.0 110.385 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.707 ' N ' HD22 ' A' ' 76' ' ' ASN . 0.7 OUTLIER -98.01 -10.49 24.33 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.018 -1.051 . . . . 0.0 112.065 -178.458 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 95.1 t -114.93 -32.93 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.595 0 O-C-N 120.407 -1.433 . . . . 0.0 110.337 179.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.501 ' C ' ' NE2' ' A' ' 81' ' ' GLN . 19.0 p-10 -49.28 111.99 0.57 Allowed 'General case' 0 N--CA 1.498 1.929 0 O-C-N 120.642 -1.286 . . . . 0.0 108.645 178.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -90.06 -68.77 0.76 Allowed 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.145 -0.972 . . . . 0.0 110.645 -177.53 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.509 ' O ' ' N ' ' A' ' 82' ' ' ASP . 7.0 m120 -97.27 25.61 5.43 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.02 -1.05 . . . . 0.0 108.34 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.846 ' NE2' ' H ' ' A' ' 81' ' ' GLN . 0.0 OUTLIER 35.19 29.12 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 115.464 -0.789 . . . . 0.0 111.087 178.106 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.509 ' N ' ' O ' ' A' ' 80' ' ' ASN . 59.7 t0 -82.81 14.59 3.13 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 178.196 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.518 HH11 ' CG ' ' A' ' 83' ' ' ARG . 4.1 mtt-85 61.87 3.69 0.97 Allowed 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 -178.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.495 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.7 mp -125.2 134.24 52.44 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 71.6 t -111.69 130.5 65.16 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 O-C-N 121.618 -0.676 . . . . 0.0 109.55 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 60.1 p -103.59 165.16 11.2 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.325 -0.859 . . . . 0.0 108.859 179.057 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.8 tp -66.37 -36.05 81.88 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.246 -0.909 . . . . 0.0 108.624 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -58.05 -69.32 0.18 Allowed 'General case' 0 C--N 1.295 -1.787 0 O-C-N 121.292 -0.88 . . . . 0.0 111.123 -178.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -62.73 -30.94 71.8 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.196 -0.94 . . . . 0.0 110.903 -178.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 15.1 t80 -60.8 -51.04 71.02 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 120.789 -1.195 . . . . 0.0 109.39 -179.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -51.16 -48.64 61.83 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 179.124 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -44.33 -49.3 9.56 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.441 -0.787 . . . . 0.0 110.465 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 46.6 m -60.43 -29.91 69.3 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.065 -1.022 . . . . 0.0 110.558 -178.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.405 ' O ' ' C ' ' A' ' 95' ' ' GLN . 30.3 p -98.68 -3.13 36.67 Favored 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.112 -0.992 . . . . 0.0 110.308 -179.506 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.405 ' C ' ' O ' ' A' ' 94' ' ' THR . 2.7 tt0 -42.42 -48.08 5.1 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.181 -0.95 . . . . 0.0 110.749 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.538 ' O ' ' N ' ' A' ' 98' ' ' GLU . 16.2 tpt180 -141.04 -28.92 0.67 Allowed 'General case' 0 N--CA 1.497 1.877 0 O-C-N 120.923 -1.111 . . . . 0.0 109.778 -179.657 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 56.9 tttm -52.41 86.42 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.308 0 O-C-N 121.189 -0.944 . . . . 0.0 110.109 -179.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.538 ' N ' ' O ' ' A' ' 96' ' ' ARG . 1.5 pp20? -167.19 129.27 1.66 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.154 -0.966 . . . . 0.0 109.438 179.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.475 ' OXT' ' CD2' ' A' ' 99' ' ' PHE . 58.2 t80 . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 117.958 -1.02 . . . . 0.0 109.457 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.576 ' N ' HD22 ' A' ' 1' ' ' LEU . 3.5 mm? . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 60.9 tttp -61.63 107.47 0.81 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.22 -0.925 . . . . 0.0 109.508 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -169.67 162.87 9.93 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.265 -0.897 . . . . 0.0 109.43 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.0 m -149.79 135.09 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.251 -0.906 . . . . 0.0 109.444 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.443 ' CZ3' ' O ' ' A' ' 6' ' ' GLU . 5.8 p-90 -80.8 12.2 3.38 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.317 -0.864 . . . . 0.0 109.454 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.443 ' O ' ' CZ3' ' A' ' 5' ' ' TRP . 25.7 tp10 49.52 -102.37 0.1 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.285 -0.885 . . . . 0.0 109.436 179.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -165.43 -31.46 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.022 -1.048 . . . . 0.0 109.595 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.5 pp -165.08 137.04 4.27 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.215 -0.928 . . . . 0.0 109.536 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -99.4 24.99 7.4 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.321 -0.862 . . . . 0.0 109.53 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -83.01 8.75 62.26 Favored Glycine 0 N--CA 1.494 2.516 0 N-CA-C 109.345 -1.502 . . . . 0.0 109.345 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.622 HD22 ' N ' ' A' ' 11' ' ' LEU . 3.3 mm? 56.28 32.04 19.66 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.727 -0.866 . . . . 0.0 110.121 -179.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.489 ' C ' ' H ' ' A' ' 14' ' ' ASN . 6.3 m-20 43.36 76.94 0.48 Allowed Pre-proline 0 N--CA 1.503 2.224 0 O-C-N 121.112 -0.993 . . . . 0.0 110.601 178.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_endo -70.2 9.57 0.65 Allowed 'Trans proline' 0 C--N 1.319 -0.998 0 C-N-CA 121.528 1.485 . . . . 0.0 108.895 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.524 ' O ' ' N ' ' A' ' 16' ' ' PHE . 17.3 m120 -98.21 93.22 6.12 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.532 ' NE ' ' O ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -44.14 -18.19 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 179.921 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.524 ' N ' ' O ' ' A' ' 14' ' ' ASN . 6.9 t80 78.39 60.43 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.638 -0.664 . . . . 0.0 110.272 179.442 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 24.5 m120 47.53 83.78 0.21 Allowed Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.182 -0.949 . . . . 0.0 110.035 178.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -59.23 -11.67 13.85 Favored 'Trans proline' 0 C--N 1.32 -0.926 0 C-N-CA 121.272 1.314 . . . . 0.0 110.252 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.1 ttpm? -57.3 -40.92 78.87 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.285 -0.885 . . . . 0.0 110.718 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 48.6 m -66.33 -39.71 89.42 Favored 'General case' 0 C--N 1.307 -1.261 0 O-C-N 120.863 -1.148 . . . . 0.0 110.248 -178.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -55.96 -34.7 65.95 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 108.077 -1.083 . . . . 0.0 108.077 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 23.5 t80 -68.77 -35.34 76.95 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.317 -0.864 . . . . 0.0 109.741 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.6 mt -72.58 -61.56 1.65 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 O-C-N 120.764 -1.21 . . . . 0.0 108.865 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.7 tp -46.38 -35.83 5.85 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.198 -0.939 . . . . 0.0 110.765 179.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.521 ' O ' ' ND1' ' A' ' 25' ' ' HIS . 0.9 OUTLIER -78.88 -14.57 59.16 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.46 -1.4 . . . . 0.0 109.691 -179.971 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.435 ' OD1' HD21 ' A' ' 33' ' ' LEU . 94.5 m-20 -78.97 92.9 5.0 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.98 -1.075 . . . . 0.0 108.875 179.108 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.416 HD13 HG21 ' A' ' 27' ' ' ILE . 23.1 mt -75.09 -52.28 19.24 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.322 0 O-C-N 121.235 -0.916 . . . . 0.0 110.724 -178.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.506 ' N ' HD22 ' A' ' 28' ' ' ASN . 2.2 m120 -87.42 12.69 11.54 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 120.848 -1.158 . . . . 0.0 110.086 -179.51 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 1.4 m 43.94 55.92 4.98 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.204 -0.935 . . . . 0.0 110.611 178.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.418 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 12.0 t70 -98.19 -3.09 38.32 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.106 -0.996 . . . . 0.0 108.66 179.357 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 75.65 0.62 63.9 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 -179.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -143.41 164.53 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.235 -1.156 . . . . 0.0 108.683 178.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.435 HD21 ' OD1' ' A' ' 26' ' ' ASP . 66.0 mt -114.63 128.98 56.61 Favored 'General case' 0 N--CA 1.516 2.866 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 178.189 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 40.4 p-10 -107.96 163.88 12.75 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.297 -0.877 . . . . 0.0 109.843 -179.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.417 ' OE2' ' O ' ' A' ' 35' ' ' GLU . 0.4 OUTLIER -51.67 -11.36 0.14 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.51 -0.744 . . . . 0.0 110.379 -179.612 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.2 mm100 -82.57 -36.59 26.09 Favored 'General case' 0 C--N 1.297 -1.704 0 O-C-N 120.801 -1.187 . . . . 0.0 109.559 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -72.86 -33.6 66.21 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.086 -1.009 . . . . 0.0 109.234 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.4 mt -82.22 -36.27 27.39 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.16 -0.962 . . . . 0.0 109.249 178.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -60.83 -41.86 96.61 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 120.758 -1.213 . . . . 0.0 108.944 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.81 -29.56 62.23 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.248 -0.908 . . . . 0.0 110.515 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.545 ' O ' HD23 ' A' ' 41' ' ' LEU . 0.8 OUTLIER -76.66 -24.96 53.27 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.026 -1.046 . . . . 0.0 110.18 -179.536 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 34.2 m-85 -78.91 -49.88 12.1 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.592 -1.318 . . . . 0.0 108.934 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 34.5 m -63.37 -40.73 98.06 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.217 -0.927 . . . . 0.0 110.371 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 27.3 ttpt -73.84 -47.5 38.03 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.175 -0.953 . . . . 0.0 111.213 -178.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -54.24 -27.73 36.73 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.764 -1.21 . . . . 0.0 110.073 -178.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 28.0 mt -77.18 -25.38 51.8 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.981 -1.075 . . . . 0.0 110.702 -179.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.421 ' OE2' ' O ' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -67.52 0.91 2.66 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.688 -1.257 . . . . 0.0 109.866 -179.19 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -108.36 24.01 13.65 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.215 -0.928 . . . . 0.0 109.616 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 41.8 t -148.06 -57.16 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 O-C-N 121.094 -1.004 . . . . 0.0 109.75 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.589 ' CZ ' ' SD ' ' A' ' 62' ' ' MET . 78.6 m-85 -81.12 -163.44 0.6 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.14 -0.975 . . . . 0.0 109.835 -179.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -152.16 80.1 6.02 Favored Pre-proline 0 N--CA 1.495 1.779 0 O-C-N 121.285 -0.885 . . . . 0.0 109.35 -179.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -57.22 179.17 0.13 Allowed 'Trans proline' 0 C--N 1.319 -0.978 0 C-N-CA 121.372 1.382 . . . . 0.0 110.112 -179.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 85.6 mttt 55.24 72.62 0.47 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.443 -0.786 . . . . 0.0 109.243 -179.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.689 ' N ' HD22 ' A' ' 54' ' ' ASN . 0.0 OUTLIER -172.88 -36.83 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.461 -0.774 . . . . 0.0 110.124 -179.867 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.491 ' C ' ' H ' ' A' ' 57' ' ' ASP . 69.9 mm-40 -136.02 135.03 39.12 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.487 -0.758 . . . . 0.0 109.772 -179.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -58.72 -4.0 0.38 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.284 -0.885 . . . . 0.0 109.127 179.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.491 ' H ' ' C ' ' A' ' 55' ' ' GLU . 37.6 t0 -143.07 85.21 1.86 Allowed 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.497 ' C ' ' H ' ' A' ' 60' ' ' ARG . 26.6 t0 -125.51 158.14 35.27 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.599 -0.688 . . . . 0.0 109.734 -179.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 37.6 mtp 61.83 -3.02 0.25 Allowed 'General case' 0 N--CA 1.488 1.444 0 CA-C-O 121.18 0.514 . . . . 0.0 109.718 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.533 ' O ' ' N ' ' A' ' 62' ' ' MET . 66.2 ttt180 -80.85 -60.24 2.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.986 -1.071 . . . . 0.0 109.054 179.415 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -48.38 -9.26 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.215 -0.928 . . . . 0.0 110.418 -179.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.589 ' SD ' ' CZ ' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -124.31 -2.29 8.06 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.255 -0.903 . . . . 0.0 109.87 -179.929 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.404 ' C ' ' O ' ' A' ' 62' ' ' MET . 4.2 mt-10 -40.64 -20.83 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.179 0 CA-C-O 121.368 0.604 . . . . 0.0 109.57 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.564 ' N ' ' O ' ' A' ' 62' ' ' MET . 51.5 mt-10 -65.27 -23.3 67.01 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.224 -0.923 . . . . 0.0 109.775 179.383 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -69.85 -43.05 72.72 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.264 -0.898 . . . . 0.0 109.944 -179.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 8.2 mtm180 -56.38 -46.48 80.08 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.137 -0.977 . . . . 0.0 109.38 -179.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 54.2 mt -67.33 -28.13 67.72 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.229 -0.92 . . . . 0.0 110.148 -179.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 6.3 mmm180 -64.3 -42.64 96.27 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.905 -1.122 . . . . 0.0 109.758 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 4.6 mtt -84.29 -50.1 8.15 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.015 -1.053 . . . . 0.0 109.698 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -55.37 -38.06 68.36 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.064 -1.023 . . . . 0.0 110.846 -179.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 65.0 mt-10 -82.16 -51.84 7.57 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 120.75 -1.219 . . . . 0.0 110.764 -179.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.414 ' O ' ' ND2' ' A' ' 76' ' ' ASN . 43.8 t-80 -53.86 -37.28 63.51 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.021 -1.049 . . . . 0.0 110.099 -179.473 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 79.4 t -75.07 -54.0 15.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 120.703 -1.248 . . . . 0.0 109.677 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.44 ' O ' ' CG ' ' A' ' 78' ' ' ASP . 18.9 mtp -65.92 -13.66 60.11 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.221 -0.924 . . . . 0.0 110.302 -179.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -89.37 -38.93 13.77 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.357 -1.464 . . . . 0.0 110.713 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.685 HD22 ' H ' ' A' ' 77' ' ' VAL . 0.0 OUTLIER -102.66 -22.53 13.95 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.106 -0.996 . . . . 0.0 112.285 -178.187 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.685 ' H ' HD22 ' A' ' 76' ' ' ASN . 42.1 t -94.69 -34.65 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 O-C-N 120.308 -1.495 . . . . 0.0 109.485 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.44 ' CG ' ' O ' ' A' ' 74' ' ' MET . 17.9 p-10 -48.64 101.7 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.864 -1.148 . . . . 0.0 109.158 178.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -76.19 -65.47 0.92 Allowed 'General case' 0 C--N 1.295 -1.781 0 O-C-N 120.975 -1.078 . . . . 0.0 110.703 -178.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.465 ' O ' ' N ' ' A' ' 82' ' ' ASP . 7.5 t-20 -105.51 25.73 10.36 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 121.185 -0.947 . . . . 0.0 109.357 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.427 ' CA ' HE21 ' A' ' 81' ' ' GLN . 0.1 OUTLIER 37.88 29.01 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.648 0 CA-C-O 121.17 0.51 . . . . 0.0 111.092 178.929 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.534 ' C ' ' H ' ' A' ' 84' ' ' LEU . 17.3 p-10 -84.02 12.91 5.57 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 178.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 15.6 mmt180 65.09 -3.22 0.63 Allowed 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 -178.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.534 ' H ' ' C ' ' A' ' 82' ' ' ASP . 6.5 mp -122.03 134.59 54.79 Favored 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 107.289 -1.374 . . . . 0.0 107.289 179.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 74.5 t -113.69 131.67 64.85 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.109 0 O-C-N 121.643 -0.661 . . . . 0.0 109.691 -178.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 64.6 p -99.61 166.12 11.29 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.043 -1.035 . . . . 0.0 109.543 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.9 tp -67.3 -36.78 82.21 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 179.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.555 ' H ' ' CD ' ' A' ' 88' ' ' GLU . 13.7 mp0 -56.64 -67.62 0.29 Allowed 'General case' 0 C--N 1.294 -1.835 0 O-C-N 121.434 -0.791 . . . . 0.0 110.642 -178.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -62.84 -38.0 89.06 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.268 -0.895 . . . . 0.0 111.347 -178.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 7.0 t80 -57.06 -50.94 71.2 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.476 -1.39 . . . . 0.0 109.572 -178.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 80.4 mt -50.11 -47.74 53.78 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.102 -0.999 . . . . 0.0 109.008 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -51.06 -59.61 3.99 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.394 -0.817 . . . . 0.0 109.945 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 46.3 t -45.35 -25.93 0.46 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.138 -0.976 . . . . 0.0 110.428 -179.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 43.6 p -97.82 -2.94 39.85 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.133 -0.979 . . . . 0.0 109.866 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 24.2 mt-30 -73.64 52.04 0.38 Allowed 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 107.888 -1.152 . . . . 0.0 107.888 178.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.458 ' C ' ' H ' ' A' ' 98' ' ' GLU . 3.9 tpt180 176.55 -35.09 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.965 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 179.129 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 3.0 tppt? -59.93 -1.71 0.32 Allowed 'General case' 0 C--N 1.308 -1.235 0 O-C-N 121.139 -0.975 . . . . 0.0 109.825 -179.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.458 ' H ' ' C ' ' A' ' 96' ' ' ARG . 48.0 mm-40 -61.22 89.41 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.268 -0.895 . . . . 0.0 109.221 179.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 49.2 t80 . . . . . 0 N--CA 1.493 1.686 0 CA-C-O 117.989 -1.005 . . . . 0.0 109.462 179.992 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.487 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm 44.58 -159.28 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.412 -0.805 . . . . 0.0 109.765 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.504 ' C ' ' H ' ' A' ' 5' ' ' TRP . 39.7 tt0 -71.32 77.13 0.74 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.183 -0.948 . . . . 0.0 109.379 179.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.419 ' O ' ' O ' ' A' ' 5' ' ' TRP . 3.6 t 58.55 0.59 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.366 -0.834 . . . . 0.0 109.698 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.504 ' H ' ' C ' ' A' ' 3' ' ' GLU . 30.6 t90 50.41 97.76 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.15 -0.969 . . . . 0.0 109.808 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.436 ' O ' ' O ' ' A' ' 7' ' ' GLU . 13.3 pt-20 -155.53 -26.17 0.11 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.17 -0.956 . . . . 0.0 109.51 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.436 ' O ' ' O ' ' A' ' 6' ' ' GLU . 35.4 tt0 60.09 129.02 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.54 -0.725 . . . . 0.0 109.947 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.5 tt -163.53 63.81 0.17 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.156 -0.965 . . . . 0.0 108.954 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.4 p-10 -50.09 -45.7 52.82 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.211 -0.931 . . . . 0.0 109.436 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 165.81 55.52 0.03 OUTLIER Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.137 -1.585 . . . . 0.0 109.137 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 62.6 mt -135.9 -167.06 1.97 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.487 -1.008 . . . . 0.0 108.887 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 59.5 t0 45.81 68.79 3.05 Favored Pre-proline 0 N--CA 1.501 2.088 0 O-C-N 121.274 -0.891 . . . . 0.0 109.982 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.439 ' O ' ' O ' ' A' ' 14' ' ' ASN . 1.9 Cg_endo -67.58 -2.34 8.23 Favored 'Trans proline' 0 C--N 1.321 -0.903 0 C-N-CA 121.773 1.649 . . . . 0.0 109.515 178.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.439 ' O ' ' O ' ' A' ' 13' ' ' PRO . 43.1 t-20 42.09 94.93 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.416 -0.802 . . . . 0.0 110.663 179.227 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.591 HH11 ' CG ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -161.64 150.84 16.08 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.918 -1.114 . . . . 0.0 110.229 179.91 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 7.9 t80 57.79 -163.79 0.19 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.551 -0.718 . . . . 0.0 109.794 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.671 HD22 ' N ' ' A' ' 17' ' ' ASN . 0.0 OUTLIER -171.83 78.04 0.49 Allowed Pre-proline 0 N--CA 1.49 1.543 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 -179.528 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -59.37 -16.77 36.69 Favored 'Trans proline' 0 C--N 1.32 -0.937 0 C-N-CA 121.436 1.424 . . . . 0.0 111.228 -178.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 51.4 tttm -66.81 -36.53 82.6 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.906 -1.121 . . . . 0.0 111.077 -179.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.3 m -74.12 -41.6 61.34 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 120.617 -1.302 . . . . 0.0 110.367 -178.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.417 ' CD2' ' NE2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -55.28 -34.26 63.93 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 179.97 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -68.98 -35.96 77.32 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.347 -0.845 . . . . 0.0 109.686 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 97.2 mt -71.34 -61.07 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.225 0 O-C-N 120.827 -1.171 . . . . 0.0 109.007 179.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.9 tp -46.63 -38.02 9.06 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.31 -0.869 . . . . 0.0 110.751 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.417 ' NE2' ' CD2' ' A' ' 21' ' ' PHE . 0.4 OUTLIER -74.99 -16.24 60.63 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.327 -1.483 . . . . 0.0 109.712 179.871 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -78.71 91.0 4.63 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.981 -1.074 . . . . 0.0 108.527 179.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 87.5 mt -75.75 -43.04 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.35 0 O-C-N 121.421 -0.799 . . . . 0.0 110.869 -178.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.513 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -95.24 12.66 28.14 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.015 -1.053 . . . . 0.0 110.083 -179.687 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 49.9 p 43.92 53.05 6.47 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.198 -0.939 . . . . 0.0 110.519 178.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -97.19 -3.78 40.27 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.09 -1.006 . . . . 0.0 108.886 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 76.94 -1.36 63.34 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 -179.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.1 156.33 17.34 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 O-C-N 121.287 -1.125 . . . . 0.0 108.298 178.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 31.1 mt -114.42 128.86 56.55 Favored 'General case' 0 N--CA 1.512 2.664 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 178.426 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.434 ' OD1' ' OE2' ' A' ' 37' ' ' GLU . 45.0 p-10 -106.21 174.27 5.96 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.31 -0.869 . . . . 0.0 110.436 -179.029 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -52.08 -11.63 0.18 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.808 -0.557 . . . . 0.0 110.12 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 4.0 mm100 -83.13 -43.0 16.7 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.884 -1.135 . . . . 0.0 109.048 179.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.527 ' OE1' ' N ' ' A' ' 37' ' ' GLU . 0.3 OUTLIER -73.48 -29.93 62.83 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.312 -0.867 . . . . 0.0 108.789 179.377 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.5 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 10.2 mp -82.13 -40.03 22.45 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.545 -0.722 . . . . 0.0 109.435 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -70.23 -37.34 74.97 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 120.831 -1.168 . . . . 0.0 109.725 -179.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.62 -28.5 61.83 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.256 -0.903 . . . . 0.0 111.028 -179.069 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 mp -76.13 -27.9 57.23 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.85 -1.156 . . . . 0.0 110.525 -178.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.5 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 8.0 m-85 -80.91 -45.38 16.84 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 120.655 -1.278 . . . . 0.0 109.545 -179.281 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 51.4 m -63.96 -51.36 64.75 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.129 -0.982 . . . . 0.0 111.098 -178.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.439 ' CG ' ' N ' ' A' ' 45' ' ' GLU . 13.7 ptmt -66.96 -47.15 72.51 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.877 -1.139 . . . . 0.0 111.709 -177.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.439 ' N ' ' CG ' ' A' ' 44' ' ' LYS . 28.1 mt-10 -54.31 -27.31 34.67 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 120.309 -1.494 . . . . 0.0 108.444 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 8.1 tp -76.55 -24.14 53.59 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.463 -0.773 . . . . 0.0 109.37 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -63.53 -36.27 83.24 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.435 -0.791 . . . . 0.0 110.206 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.9 pttt -90.33 39.37 0.97 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.832 -1.167 . . . . 0.0 110.541 -179.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 21.7 t -146.97 -58.48 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 120.938 -1.101 . . . . 0.0 110.068 179.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.568 ' CZ ' ' SD ' ' A' ' 62' ' ' MET . 30.2 m-85 -85.38 -10.19 56.59 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.017 -1.052 . . . . 0.0 109.903 -179.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.541 ' C ' ' H ' ' A' ' 53' ' ' LYS . 7.9 m-20 50.4 88.64 0.11 Allowed Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 120.943 -1.098 . . . . 0.0 109.511 179.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -63.35 10.65 0.1 OUTLIER 'Trans proline' 0 C--N 1.322 -0.833 0 C-N-CA 121.317 1.345 . . . . 0.0 110.791 -179.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.541 ' H ' ' C ' ' A' ' 51' ' ' ASP . 94.9 mttt -112.2 30.94 6.64 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.465 -0.772 . . . . 0.0 109.68 -179.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.493 ' ND2' ' O ' ' A' ' 54' ' ' ASN . 2.0 t-20 -135.51 5.18 3.17 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 121.398 -0.814 . . . . 0.0 110.101 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -171.11 143.49 1.95 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.895 -1.128 . . . . 0.0 109.68 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.519 ' CD ' ' H ' ' A' ' 56' ' ' GLU . 5.8 mp0 -81.87 5.86 17.58 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.214 -0.929 . . . . 0.0 109.408 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.419 ' O ' ' OD1' ' A' ' 57' ' ' ASP . 40.9 t0 -54.64 -5.27 0.08 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.356 -0.84 . . . . 0.0 109.875 -179.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.466 ' O ' ' N ' ' A' ' 60' ' ' ARG . 36.9 m-20 51.58 28.24 4.51 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.133 -0.979 . . . . 0.0 109.573 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 61.9 mtp 48.93 14.15 0.07 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.261 -0.899 . . . . 0.0 109.532 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.466 ' N ' ' O ' ' A' ' 58' ' ' ASP . 40.1 ttp180 -69.3 -53.92 17.22 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.245 -0.909 . . . . 0.0 109.762 -179.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -60.19 -41.61 93.3 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.094 -1.004 . . . . 0.0 110.186 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.568 ' SD ' ' CZ ' ' A' ' 50' ' ' TYR . 9.7 tpt -71.35 -9.36 58.02 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.139 -0.976 . . . . 0.0 109.76 -179.305 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.457 ' CG ' ' O ' ' A' ' 60' ' ' ARG . 0.5 OUTLIER -50.14 -7.75 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.954 -1.092 . . . . 0.0 109.967 179.812 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.528 ' N ' ' O ' ' A' ' 62' ' ' MET . 54.9 mt-10 -54.12 -45.56 71.95 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.065 -1.022 . . . . 0.0 110.039 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -67.45 -26.23 66.29 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.999 -1.063 . . . . 0.0 109.288 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 11.1 ttm180 -57.2 -41.73 79.95 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.224 -0.923 . . . . 0.0 109.519 -179.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.575 ' C ' HD12 ' A' ' 67' ' ' LEU . 0.7 OUTLIER -81.7 -28.36 33.49 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.114 -0.991 . . . . 0.0 109.873 -179.629 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.8 tmm_? -60.59 -36.74 79.29 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.127 -0.983 . . . . 0.0 109.648 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 36.6 mtt -85.73 -37.47 19.33 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.063 -1.023 . . . . 0.0 109.737 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -61.75 -41.51 97.76 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.012 -1.055 . . . . 0.0 111.115 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.465 ' N ' ' CD ' ' A' ' 71' ' ' GLU . 1.3 mp0 -84.02 -52.46 6.29 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 120.965 -1.084 . . . . 0.0 111.147 -178.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 28.0 m170 -53.86 -39.81 65.97 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.894 -1.129 . . . . 0.0 110.121 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.402 ' HA ' HD21 ' A' ' 76' ' ' ASN . 72.9 t -75.12 -51.2 22.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 120.756 -1.215 . . . . 0.0 109.932 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 19.6 mtp -67.82 -14.74 63.2 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.934 -1.103 . . . . 0.0 110.094 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 23.6 ttpp -85.24 -32.55 22.54 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.373 -1.454 . . . . 0.0 110.506 -179.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.665 HD22 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -111.96 -23.31 10.6 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.18 -0.95 . . . . 0.0 112.647 -177.92 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.665 ' H ' HD22 ' A' ' 76' ' ' ASN . 32.5 t -95.13 -38.25 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.49 0 O-C-N 120.458 -1.401 . . . . 0.0 110.61 -178.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -66.23 102.57 0.86 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.443 -1.411 . . . . 0.0 107.433 178.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.404 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -81.33 -52.8 6.91 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.356 -0.84 . . . . 0.0 111.777 -177.475 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.447 ' O ' ' N ' ' A' ' 82' ' ' ASP . 56.8 t-20 -100.0 23.46 9.82 Favored 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.199 -0.938 . . . . 0.0 109.641 -179.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.427 ' C ' ' O ' ' A' ' 80' ' ' ASN . 1.3 mm100 32.68 35.73 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.81 0 CA-C-O 121.079 0.466 . . . . 0.0 112.088 178.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.542 ' C ' ' H ' ' A' ' 84' ' ' LEU . 48.9 t0 -85.45 12.3 8.69 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 178.473 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.528 ' HG2' HH11 ' A' ' 83' ' ' ARG . 4.3 mtt-85 64.9 -4.29 0.49 Allowed 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 -178.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.542 ' H ' ' C ' ' A' ' 82' ' ' ASP . 14.7 mt -120.64 134.85 55.25 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 107.313 -1.366 . . . . 0.0 107.313 178.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 71.6 t -112.04 129.62 67.18 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.561 -0.712 . . . . 0.0 109.831 -178.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 32.5 p -105.63 159.15 16.19 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 178.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.2 tp -59.33 -35.6 74.14 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.41 -0.807 . . . . 0.0 109.397 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.527 ' H ' ' CD ' ' A' ' 88' ' ' GLU . 6.2 mp0 -60.7 -68.34 0.31 Allowed 'General case' 0 C--N 1.296 -1.757 0 O-C-N 121.24 -0.912 . . . . 0.0 111.828 -177.303 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.404 ' CB ' HG21 ' A' ' 79' ' ' THR . 6.3 mm-40 -63.03 -32.0 73.27 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.033 -1.042 . . . . 0.0 110.563 -177.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -61.37 -51.89 66.93 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.892 -1.13 . . . . 0.0 109.753 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 68.2 mt -50.48 -48.57 56.68 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.25 -0.906 . . . . 0.0 109.256 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -46.66 -49.43 19.27 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.304 -0.873 . . . . 0.0 109.963 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 48.3 t -56.76 -27.55 59.67 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.199 -0.938 . . . . 0.0 109.882 -179.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 29.4 p -99.24 -7.11 26.93 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 121.229 -0.919 . . . . 0.0 109.778 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.507 ' C ' ' H ' ' A' ' 97' ' ' LYS . 20.9 mt-30 -65.81 141.41 58.3 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.971 -1.081 . . . . 0.0 108.869 179.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.544 ' C ' ' H ' ' A' ' 98' ' ' GLU . 22.1 mmm180 55.65 3.61 0.09 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.434 -0.791 . . . . 0.0 109.545 -179.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.507 ' H ' ' C ' ' A' ' 95' ' ' GLN . 79.0 mttt 66.79 -20.38 0.11 Allowed 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.681 -0.637 . . . . 0.0 110.082 -179.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.544 ' H ' ' C ' ' A' ' 96' ' ' ARG . 31.1 tp10 50.62 64.18 1.92 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.042 -1.037 . . . . 0.0 109.758 179.683 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 67.2 t80 . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 117.978 -1.01 . . . . 0.0 109.497 179.973 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.562 ' N ' HD12 ' A' ' 1' ' ' LEU . 9.6 mp . . . . . 0 N--CA 1.491 1.586 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 52.3 mttp -148.12 -17.67 0.34 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.238 -0.914 . . . . 0.0 109.264 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 53.59 64.6 1.78 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.326 -0.859 . . . . 0.0 109.571 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 33.6 m -65.13 -147.14 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 O-C-N 121.213 -0.929 . . . . 0.0 109.369 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 49.5 p90 -153.62 -157.23 0.76 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.125 -0.985 . . . . 0.0 109.383 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.526 ' O ' ' N ' ' A' ' 8' ' ' LEU . 14.0 pt-20 -157.85 -22.18 0.08 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.201 -0.937 . . . . 0.0 109.545 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 65.73 -62.31 0.24 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.446 -0.784 . . . . 0.0 109.568 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.526 ' N ' ' O ' ' A' ' 6' ' ' GLU . 6.3 tp -168.96 39.06 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.218 -0.926 . . . . 0.0 109.487 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.438 ' O ' ' O ' ' A' ' 8' ' ' LEU . 26.3 t0 55.67 165.35 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.476 -0.765 . . . . 0.0 109.702 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -84.59 25.18 5.89 Favored Glycine 0 N--CA 1.492 2.424 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 28.6 tp -58.97 -83.43 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.187 -1.184 . . . . 0.0 108.923 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -171.06 68.23 0.48 Allowed Pre-proline 0 N--CA 1.491 1.58 0 O-C-N 121.198 -0.939 . . . . 0.0 109.498 -179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.407 ' O ' ' C ' ' A' ' 14' ' ' ASN . 1.8 Cg_endo -63.1 -45.35 12.71 Favored 'Trans proline' 0 C--N 1.318 -1.032 0 C-N-CA 121.465 1.443 . . . . 0.0 109.864 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.407 ' C ' ' O ' ' A' ' 13' ' ' PRO . 55.5 t-20 41.82 67.95 0.51 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.528 -0.733 . . . . 0.0 110.275 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 58.7 mtp180 -65.18 112.96 3.65 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.319 -0.863 . . . . 0.0 109.459 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -168.15 119.65 0.83 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.323 -0.861 . . . . 0.0 109.243 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -162.93 73.12 2.03 Favored Pre-proline 0 N--CA 1.49 1.535 0 O-C-N 121.212 -0.93 . . . . 0.0 109.828 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -58.76 -15.82 28.21 Favored 'Trans proline' 0 C--N 1.319 -0.994 0 C-N-CA 121.532 1.488 . . . . 0.0 110.33 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 69.0 tttt -57.38 -36.01 70.7 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.36 -0.838 . . . . 0.0 110.824 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 38.9 m -70.27 -39.79 74.74 Favored 'General case' 0 N--CA 1.483 1.2 0 O-C-N 120.58 -1.325 . . . . 0.0 110.083 -178.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.524 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.08 -50.38 71.18 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 108.083 -1.081 . . . . 0.0 108.083 179.767 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.524 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 41.7 t80 -54.11 -35.16 61.85 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.539 -0.725 . . . . 0.0 110.406 -179.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.531 ' O ' ' N ' ' A' ' 25' ' ' HIS . 97.2 mt -73.9 -61.99 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.204 0 O-C-N 120.694 -1.254 . . . . 0.0 108.974 -179.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.2 tp -46.22 -12.87 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.021 -1.049 . . . . 0.0 110.898 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.531 ' N ' ' O ' ' A' ' 23' ' ' ILE . 0.7 OUTLIER -102.24 -15.77 16.52 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 120.535 -1.353 . . . . 0.0 110.205 179.952 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.492 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 58.5 p30 -75.36 70.03 2.22 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.81 -1.181 . . . . 0.0 109.362 179.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 63.7 mt -50.2 -52.34 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.46 0 O-C-N 121.297 -0.877 . . . . 0.0 110.897 -179.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.512 ' N ' HD22 ' A' ' 28' ' ' ASN . 2.1 m120 -87.89 14.35 9.0 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 120.726 -1.234 . . . . 0.0 110.376 -179.297 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.403 ' C ' ' O ' ' A' ' 28' ' ' ASN . 8.5 t 41.37 48.27 3.23 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.217 -0.927 . . . . 0.0 110.616 178.53 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -92.9 0.69 57.46 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.948 -1.095 . . . . 0.0 108.855 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 74.82 -0.26 57.77 Favored Glycine 0 N--CA 1.487 2.046 0 N-CA-C 109.343 -1.503 . . . . 0.0 109.343 -179.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -135.97 166.11 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 O-C-N 121.429 -1.042 . . . . 0.0 108.784 178.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.41 HD21 ' CG ' ' A' ' 25' ' ' HIS . 0.1 OUTLIER -106.13 117.04 33.0 Favored 'General case' 0 N--CA 1.509 2.515 0 N-CA-C 107.44 -1.319 . . . . 0.0 107.44 177.969 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.413 ' OD1' ' N ' ' A' ' 34' ' ' ASP . 0.3 OUTLIER -90.55 165.18 13.91 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.535 -0.728 . . . . 0.0 110.361 -178.397 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -74.99 -39.84 61.03 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.541 -0.725 . . . . 0.0 110.786 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.501 ' NE2' ' C ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -63.01 -24.44 67.92 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 120.676 -1.265 . . . . 0.0 108.653 -179.779 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -84.82 -33.0 23.01 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 178.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.8 tp -75.84 -32.13 59.65 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 178.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 48.9 tt0 -67.43 -41.47 84.75 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 120.961 -1.087 . . . . 0.0 109.068 179.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.57 -45.42 53.44 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.271 -0.893 . . . . 0.0 110.769 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.423 HD22 ' CE1' ' A' ' 25' ' ' HIS . 39.7 tp -57.86 -23.26 52.14 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.175 -0.953 . . . . 0.0 109.619 -179.458 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -80.05 -51.22 9.29 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 120.967 -1.083 . . . . 0.0 109.057 -179.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 29.5 m -63.37 -34.38 77.59 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.122 -0.986 . . . . 0.0 109.994 -179.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -73.99 -46.98 40.39 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.113 -0.992 . . . . 0.0 110.51 -179.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -53.78 -27.54 29.63 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 120.751 -1.218 . . . . 0.0 109.377 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.492 ' C ' ' H ' ' A' ' 48' ' ' LYS . 18.9 mt -84.87 -25.76 27.79 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.292 -0.88 . . . . 0.0 110.58 -179.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.74 4.5 0.11 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.809 -1.182 . . . . 0.0 110.346 -179.084 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.492 ' H ' ' C ' ' A' ' 46' ' ' LEU . 40.6 pttt -135.37 41.32 2.78 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.143 -0.973 . . . . 0.0 109.819 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 58.5 t -147.27 -57.15 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 121.27 -0.894 . . . . 0.0 109.262 179.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -89.84 -139.57 0.14 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.131 -0.981 . . . . 0.0 109.231 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.533 ' C ' ' H ' ' A' ' 53' ' ' LYS . 17.0 p-10 -166.69 77.14 1.08 Allowed Pre-proline 0 N--CA 1.49 1.542 0 O-C-N 121.015 -1.053 . . . . 0.0 109.393 -179.42 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -63.72 11.02 0.1 Allowed 'Trans proline' 0 C--N 1.319 -0.998 0 C-N-CA 121.542 1.495 . . . . 0.0 110.46 -179.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.533 ' H ' ' C ' ' A' ' 51' ' ' ASP . 45.4 mmtt -82.83 -5.37 58.93 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.181 -0.949 . . . . 0.0 109.36 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.408 ' OD1' ' OD2' ' A' ' 51' ' ' ASP . 12.3 m120 -73.7 -13.34 60.96 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.229 -0.919 . . . . 0.0 109.58 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 46.09 49.62 12.22 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.441 -0.787 . . . . 0.0 109.728 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.401 ' O ' ' OD2' ' A' ' 58' ' ' ASP . 24.5 tt0 -162.54 -52.68 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.34 0 O-C-N 121.243 -0.911 . . . . 0.0 108.663 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.452 ' O ' ' N ' ' A' ' 59' ' ' MET . 28.0 m-20 -56.22 -19.28 13.16 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.367 -0.833 . . . . 0.0 109.634 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.407 ' C ' ' N ' ' A' ' 60' ' ' ARG . 43.8 m-20 48.84 15.44 0.09 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.26 -0.9 . . . . 0.0 109.661 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.452 ' N ' ' O ' ' A' ' 57' ' ' ASP . 63.0 mmm 50.6 16.83 0.33 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.137 -0.977 . . . . 0.0 109.513 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.407 ' N ' ' C ' ' A' ' 58' ' ' ASP . 39.8 ttm180 -82.76 -45.19 14.68 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.187 -0.946 . . . . 0.0 109.578 -179.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -51.47 -51.44 55.02 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.932 -1.105 . . . . 0.0 110.358 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.545 ' O ' ' N ' ' A' ' 64' ' ' GLU . 0.3 OUTLIER -69.76 -9.09 53.21 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.047 -1.033 . . . . 0.0 111.167 -178.622 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.441 ' C ' ' O ' ' A' ' 62' ' ' MET . 12.9 pt-20 -37.92 -26.08 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.523 -0.736 . . . . 0.0 110.699 -179.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.545 ' N ' ' O ' ' A' ' 62' ' ' MET . 23.6 mm-40 -54.64 -25.62 27.92 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.226 -0.922 . . . . 0.0 109.54 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.456 ' CD ' ' N ' ' A' ' 65' ' ' GLU . 1.5 mp0 -78.38 -44.59 24.57 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.3 -0.875 . . . . 0.0 109.912 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 57.9 mtt180 -60.43 -43.29 96.95 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.16 -0.963 . . . . 0.0 109.675 -179.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.401 ' O ' ' OE1' ' A' ' 71' ' ' GLU . 42.1 mt -74.33 -29.86 61.78 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.109 -0.994 . . . . 0.0 110.128 -178.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.7 tpp180 -74.43 -38.29 63.06 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.194 -0.941 . . . . 0.0 110.233 -178.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 30.6 mtt -86.36 -46.82 9.92 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 120.956 -1.09 . . . . 0.0 110.096 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 45.1 ttm180 -60.17 -36.98 78.81 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.858 -1.151 . . . . 0.0 110.386 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.401 ' OE1' ' O ' ' A' ' 67' ' ' LEU . 64.2 mt-10 -74.97 -47.78 27.6 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.758 -1.214 . . . . 0.0 110.32 -179.489 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.513 ' CE1' ' OD1' ' A' ' 76' ' ' ASN . 52.0 t-80 -58.04 -38.81 76.95 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.025 -1.047 . . . . 0.0 110.278 -179.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 77.9 t -71.86 -55.27 14.06 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 O-C-N 120.785 -1.197 . . . . 0.0 109.815 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 10.4 mtp -64.08 -21.97 66.74 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.054 -1.029 . . . . 0.0 110.107 -179.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -91.03 -32.96 15.71 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.497 -1.377 . . . . 0.0 110.252 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.513 ' OD1' ' CE1' ' A' ' 72' ' ' HIS . 25.3 m120 -100.78 -9.48 21.69 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.008 -1.057 . . . . 0.0 111.691 -178.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 99.4 t -118.62 -33.59 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.515 0 O-C-N 120.667 -1.271 . . . . 0.0 110.698 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -48.94 113.78 0.86 Allowed 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.719 -1.238 . . . . 0.0 108.502 178.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.403 HG23 ' H ' ' A' ' 79' ' ' THR . 0.4 OUTLIER -91.23 -65.54 1.0 Allowed 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.286 -0.884 . . . . 0.0 112.422 -176.11 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -107.16 25.03 11.9 Favored 'General case' 0 N--CA 1.51 2.571 0 O-C-N 120.886 -1.134 . . . . 0.0 110.655 -178.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.408 HE21 ' CA ' ' A' ' 81' ' ' GLN . 0.6 OUTLIER 45.34 78.89 0.06 Allowed 'General case' 0 C--N 1.298 -1.657 0 O-C-N 121.514 -0.741 . . . . 0.0 111.679 177.52 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.558 ' C ' ' H ' ' A' ' 84' ' ' LEU . 26.3 t0 -144.81 19.17 1.64 Allowed 'General case' 0 C--N 1.296 -1.754 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 47.0 mtm180 58.15 -0.34 0.11 Allowed 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -179.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.558 ' H ' ' C ' ' A' ' 82' ' ' ASP . 1.8 mp -125.16 135.57 52.75 Favored 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 107.478 -1.304 . . . . 0.0 107.478 179.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 60.8 t -113.85 130.45 67.96 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.104 0 O-C-N 121.676 -0.64 . . . . 0.0 109.339 -179.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 66.9 p -94.64 163.22 13.47 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.034 -1.041 . . . . 0.0 109.386 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.737 ' C ' HD13 ' A' ' 87' ' ' LEU . 1.2 tm? -68.6 -38.58 80.73 Favored 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 108.002 -1.111 . . . . 0.0 108.002 179.723 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 69.7 mm-40 -60.19 -69.49 0.22 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.58 -0.7 . . . . 0.0 111.218 -179.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 74.2 mm-40 -56.46 -30.56 63.04 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.032 -1.042 . . . . 0.0 110.354 -178.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -62.03 -51.21 68.93 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.852 -1.155 . . . . 0.0 110.106 -179.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 89.1 mt -52.22 -38.97 59.57 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 120.963 -1.085 . . . . 0.0 108.963 178.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.445 ' O ' ' N ' ' A' ' 94' ' ' THR . . . -57.05 -62.75 1.53 Allowed 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.266 -0.896 . . . . 0.0 109.937 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 45.9 t -44.09 -22.46 0.06 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.383 -0.823 . . . . 0.0 110.14 -179.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.445 ' N ' ' O ' ' A' ' 92' ' ' ALA . 44.4 p -98.97 -40.71 7.92 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.349 -0.844 . . . . 0.0 109.785 179.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -148.19 124.71 11.02 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.987 -1.071 . . . . 0.0 108.888 -179.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.444 ' O ' ' CG ' ' A' ' 96' ' ' ARG . 4.3 ttp180 -140.48 22.26 2.36 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.106 -0.996 . . . . 0.0 108.98 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 53.3 mttp 53.25 15.95 0.74 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.334 -0.854 . . . . 0.0 109.595 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -73.11 65.0 0.77 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.235 -0.916 . . . . 0.0 109.51 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 57.7 t80 . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 118.047 -0.977 . . . . 0.0 109.418 -179.994 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.418 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 51.3 tp . . . . . 0 N--CA 1.491 1.584 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 16.7 mtpp -77.18 -30.71 55.01 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.246 -0.909 . . . . 0.0 109.295 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -78.71 -152.13 0.06 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.268 -0.895 . . . . 0.0 109.349 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.448 HG23 ' H ' ' A' ' 7' ' ' GLU . 34.4 m -71.9 -156.87 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.298 -0.876 . . . . 0.0 109.418 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 4.5 m-90 -70.21 54.27 0.14 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.215 -0.928 . . . . 0.0 109.553 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.445 ' N ' ' O ' ' A' ' 4' ' ' VAL . 12.8 mm-40 49.86 48.19 22.08 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.237 -0.914 . . . . 0.0 109.614 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.448 ' H ' HG23 ' A' ' 4' ' ' VAL . 5.5 tp10 54.88 -128.02 2.24 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.289 -0.882 . . . . 0.0 109.476 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.1 tp -160.44 122.79 3.25 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.248 -0.907 . . . . 0.0 109.126 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.508 ' OD1' ' N ' ' A' ' 11' ' ' LEU . 9.6 t70 -51.15 151.79 2.6 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.207 -0.933 . . . . 0.0 110.124 -179.106 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.444 ' N ' ' OD1' ' A' ' 9' ' ' ASP . . . -80.41 -39.45 15.14 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.368 -1.493 . . . . 0.0 109.368 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.508 ' N ' ' OD1' ' A' ' 9' ' ' ASP . 10.0 tp -154.35 63.0 0.69 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.247 -1.149 . . . . 0.0 109.147 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.432 ' O ' ' O ' ' A' ' 11' ' ' LEU . 0.2 OUTLIER 57.91 162.98 0.08 OUTLIER Pre-proline 0 N--CA 1.506 2.346 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 -179.655 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -57.13 -14.61 15.38 Favored 'Trans proline' 0 C--N 1.319 -1.016 0 C-N-CA 121.22 1.28 . . . . 0.0 109.552 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.535 ' O ' ' N ' ' A' ' 16' ' ' PHE . 2.6 m-20 -48.59 -53.34 18.78 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.313 -0.867 . . . . 0.0 109.685 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.572 HH11 ' CG ' ' A' ' 15' ' ' ARG . 3.8 mtt-85 51.35 -88.23 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.356 -0.84 . . . . 0.0 109.578 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.535 ' N ' ' O ' ' A' ' 14' ' ' ASN . 75.0 m-85 -139.84 -147.68 0.23 Allowed 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.369 -0.832 . . . . 0.0 109.191 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.541 HD22 ' C ' ' A' ' 17' ' ' ASN . 0.2 OUTLIER 50.13 67.33 4.5 Favored Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.25 -0.906 . . . . 0.0 109.707 -179.955 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -65.29 -17.93 59.41 Favored 'Trans proline' 0 C--N 1.317 -1.081 0 C-N-CA 121.497 1.465 . . . . 0.0 110.09 -179.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.6 tttp -57.3 -34.73 69.01 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.361 -0.837 . . . . 0.0 110.981 -179.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 47.9 m -72.17 -41.23 67.29 Favored 'General case' 0 N--CA 1.485 1.282 0 O-C-N 120.695 -1.253 . . . . 0.0 110.226 -178.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.562 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -55.86 -43.88 77.54 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.03 -1.044 . . . . 0.0 108.463 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.562 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 45.3 t80 -61.25 -35.61 77.72 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.45 -0.781 . . . . 0.0 110.355 -179.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.401 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.6 mt -73.38 -61.0 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.194 0 O-C-N 120.746 -1.221 . . . . 0.0 109.162 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 22.1 tp -46.33 -34.69 4.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.178 -0.952 . . . . 0.0 110.708 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.45 ' ND1' ' N ' ' A' ' 25' ' ' HIS . 0.3 OUTLIER -79.73 -16.05 56.37 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 120.314 -1.491 . . . . 0.0 109.705 179.859 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.401 ' N ' ' O ' ' A' ' 23' ' ' ILE . 10.1 t0 -78.42 92.27 4.58 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.036 -1.04 . . . . 0.0 108.798 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 6.4 mt -73.37 -49.66 35.75 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 O-C-N 121.527 -0.733 . . . . 0.0 111.123 -178.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.595 ' N ' HD22 ' A' ' 28' ' ' ASN . 1.5 m120 -88.13 8.1 28.49 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.78 -1.2 . . . . 0.0 110.344 -179.445 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.4 p 45.48 60.31 3.14 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.061 -1.024 . . . . 0.0 110.537 179.144 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -101.55 -1.78 32.11 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.286 -0.884 . . . . 0.0 108.891 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 77.59 -1.95 64.88 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.959 -1.256 . . . . 0.0 109.959 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -136.21 165.41 29.25 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.213 0 O-C-N 121.41 -1.053 . . . . 0.0 108.302 178.303 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.7 tp -116.93 123.17 46.32 Favored 'General case' 0 N--CA 1.513 2.708 0 N-CA-C 107.853 -1.165 . . . . 0.0 107.853 178.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.418 ' OD1' ' OE2' ' A' ' 37' ' ' GLU . 36.2 p-10 -107.77 172.87 6.59 Favored 'General case' 0 N--CA 1.509 2.493 0 CA-C-O 122.179 0.99 . . . . 0.0 111.493 -178.288 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -58.8 -10.59 2.48 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.368 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -83.03 -48.95 10.07 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.728 -1.232 . . . . 0.0 108.814 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.512 ' OE1' ' N ' ' A' ' 37' ' ' GLU . 0.3 OUTLIER -67.55 -30.26 69.85 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 179.04 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 4.8 tp -82.09 -33.15 29.91 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.56 -0.712 . . . . 0.0 109.375 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -72.75 -44.21 61.91 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 120.857 -1.152 . . . . 0.0 109.199 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.27 -30.26 62.04 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.266 -0.896 . . . . 0.0 111.011 -178.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 41' ' ' LEU . 40.4 mt -75.56 -21.94 57.45 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 120.836 -1.165 . . . . 0.0 109.464 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -77.48 -50.26 13.02 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.068 -1.02 . . . . 0.0 108.742 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.5 m -61.5 -39.0 89.4 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.427 -0.796 . . . . 0.0 110.575 -179.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 44.1 mtpt -74.97 -36.59 62.04 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.148 -0.97 . . . . 0.0 111.698 -178.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -62.78 -30.28 71.34 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.208 -1.558 . . . . 0.0 109.32 -179.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 21.9 mt -72.51 -32.38 66.1 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.037 -1.039 . . . . 0.0 109.279 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 63.9 mm-40 -54.53 -12.87 0.8 Allowed 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.389 -0.819 . . . . 0.0 109.596 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 78.6 mttt -117.34 40.45 3.04 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.506 -0.746 . . . . 0.0 109.87 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 60.8 t -149.49 -59.32 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 O-C-N 121.023 -1.048 . . . . 0.0 109.546 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -89.75 -27.03 20.31 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.18 -0.95 . . . . 0.0 109.905 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 16.4 t0 61.96 72.0 0.68 Allowed Pre-proline 0 N--CA 1.502 2.134 0 O-C-N 121.155 -0.965 . . . . 0.0 108.966 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.64 175.36 1.72 Allowed 'Trans proline' 0 C--N 1.316 -1.144 0 C-N-CA 121.268 1.312 . . . . 0.0 109.84 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 1.4 ptpp? -171.55 -36.66 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.529 -0.732 . . . . 0.0 109.297 -179.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -88.44 -19.62 26.29 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.425 -0.797 . . . . 0.0 109.508 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 64.97 139.69 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -179.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 50.02 47.87 22.74 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.383 -0.823 . . . . 0.0 109.464 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.475 ' O ' ' N ' ' A' ' 59' ' ' MET . 24.4 t0 -144.87 -113.51 0.09 Allowed 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.423 -0.798 . . . . 0.0 109.413 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -50.57 -11.34 0.08 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.143 -0.973 . . . . 0.0 109.358 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.475 ' N ' ' O ' ' A' ' 57' ' ' ASP . 96.7 mmm -81.66 21.73 0.79 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.427 -0.796 . . . . 0.0 108.937 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.524 ' O ' ' N ' ' A' ' 62' ' ' MET . 51.4 mtp180 -129.68 -53.92 1.15 Allowed 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 179.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -43.26 -16.85 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.44 -0.787 . . . . 0.0 110.928 -179.228 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.561 ' O ' ' N ' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -113.45 5.81 16.88 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.208 -0.932 . . . . 0.0 109.846 179.827 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.408 ' C ' ' O ' ' A' ' 62' ' ' MET . 12.0 pt-20 -41.58 -20.45 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.038 0 CA-C-O 121.528 0.68 . . . . 0.0 109.688 -179.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 62' ' ' MET . 42.7 mt-10 -65.59 -28.78 69.38 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.579 -0.7 . . . . 0.0 109.244 179.183 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -74.71 -40.47 61.31 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.332 -0.855 . . . . 0.0 109.629 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 29.5 mtm180 -64.42 -36.41 84.07 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.183 -0.948 . . . . 0.0 108.974 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 33.2 mt -81.61 -28.51 33.7 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.312 -0.867 . . . . 0.0 109.636 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -72.58 -37.2 68.26 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.243 -0.91 . . . . 0.0 110.02 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 12.6 mtt -85.63 -35.39 20.99 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 120.99 -1.069 . . . . 0.0 109.567 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 64.4 ttt180 -72.0 -33.55 68.17 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.761 -1.212 . . . . 0.0 109.801 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 37.8 mm-40 -78.48 -46.56 19.37 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.884 -1.135 . . . . 0.0 109.923 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 42.2 t-80 -60.28 -34.3 73.56 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.153 -0.967 . . . . 0.0 110.154 -179.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 68.9 t -75.0 -55.91 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 O-C-N 120.614 -1.304 . . . . 0.0 109.894 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 5.7 mtt -64.0 -17.45 63.33 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.953 -1.092 . . . . 0.0 110.542 -179.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 19.5 tptm -82.72 -39.05 22.47 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.2 -1.562 . . . . 0.0 110.436 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.657 HD22 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -103.87 -21.89 13.58 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.101 -1.0 . . . . 0.0 112.483 -177.949 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.657 ' H ' HD22 ' A' ' 76' ' ' ASN . 40.5 t -94.99 -35.48 6.11 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.414 0 O-C-N 120.404 -1.435 . . . . 0.0 109.507 -179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -47.57 106.58 0.09 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.043 -1.035 . . . . 0.0 108.889 178.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.56 -72.52 0.33 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.267 -0.895 . . . . 0.0 113.123 -176.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.807 ' H ' HD22 ' A' ' 80' ' ' ASN . 0.0 OUTLIER -106.81 26.88 9.49 Favored 'General case' 0 N--CA 1.513 2.69 0 O-C-N 120.661 -1.274 . . . . 0.0 110.802 -177.288 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.422 HE21 ' CA ' ' A' ' 81' ' ' GLN . 0.5 OUTLIER 44.7 71.08 0.28 Allowed 'General case' 0 C--N 1.293 -1.869 0 O-C-N 121.433 -0.792 . . . . 0.0 111.185 178.37 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.549 ' C ' ' H ' ' A' ' 84' ' ' LEU . 1.1 m-20 -136.14 18.86 3.2 Favored 'General case' 0 C--N 1.298 -1.658 0 N-CA-C 106.665 -1.606 . . . . 0.0 106.665 177.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 74.0 mtt180 60.69 -2.37 0.18 Allowed 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -178.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.549 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.9 mt -119.96 133.89 55.41 Favored 'General case' 0 N--CA 1.497 1.922 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 53.2 t -109.23 131.66 59.44 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 58.8 p -97.77 157.53 16.02 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 120.926 -1.109 . . . . 0.0 109.732 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.734 ' C ' HD13 ' A' ' 87' ' ' LEU . 0.9 OUTLIER -63.13 -36.62 84.2 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 107.714 -1.217 . . . . 0.0 107.714 179.425 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.545 ' H ' ' CD ' ' A' ' 88' ' ' GLU . 20.5 mp0 -58.32 -71.84 0.1 Allowed 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.612 -0.68 . . . . 0.0 112.39 -179.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -61.3 -32.49 72.34 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.882 -1.136 . . . . 0.0 110.233 -177.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -57.27 -48.71 78.18 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 120.934 -1.104 . . . . 0.0 109.258 179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.454 ' O ' ' N ' ' A' ' 94' ' ' THR . 54.7 mt -52.05 -47.83 64.91 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.979 -1.076 . . . . 0.0 108.822 178.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.414 ' C ' ' O ' ' A' ' 91' ' ' LEU . . . -41.57 -57.29 2.3 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.62 -0.675 . . . . 0.0 109.923 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 40.8 t -53.08 -33.72 53.37 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.299 -0.875 . . . . 0.0 109.486 179.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.454 ' N ' ' O ' ' A' ' 91' ' ' LEU . 11.6 p -102.27 23.21 12.04 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.441 -0.787 . . . . 0.0 109.296 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -152.95 140.45 19.74 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.248 -0.908 . . . . 0.0 109.854 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.585 ' CG ' HH11 ' A' ' 96' ' ' ARG . 0.0 OUTLIER -145.21 16.01 1.51 Allowed 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 179.377 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 41.3 mttp 57.75 1.98 0.15 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.723 -0.611 . . . . 0.0 109.906 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.484 ' H ' ' C ' ' A' ' 96' ' ' ARG . 65.1 mt-10 -88.35 49.94 1.88 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.165 -0.959 . . . . 0.0 109.209 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 88.8 m-85 . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 118.054 -0.974 . . . . 0.0 109.646 -179.954 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 8.2 tp . . . . . 0 N--CA 1.492 1.63 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -168.75 -57.22 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.148 -0.97 . . . . 0.0 109.431 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 48.2 tt0 -82.1 99.9 9.47 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.219 -0.925 . . . . 0.0 109.396 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 28.5 m -57.45 -166.23 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 O-C-N 121.14 -0.975 . . . . 0.0 109.48 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 71.6 t-105 -162.29 -51.11 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.211 -0.931 . . . . 0.0 109.461 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -61.43 157.17 17.48 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.24 -0.912 . . . . 0.0 109.399 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.1 tt0 -169.77 -21.54 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.213 -0.929 . . . . 0.0 109.357 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 14.9 tp -159.01 92.19 1.08 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.249 -0.907 . . . . 0.0 109.42 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -83.89 76.29 10.04 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.6 -0.688 . . . . 0.0 109.432 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.533 ' O ' ' N ' ' A' ' 12' ' ' ASP . . . -47.63 -36.78 12.93 Favored Glycine 0 N--CA 1.492 2.369 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 37.1 tp -43.54 -17.98 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.594 -0.945 . . . . 0.0 109.731 -179.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.533 ' N ' ' O ' ' A' ' 10' ' ' GLY . 1.3 m-20 -126.7 79.68 71.43 Favored Pre-proline 0 N--CA 1.499 2.024 0 O-C-N 121.351 -0.843 . . . . 0.0 109.394 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -62.0 -2.43 2.94 Favored 'Trans proline' 0 C--N 1.319 -0.996 0 C-N-CA 121.23 1.287 . . . . 0.0 109.654 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.663 HD22 ' H ' ' A' ' 14' ' ' ASN . 2.5 m-80 -43.81 -35.92 2.11 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.566 -0.709 . . . . 0.0 109.866 -179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 24.3 mmt180 -81.7 -47.96 12.28 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.2 -0.937 . . . . 0.0 109.278 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -74.31 122.22 22.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.309 -0.87 . . . . 0.0 109.499 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.7 p-10 -172.88 68.41 0.38 Allowed Pre-proline 0 N--CA 1.49 1.553 0 O-C-N 121.25 -0.906 . . . . 0.0 109.491 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -63.55 -20.67 69.97 Favored 'Trans proline' 0 C--N 1.318 -1.031 0 C-N-CA 121.449 1.432 . . . . 0.0 110.006 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -55.28 -33.64 63.4 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.179 -0.95 . . . . 0.0 110.773 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.1 m -74.17 -41.64 61.16 Favored 'General case' 0 N--CA 1.484 1.259 0 O-C-N 120.741 -1.225 . . . . 0.0 110.429 -178.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -55.89 -34.65 65.72 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.906 -1.121 . . . . 0.0 108.301 179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -70.32 -34.86 73.18 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.402 -0.811 . . . . 0.0 110.089 -179.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.419 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.7 mt -72.4 -60.84 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 O-C-N 120.827 -1.171 . . . . 0.0 109.261 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.2 tp -45.6 -33.55 2.9 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.196 -0.94 . . . . 0.0 110.932 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 26.9 m170 -83.75 -14.41 51.59 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 120.261 -1.525 . . . . 0.0 109.66 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.419 ' N ' ' O ' ' A' ' 23' ' ' ILE . 91.7 m-20 -75.52 94.79 3.2 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.068 -1.02 . . . . 0.0 108.916 179.143 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.411 HD13 HG21 ' A' ' 27' ' ' ILE . 28.4 mt -76.81 -49.93 22.45 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.308 0 O-C-N 121.406 -0.809 . . . . 0.0 110.955 -178.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.524 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -89.55 7.12 37.9 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 120.706 -1.246 . . . . 0.0 110.106 -179.698 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 24.6 p 44.35 51.28 7.7 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.097 -1.002 . . . . 0.0 110.624 178.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -93.19 5.37 51.76 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.081 -1.012 . . . . 0.0 108.423 179.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 73.61 2.7 61.0 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.669 -1.372 . . . . 0.0 109.669 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -141.94 166.34 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 O-C-N 121.261 -1.141 . . . . 0.0 108.665 178.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.1 tp -113.93 112.36 23.2 Favored 'General case' 0 N--CA 1.512 2.631 0 N-CA-C 107.478 -1.305 . . . . 0.0 107.478 178.074 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -87.58 178.41 6.79 Favored 'General case' 0 N--CA 1.502 2.139 0 O-C-N 121.503 -0.748 . . . . 0.0 110.645 -178.129 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -73.53 -42.98 61.04 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.467 -0.77 . . . . 0.0 111.25 -178.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.497 ' NE2' ' C ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -60.41 -24.46 65.18 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 120.513 -1.367 . . . . 0.0 108.591 -179.732 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -85.35 -33.28 22.08 Favored 'General case' 0 N--CA 1.498 1.954 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 178.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.1 tp -71.48 -35.49 70.84 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.55 -0.719 . . . . 0.0 109.336 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -74.3 -51.58 14.8 Favored 'General case' 0 C--N 1.306 -1.32 0 O-C-N 121.163 -0.96 . . . . 0.0 110.825 -179.143 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.8 -33.66 76.38 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.879 -1.138 . . . . 0.0 110.876 -178.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 40.1 tp -73.17 -27.83 61.87 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.956 -1.09 . . . . 0.0 110.089 -179.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -82.18 -47.9 11.93 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 120.716 -1.24 . . . . 0.0 110.156 -179.347 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 18.4 m -59.23 -35.8 74.3 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 120.942 -1.099 . . . . 0.0 110.392 -179.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 27.0 ttmt -73.75 -47.79 36.53 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.999 -1.063 . . . . 0.0 111.478 -178.369 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -53.88 -25.91 22.24 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.559 -1.338 . . . . 0.0 108.18 -179.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.1 tp -73.33 -21.57 60.52 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -76.74 -35.63 57.65 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.544 -0.722 . . . . 0.0 110.408 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.1 pttp -83.49 -11.98 56.82 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 120.898 -1.126 . . . . 0.0 110.658 -178.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 57.0 t -88.57 -44.87 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 O-C-N 120.94 -1.1 . . . . 0.0 108.438 179.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.464 ' OH ' ' SD ' ' A' ' 62' ' ' MET . 50.5 m-85 -90.55 -153.68 0.31 Allowed 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 179.043 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -152.48 68.06 6.95 Favored Pre-proline 0 N--CA 1.502 2.165 0 O-C-N 120.675 -1.266 . . . . 0.0 110.003 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -57.94 -177.36 0.09 OUTLIER 'Trans proline' 0 C--N 1.318 -1.051 0 C-N-CA 121.472 1.448 . . . . 0.0 109.547 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.466 ' O ' ' CB ' ' A' ' 54' ' ' ASN . 60.5 mttt 67.8 98.37 0.06 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.49 -0.756 . . . . 0.0 109.055 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.466 ' CB ' ' O ' ' A' ' 53' ' ' LYS . 1.4 m120 81.94 12.98 0.6 Allowed 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -179.561 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 52.0 mm-40 -139.01 50.82 1.81 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.396 -0.815 . . . . 0.0 108.851 179.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -54.34 174.38 0.06 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.264 -0.898 . . . . 0.0 109.482 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 48.21 67.45 0.84 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.387 -0.821 . . . . 0.0 109.943 179.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -158.54 -22.7 0.08 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.221 -0.924 . . . . 0.0 109.369 179.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 4.6 mtp -100.04 -6.49 26.35 Favored 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 178.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.542 HH11 ' CG ' ' A' ' 60' ' ' ARG . 0.7 OUTLIER -82.07 -69.1 0.64 Allowed 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 179.588 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -50.07 -12.92 0.09 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.201 -0.937 . . . . 0.0 109.409 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.464 ' SD ' ' OH ' ' A' ' 50' ' ' TYR . 15.4 tpt -103.5 -12.01 17.41 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.392 -0.817 . . . . 0.0 109.665 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -54.05 -16.61 2.05 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.569 -1.332 . . . . 0.0 108.095 179.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -65.38 -44.18 88.39 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.421 -0.799 . . . . 0.0 109.022 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.432 ' O ' ' N ' ' A' ' 68' ' ' ARG . 4.8 tp10 -65.55 -43.99 88.21 Favored 'General case' 0 C--N 1.302 -1.481 0 O-C-N 121.668 -0.645 . . . . 0.0 109.549 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? -46.08 -36.63 5.94 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 38.2 mt -83.37 -27.27 29.79 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.629 -0.669 . . . . 0.0 109.533 179.066 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.432 ' N ' ' O ' ' A' ' 65' ' ' GLU . 12.3 tpt180 -68.42 -36.89 79.73 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.928 -1.108 . . . . 0.0 109.682 -179.347 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 2.4 mmt -84.57 -50.76 7.41 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.033 -1.042 . . . . 0.0 109.64 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 41.4 ttp180 -54.69 -38.29 66.83 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.878 -1.139 . . . . 0.0 110.309 -179.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -78.35 -53.09 7.67 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.978 -1.077 . . . . 0.0 110.508 -179.029 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 43.1 t60 -56.42 -33.23 65.63 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.019 -1.05 . . . . 0.0 109.506 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 58.4 t -75.04 -54.69 13.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 120.734 -1.228 . . . . 0.0 109.499 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 32.0 mtp -63.58 -16.3 60.47 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.309 -0.869 . . . . 0.0 110.269 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.502 ' C ' HD22 ' A' ' 76' ' ' ASN . 42.0 tttp -95.56 -38.24 10.5 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.644 -1.285 . . . . 0.0 110.132 -179.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.66 ' N ' HD22 ' A' ' 76' ' ' ASN . 0.8 OUTLIER -98.21 -11.12 23.04 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 120.975 -1.078 . . . . 0.0 112.145 -178.015 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 74.0 t -110.32 -34.87 2.53 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.45 0 O-C-N 120.467 -1.396 . . . . 0.0 109.638 179.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -59.29 104.13 0.23 Allowed 'General case' 0 N--CA 1.494 1.764 0 O-C-N 120.562 -1.336 . . . . 0.0 107.778 177.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.42 HG23 ' H ' ' A' ' 79' ' ' THR . 0.1 OUTLIER -83.16 -53.63 5.64 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.17 -0.956 . . . . 0.0 111.32 -178.22 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 10.4 t-20 -101.87 24.68 9.6 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.24 -0.913 . . . . 0.0 109.666 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 33.08 37.95 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 178.579 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.568 ' C ' ' H ' ' A' ' 84' ' ' LEU . 16.5 p-10 -91.03 14.61 13.5 Favored 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 178.286 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 37.5 mtm180 64.02 -3.88 0.43 Allowed 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 -178.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.568 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.4 mp -120.52 134.55 55.26 Favored 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 107.164 -1.421 . . . . 0.0 107.164 179.41 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 82.7 t -112.23 130.12 66.51 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.945 0 O-C-N 121.606 -0.684 . . . . 0.0 109.815 -178.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 26.4 p -103.43 162.35 13.1 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.246 -0.909 . . . . 0.0 108.667 178.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.8 tp -63.35 -35.54 80.73 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.264 -0.898 . . . . 0.0 109.063 179.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -60.73 -68.37 0.31 Allowed 'General case' 0 C--N 1.294 -1.824 0 O-C-N 121.128 -0.982 . . . . 0.0 111.623 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -61.46 -30.73 70.77 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.1 -1.0 . . . . 0.0 110.537 -178.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -64.58 -51.64 61.69 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.932 -1.105 . . . . 0.0 109.523 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 52.0 mt -48.39 -42.53 32.12 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.297 -0.877 . . . . 0.0 109.421 179.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -55.19 -57.77 10.43 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.064 -1.022 . . . . 0.0 110.373 -179.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 84.8 p -48.08 -61.87 1.76 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.165 -0.959 . . . . 0.0 110.951 -179.119 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.453 ' O ' ' N ' ' A' ' 96' ' ' ARG . 0.2 OUTLIER -62.41 -65.99 0.61 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.105 -0.997 . . . . 0.0 110.302 -178.697 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.447 ' C ' ' O ' ' A' ' 94' ' ' THR . 17.6 mm100 -32.97 -35.79 0.02 OUTLIER 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.57 -0.706 . . . . 0.0 111.705 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.453 ' N ' ' O ' ' A' ' 94' ' ' THR . 20.7 mmt180 -60.96 95.47 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.861 -1.15 . . . . 0.0 110.124 -179.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 45.5 mttp 55.08 10.5 0.41 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.439 -0.788 . . . . 0.0 110.485 179.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 50.16 69.56 0.6 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.92 -1.113 . . . . 0.0 109.425 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 56.1 t80 . . . . . 0 N--CA 1.494 1.739 0 CA-C-O 118.007 -0.997 . . . . 0.0 109.396 179.944 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 39.2 tp . . . . . 0 N--CA 1.49 1.574 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -62.15 135.59 57.57 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.248 -0.907 . . . . 0.0 109.483 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -163.55 -33.33 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.28 -0.887 . . . . 0.0 109.357 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.514 HG22 ' N ' ' A' ' 5' ' ' TRP . 8.3 p -76.36 161.17 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 O-C-N 121.294 -0.879 . . . . 0.0 109.508 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.514 ' N ' HG22 ' A' ' 4' ' ' VAL . 5.1 m-90 -144.13 71.9 1.33 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.284 -0.885 . . . . 0.0 109.15 179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -149.83 125.84 10.59 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.221 -0.925 . . . . 0.0 109.502 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 54.73 -109.88 0.52 Allowed 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.524 -0.735 . . . . 0.0 109.641 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.635 HD12 ' O ' ' A' ' 8' ' ' LEU . 0.9 OUTLIER -170.63 157.47 5.76 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.377 -0.827 . . . . 0.0 109.448 -179.657 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.537 ' O ' ' N ' ' A' ' 11' ' ' LEU . 26.1 m-20 -38.55 133.19 1.06 Allowed 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.49 -0.756 . . . . 0.0 109.894 -179.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -48.47 -9.56 0.09 OUTLIER Glycine 0 N--CA 1.491 2.339 0 O-C-N 120.61 -1.306 . . . . 0.0 110.359 -179.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.537 ' N ' ' O ' ' A' ' 9' ' ' ASP . 0.4 OUTLIER -154.55 62.03 0.68 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.955 -1.321 . . . . 0.0 109.812 -179.952 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -58.33 130.78 84.36 Favored Pre-proline 0 N--CA 1.49 1.527 0 O-C-N 121.081 -1.012 . . . . 0.0 108.763 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -62.0 -10.63 18.34 Favored 'Trans proline' 0 C--O 1.215 -0.63 0 C-N-CA 120.655 0.903 . . . . 0.0 109.867 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 73.2 m-20 -67.06 -55.21 15.29 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.247 -0.908 . . . . 0.0 109.614 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 38.7 ttp180 48.27 79.29 0.07 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.181 -0.95 . . . . 0.0 109.558 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -78.39 157.13 29.14 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.332 -0.855 . . . . 0.0 109.526 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.694 ' ND2' ' H ' ' A' ' 20' ' ' THR . 0.2 OUTLIER -171.31 67.37 0.45 Allowed Pre-proline 0 N--CA 1.49 1.557 0 O-C-N 121.304 -0.873 . . . . 0.0 109.738 -179.956 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -65.34 -23.05 59.32 Favored 'Trans proline' 0 C--N 1.317 -1.13 0 C-N-CA 121.371 1.381 . . . . 0.0 109.761 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 55.7 tttp -56.77 -41.49 77.73 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.401 -0.812 . . . . 0.0 110.803 -179.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.694 ' H ' ' ND2' ' A' ' 17' ' ' ASN . 29.3 m -64.82 -40.18 94.78 Favored 'General case' 0 N--CA 1.485 1.321 0 O-C-N 120.76 -1.213 . . . . 0.0 110.355 -178.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -55.33 -41.82 72.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.942 -1.099 . . . . 0.0 108.263 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -62.54 -33.13 74.29 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.395 -0.816 . . . . 0.0 110.149 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.411 ' O ' ' N ' ' A' ' 25' ' ' HIS . 96.6 mt -75.84 -62.61 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 O-C-N 120.725 -1.235 . . . . 0.0 109.129 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.9 tp -47.51 -16.2 0.06 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.068 -1.02 . . . . 0.0 111.257 179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.54 ' O ' ' ND1' ' A' ' 25' ' ' HIS . 0.7 OUTLIER -100.77 -15.74 17.55 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.479 -1.388 . . . . 0.0 109.833 179.896 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.4 t0 -76.32 89.55 3.17 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.863 -1.148 . . . . 0.0 108.462 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 10.9 mt -71.85 -52.19 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 O-C-N 121.448 -0.782 . . . . 0.0 111.134 -178.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.568 ' N ' HD22 ' A' ' 28' ' ' ASN . 1.7 m120 -86.32 4.48 38.95 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.856 -1.153 . . . . 0.0 110.029 -179.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 18.8 p 46.22 57.65 5.13 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.082 -1.011 . . . . 0.0 110.319 179.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -99.8 -0.07 40.55 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.274 -0.891 . . . . 0.0 108.737 179.4 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.85 3.76 87.84 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 110.101 -1.2 . . . . 0.0 110.101 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.12 165.35 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.121 0 O-C-N 121.16 -1.2 . . . . 0.0 108.328 178.037 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.405 HD21 ' CD2' ' A' ' 25' ' ' HIS . 4.4 tp -120.43 115.43 23.47 Favored 'General case' 0 N--CA 1.513 2.703 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 178.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.442 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 27.6 p-10 -98.29 -174.21 2.78 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.244 -0.91 . . . . 0.0 111.567 -178.1 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -72.16 -21.23 61.48 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -178.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.496 ' NE2' ' C ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -77.06 -25.86 52.89 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 120.008 -1.683 . . . . 0.0 109.349 -179.682 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -87.82 -31.84 19.36 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.946 -1.096 . . . . 0.0 108.415 178.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.2 tp -77.73 -33.58 52.92 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.598 -0.689 . . . . 0.0 109.17 179.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -71.85 -44.97 62.94 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.033 -1.042 . . . . 0.0 109.557 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.448 ' HB1' ' NZ ' ' A' ' 44' ' ' LYS . . . -72.13 -43.45 64.66 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.043 -1.035 . . . . 0.0 111.3 -178.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.405 ' CD2' ' CD2' ' A' ' 25' ' ' HIS . 35.7 tp -62.39 -24.94 67.66 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.747 -1.221 . . . . 0.0 109.243 -179.404 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -74.53 -36.34 63.17 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 120.982 -1.074 . . . . 0.0 108.822 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 17.6 m -62.45 -54.93 32.94 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.468 -0.77 . . . . 0.0 111.747 -178.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.448 ' NZ ' ' HB1' ' A' ' 40' ' ' ALA . 1.7 mtmt -72.95 -47.48 45.11 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 120.601 -1.312 . . . . 0.0 112.171 -177.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -52.78 -27.93 20.15 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.36 -1.463 . . . . 0.0 109.064 -178.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 13.2 tp -82.08 -25.02 34.89 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.253 -0.904 . . . . 0.0 108.849 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -72.4 -2.86 20.98 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.543 -0.723 . . . . 0.0 109.706 178.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 57.1 mttp -102.2 44.05 1.03 Allowed 'General case' 0 N--CA 1.498 1.927 0 O-C-N 121.233 -0.917 . . . . 0.0 109.634 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 45.6 t -149.78 -54.2 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 O-C-N 121.182 -0.949 . . . . 0.0 109.838 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -84.09 -135.3 0.05 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.2 -0.937 . . . . 0.0 110.013 -179.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -142.67 75.71 18.27 Favored Pre-proline 0 N--CA 1.497 1.919 0 O-C-N 121.264 -0.898 . . . . 0.0 109.27 -179.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -60.34 178.42 0.44 Allowed 'Trans proline' 0 C--N 1.316 -1.147 0 C-N-CA 121.411 1.407 . . . . 0.0 110.15 -179.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 36.2 mttp 70.29 31.15 3.18 Favored 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 -179.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.513 ' ND2' ' O ' ' A' ' 54' ' ' ASN . 1.1 t-20 -134.24 7.36 3.64 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.695 -0.628 . . . . 0.0 109.539 179.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.503 ' CB ' ' O ' ' A' ' 54' ' ' ASN . 8.3 tt0 80.47 -149.54 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.423 -0.798 . . . . 0.0 109.372 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -93.31 74.41 4.56 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 120.995 -1.066 . . . . 0.0 108.965 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -146.06 29.76 1.07 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.486 -0.759 . . . . 0.0 109.959 -179.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -172.43 -17.05 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.953 -1.092 . . . . 0.0 109.547 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.493 ' O ' ' SD ' ' A' ' 62' ' ' MET . 3.3 mmt -108.46 15.34 23.98 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 179.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 38.4 ttp180 -97.6 -68.31 0.81 Allowed 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 178.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -35.06 -41.26 0.14 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.875 -0.516 . . . . 0.0 112.175 -179.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.594 ' SD ' ' N ' ' A' ' 63' ' ' GLU . 0.0 OUTLIER -89.0 -0.3 57.3 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 120.531 -1.356 . . . . 0.0 111.103 -178.741 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.594 ' N ' ' SD ' ' A' ' 62' ' ' MET . 1.1 pp20? -33.39 -30.08 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.31 0 CA-C-O 121.451 0.643 . . . . 0.0 110.668 -178.562 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.562 ' N ' ' O ' ' A' ' 62' ' ' MET . 46.1 mm-40 -68.8 -54.57 15.11 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.419 -0.8 . . . . 0.0 109.316 178.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.44 ' N ' ' O ' ' A' ' 62' ' ' MET . 7.5 tp10 -43.23 -41.52 3.91 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.604 -0.685 . . . . 0.0 110.698 -179.181 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 6.4 mmm180 -51.81 -46.11 64.15 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.123 -0.986 . . . . 0.0 109.296 -179.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 27.3 mt -79.28 -26.88 42.28 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.276 -0.89 . . . . 0.0 110.211 -179.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.11 -39.67 82.74 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.025 -1.047 . . . . 0.0 110.368 -178.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 9.8 mtt -86.08 -48.7 8.39 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 120.906 -1.121 . . . . 0.0 110.099 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.485 ' HG2' HH11 ' A' ' 70' ' ' ARG . 2.7 ttt-85 -55.0 -36.22 65.19 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 120.771 -1.206 . . . . 0.0 109.767 179.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -71.91 -50.7 26.91 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 120.847 -1.158 . . . . 0.0 110.276 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 45.0 t-80 -56.23 -35.18 67.08 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.045 -1.034 . . . . 0.0 110.529 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.417 ' HA ' HD21 ' A' ' 76' ' ' ASN . 70.2 t -71.54 -55.12 14.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 120.613 -1.304 . . . . 0.0 109.776 -179.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.6 mmt -61.53 -22.13 64.87 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.228 -0.92 . . . . 0.0 110.069 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.408 ' HZ2' ' HB3' ' A' ' 75' ' ' LYS . 0.2 OUTLIER -84.34 -37.04 22.08 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.505 -1.372 . . . . 0.0 111.162 -179.141 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.656 HD22 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -102.01 -24.99 13.91 Favored 'General case' 0 N--CA 1.505 2.322 0 O-C-N 120.961 -1.087 . . . . 0.0 112.611 -177.933 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.656 ' H ' HD22 ' A' ' 76' ' ' ASN . 32.6 t -92.86 -33.22 5.27 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.5 0 O-C-N 120.29 -1.506 . . . . 0.0 110.038 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -65.72 99.12 0.43 Allowed 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 178.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.407 HG23 ' H ' ' A' ' 79' ' ' THR . 0.1 OUTLIER -82.68 -56.86 3.6 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.077 -1.014 . . . . 0.0 112.324 -177.099 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.541 ' O ' ' N ' ' A' ' 82' ' ' ASP . 4.9 m120 -98.28 23.83 7.91 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.063 -1.023 . . . . 0.0 109.591 -178.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.469 ' C ' ' H ' ' A' ' 83' ' ' ARG . 0.2 OUTLIER 35.65 25.83 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.58 0 CA-C-N 116.31 -0.404 . . . . 0.0 112.015 178.662 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.541 ' N ' ' O ' ' A' ' 80' ' ' ASN . 81.6 m-20 -81.54 11.07 4.93 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 106.696 -1.594 . . . . 0.0 106.696 178.11 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.469 ' H ' ' C ' ' A' ' 81' ' ' GLN . 70.0 mtt180 65.72 -5.74 0.48 Allowed 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 115.131 -0.941 . . . . 0.0 108.737 -178.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.518 ' H ' ' C ' ' A' ' 82' ' ' ASP . 10.9 mt -114.35 134.04 55.25 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 107.481 -1.303 . . . . 0.0 107.481 178.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 70.4 t -112.15 129.8 66.98 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.875 0 O-C-N 121.51 -0.744 . . . . 0.0 109.391 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 17.5 p -106.17 173.88 6.12 Favored 'General case' 0 N--CA 1.5 2.07 0 N-CA-C 108.166 -1.049 . . . . 0.0 108.166 178.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.6 tp -69.94 -35.22 74.36 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.213 -0.929 . . . . 0.0 109.422 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -61.04 -67.9 0.36 Allowed 'General case' 0 C--N 1.291 -1.952 0 O-C-N 120.897 -1.127 . . . . 0.0 111.578 -177.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -63.12 -30.88 71.94 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.183 -0.948 . . . . 0.0 110.713 -178.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -59.72 -52.36 65.82 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.887 -1.133 . . . . 0.0 109.551 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 87.2 mt -50.79 -48.0 59.64 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.234 -0.916 . . . . 0.0 108.963 179.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -47.89 -55.12 10.6 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.39 -0.819 . . . . 0.0 110.173 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 51.1 m -57.32 -28.53 63.16 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.978 -1.076 . . . . 0.0 110.633 -178.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.503 ' O ' ' N ' ' A' ' 96' ' ' ARG . 29.4 p -98.81 13.67 31.56 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 120.993 -1.067 . . . . 0.0 109.881 -179.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -68.34 53.38 0.08 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.113 -0.992 . . . . 0.0 108.944 179.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.503 ' N ' ' O ' ' A' ' 94' ' ' THR . 5.9 tpp180 -177.82 -32.21 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 179.579 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.423 ' O ' ' N ' ' A' ' 99' ' ' PHE . 40.9 mttp -50.34 -19.22 0.77 Allowed 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.281 -0.887 . . . . 0.0 109.141 -179.582 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 46.4 tt0 -62.29 85.37 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.151 -0.968 . . . . 0.0 109.213 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.423 ' N ' ' O ' ' A' ' 97' ' ' LYS . 74.7 m-85 . . . . . 0 N--CA 1.49 1.549 0 CA-C-O 118.014 -0.993 . . . . 0.0 109.233 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.476 ' C ' HD12 ' A' ' 1' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 60.7 mttp -143.83 171.91 13.57 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.182 -0.948 . . . . 0.0 109.31 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 43.4 tp10 -169.18 106.24 0.4 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.189 -0.945 . . . . 0.0 109.497 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 56.7 t -67.94 -82.01 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.218 -0.926 . . . . 0.0 109.463 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 17.7 t90 -172.29 -79.98 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.162 -0.961 . . . . 0.0 109.363 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.459 ' OE2' ' NH1' ' A' ' 15' ' ' ARG . 56.8 mm-40 -69.18 -49.95 52.02 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.224 -0.922 . . . . 0.0 109.274 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 53.74 63.69 2.11 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.455 -0.778 . . . . 0.0 109.615 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 18.0 mt -45.21 134.71 6.19 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.464 -0.772 . . . . 0.0 109.244 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.464 ' N ' ' OD1' ' A' ' 9' ' ' ASP . 25.7 p-10 -127.73 54.61 1.68 Allowed 'General case' 0 N--CA 1.498 1.966 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -179.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.532 ' O ' ' O ' ' A' ' 11' ' ' LEU . . . 81.74 68.79 1.43 Allowed Glycine 0 N--CA 1.489 2.21 0 N-CA-C 108.264 -1.935 . . . . 0.0 108.264 -178.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.549 ' N ' HD12 ' A' ' 11' ' ' LEU . 6.1 mp 50.25 121.72 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.01 0 CA-C-O 121.991 0.901 . . . . 0.0 111.022 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -135.85 70.06 64.72 Favored Pre-proline 0 N--CA 1.498 1.972 0 O-C-N 121.095 -1.003 . . . . 0.0 109.703 179.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -62.04 -37.27 65.7 Favored 'Trans proline' 0 C--N 1.32 -0.932 0 C-N-CA 121.605 1.537 . . . . 0.0 110.041 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -112.51 92.73 4.13 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.459 ' NH1' ' OE2' ' A' ' 6' ' ' GLU . 46.4 mtp180 -61.01 -30.87 70.55 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.314 -0.866 . . . . 0.0 109.394 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -166.69 -70.29 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.208 -0.932 . . . . 0.0 109.953 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 45.1 t-20 -165.76 77.51 1.24 Allowed Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.184 -0.948 . . . . 0.0 109.807 -179.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -60.03 -15.04 31.17 Favored 'Trans proline' 0 C--N 1.318 -1.055 0 C-N-CA 121.352 1.368 . . . . 0.0 110.115 -179.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 58.5 tttp -55.7 -42.2 74.9 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.496 -0.752 . . . . 0.0 111.171 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 58.5 m -69.19 -40.65 77.95 Favored 'General case' 0 N--CA 1.484 1.27 0 O-C-N 120.619 -1.301 . . . . 0.0 110.619 -178.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.615 ' CE2' ' NE2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -54.68 -33.86 61.46 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 179.883 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -69.68 -34.89 74.58 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 121.493 -0.755 . . . . 0.0 109.977 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.458 ' O ' ' N ' ' A' ' 26' ' ' ASP . 97.8 mt -69.36 -59.92 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 O-C-N 120.866 -1.146 . . . . 0.0 109.1 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.7 tp -44.75 -36.47 3.2 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.468 -0.77 . . . . 0.0 110.577 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.615 ' NE2' ' CE2' ' A' ' 21' ' ' PHE . 56.1 m-70 -81.25 -11.88 59.26 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.273 -1.517 . . . . 0.0 109.609 179.631 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.458 ' N ' ' O ' ' A' ' 23' ' ' ILE . 73.3 m-20 -79.91 90.68 5.34 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.02 -1.05 . . . . 0.0 108.812 179.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.417 HD13 HG21 ' A' ' 27' ' ' ILE . 22.2 mt -75.75 -52.61 17.68 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.354 0 O-C-N 121.283 -0.885 . . . . 0.0 110.878 -178.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.532 ' N ' HD22 ' A' ' 28' ' ' ASN . 1.9 m120 -86.69 11.22 13.49 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.844 -1.16 . . . . 0.0 109.896 -179.569 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 25.0 p 43.6 52.65 6.11 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.333 -0.855 . . . . 0.0 110.554 179.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -95.0 -2.31 50.62 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.08 -1.012 . . . . 0.0 108.332 179.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 76.79 -1.87 61.23 Favored Glycine 0 N--CA 1.488 2.166 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.442 ' O ' HD12 ' A' ' 33' ' ' LEU . 0.9 OUTLIER -143.67 164.9 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.106 0 O-C-N 121.274 -1.133 . . . . 0.0 108.605 178.541 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.442 HD12 ' O ' ' A' ' 32' ' ' VAL . 2.6 mp -121.36 125.6 47.38 Favored 'General case' 0 N--CA 1.519 3.006 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 178.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -108.03 -176.82 3.16 Favored 'General case' 0 N--CA 1.504 2.269 0 O-C-N 121.06 -1.025 . . . . 0.0 110.26 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -59.5 -13.21 8.1 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.676 -0.64 . . . . 0.0 111.042 -179.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.547 ' NE2' ' O ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -81.17 -27.68 35.31 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.53 -1.356 . . . . 0.0 109.25 179.724 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -83.9 -37.46 22.35 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.961 -1.087 . . . . 0.0 109.652 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.537 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 1.5 mt -75.59 -30.7 59.7 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.712 -1.243 . . . . 0.0 108.476 178.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -61.73 -45.64 93.05 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 178.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.93 -28.42 61.51 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.395 -0.816 . . . . 0.0 110.733 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.405 HD23 ' O ' ' A' ' 41' ' ' LEU . 0.6 OUTLIER -73.96 -27.11 60.83 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 120.874 -1.141 . . . . 0.0 110.313 -178.983 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.537 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 37.9 m-85 -80.98 -49.91 10.35 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.677 -1.265 . . . . 0.0 108.989 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 49.0 m -59.18 -54.45 46.84 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.16 -0.963 . . . . 0.0 111.169 -179.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.476 ' CG ' ' N ' ' A' ' 45' ' ' GLU . 15.8 ptmt -61.33 -48.0 83.33 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.142 -0.974 . . . . 0.0 111.864 -177.618 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.476 ' N ' ' CG ' ' A' ' 44' ' ' LYS . 22.5 mm-40 -55.19 -26.27 38.13 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.416 -1.428 . . . . 0.0 109.139 -179.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 41.5 mt -82.84 -37.63 24.13 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.122 -0.986 . . . . 0.0 110.762 -179.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.75 0.02 16.67 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.514 -1.366 . . . . 0.0 109.457 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.4 ttmm -92.44 -27.74 17.28 Favored 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.252 -0.905 . . . . 0.0 109.361 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 84.8 t -102.43 -53.92 7.07 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 121.298 -0.876 . . . . 0.0 109.809 -179.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -72.3 -131.05 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.115 -0.99 . . . . 0.0 109.456 -179.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -179.58 69.99 0.17 Allowed Pre-proline 0 N--CA 1.503 2.208 0 O-C-N 121.406 -0.809 . . . . 0.0 109.041 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -59.59 177.15 0.48 Allowed 'Trans proline' 0 C--N 1.316 -1.162 0 C-N-CA 121.47 1.447 . . . . 0.0 109.995 -179.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 60.1 mttp 53.16 42.37 32.15 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.479 -0.763 . . . . 0.0 109.386 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -173.7 -32.26 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.509 -0.744 . . . . 0.0 110.416 179.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.42 ' O ' ' O ' ' A' ' 56' ' ' GLU . 55.1 mt-10 -112.09 163.89 13.78 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.433 -0.792 . . . . 0.0 109.529 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.42 ' O ' ' O ' ' A' ' 55' ' ' GLU . 40.7 mt-10 -55.84 -168.02 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.262 -0.899 . . . . 0.0 109.594 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.511 ' C ' ' H ' ' A' ' 59' ' ' MET . 63.5 m-20 -75.86 35.47 0.13 Allowed 'General case' 0 N--CA 1.486 1.358 0 O-C-N 121.161 -0.962 . . . . 0.0 109.865 -179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.413 ' H ' ' C ' ' A' ' 56' ' ' GLU . 19.8 m-20 -50.36 -8.62 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.187 -0.945 . . . . 0.0 109.79 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.511 ' H ' ' C ' ' A' ' 57' ' ' ASP . 33.3 mtp -70.14 -5.74 29.29 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.239 -0.913 . . . . 0.0 109.035 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.403 ' O ' ' CG ' ' A' ' 63' ' ' GLU . 26.1 ttm180 -89.16 -49.5 6.71 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.376 -0.827 . . . . 0.0 109.238 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -56.57 -57.37 12.65 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.592 -1.318 . . . . 0.0 109.489 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.569 ' O ' ' N ' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -59.88 -7.12 1.52 Allowed 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.345 -0.847 . . . . 0.0 110.938 -179.239 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.416 ' C ' ' O ' ' A' ' 62' ' ' MET . 12.1 pt-20 -40.3 -21.73 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.381 0 O-C-N 121.406 -0.809 . . . . 0.0 109.99 -179.42 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.569 ' N ' ' O ' ' A' ' 62' ' ' MET . 52.3 mt-10 -54.56 -39.83 68.14 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.318 -0.864 . . . . 0.0 109.196 179.182 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 59.6 mm-40 -71.85 -41.62 67.89 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.216 -0.928 . . . . 0.0 108.871 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.548 ' CG ' HH11 ' A' ' 66' ' ' ARG . 0.0 OUTLIER -51.51 -43.44 62.27 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.452 -0.78 . . . . 0.0 109.12 179.672 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 22.8 mt -76.92 -27.4 54.88 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.385 -0.822 . . . . 0.0 109.87 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.524 ' CG ' HH11 ' A' ' 68' ' ' ARG . 0.0 OUTLIER -73.81 -38.1 64.69 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.023 -1.048 . . . . 0.0 109.88 -179.556 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 23.7 mtt -86.47 -41.59 14.27 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 120.673 -1.267 . . . . 0.0 109.182 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -68.3 -39.74 81.96 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.14 -0.975 . . . . 0.0 110.479 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -84.51 -51.52 6.84 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.987 -1.071 . . . . 0.0 111.419 -178.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.479 ' O ' ' ND2' ' A' ' 76' ' ' ASN . 56.9 t60 -53.76 -40.75 66.47 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.875 -1.141 . . . . 0.0 110.292 -178.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.422 ' HA ' HD21 ' A' ' 76' ' ' ASN . 69.2 t -73.94 -47.23 43.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 120.716 -1.24 . . . . 0.0 109.616 -179.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.502 ' SD ' ' OD2' ' A' ' 78' ' ' ASP . 3.4 mmt -69.5 -17.16 63.57 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.126 -0.984 . . . . 0.0 110.275 -179.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.495 ' HB3' ' HZ3' ' A' ' 75' ' ' LYS . 6.4 ttpm? -90.64 -34.64 15.36 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.362 -1.461 . . . . 0.0 111.159 -178.733 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.633 HD22 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -106.37 -26.49 11.46 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 120.95 -1.094 . . . . 0.0 113.079 -177.67 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.633 ' H ' HD22 ' A' ' 76' ' ' ASN . 40.9 t -94.44 -31.03 4.27 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.551 0 O-C-N 120.286 -1.509 . . . . 0.0 110.503 -179.018 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.502 ' OD2' ' SD ' ' A' ' 74' ' ' MET . 1.6 m-20 -69.06 103.53 1.89 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 120.447 -1.408 . . . . 0.0 107.652 178.538 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.429 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -83.23 -53.19 5.95 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.217 -0.927 . . . . 0.0 111.45 -177.829 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.462 ' O ' ' N ' ' A' ' 82' ' ' ASP . 8.7 t-20 -101.16 23.92 10.18 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 121.201 -0.937 . . . . 0.0 109.578 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.411 ' C ' ' O ' ' A' ' 80' ' ' ASN . 1.3 mm100 31.63 35.97 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 112.341 0.497 . . . . 0.0 112.341 178.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.552 ' C ' ' H ' ' A' ' 84' ' ' LEU . 26.2 t0 -85.27 11.9 9.15 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 178.399 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 36.0 mtm180 65.34 -4.77 0.51 Allowed 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 -178.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.552 ' H ' ' C ' ' A' ' 82' ' ' ASP . 4.4 mp -121.08 134.61 55.27 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 106.751 -1.574 . . . . 0.0 106.751 179.117 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 76.1 t -113.85 130.17 68.45 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 O-C-N 121.514 -0.741 . . . . 0.0 110.321 -178.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 47.4 p -100.04 173.76 6.49 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 178.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.1 tp -73.6 -36.91 65.56 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.206 -0.934 . . . . 0.0 109.229 179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 -63.6 -60.27 3.55 Favored 'General case' 0 C--N 1.29 -2.013 0 O-C-N 120.823 -1.173 . . . . 0.0 111.678 -177.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.429 ' CB ' HG21 ' A' ' 79' ' ' THR . 13.4 mm-40 -63.66 -32.54 74.06 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.644 -1.285 . . . . 0.0 110.139 -178.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -66.01 -52.43 49.41 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.677 -1.265 . . . . 0.0 109.35 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.4 mp -46.85 -45.6 20.35 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.241 -0.912 . . . . 0.0 108.877 179.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -52.42 -57.6 9.35 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.199 -0.938 . . . . 0.0 110.214 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 40.6 m -45.09 -27.83 0.64 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.242 -0.911 . . . . 0.0 109.977 -179.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 29.3 p -97.99 -54.07 3.2 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.35 -0.844 . . . . 0.0 108.723 178.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -52.31 177.87 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.202 -0.936 . . . . 0.0 109.335 179.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.524 ' CG ' HH11 ' A' ' 96' ' ' ARG . 0.0 OUTLIER -162.37 42.0 0.13 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.256 -0.902 . . . . 0.0 109.215 -179.972 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 30.8 ttpt -50.8 -19.59 1.02 Allowed 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.304 -0.872 . . . . 0.0 109.683 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 44.7 mm-40 -66.35 92.62 0.2 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.276 -0.89 . . . . 0.0 109.635 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 58.9 t80 . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 117.932 -1.032 . . . . 0.0 109.51 179.805 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 18.9 mt . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 67.8 mttm 51.5 -102.51 0.12 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.26 -0.9 . . . . 0.0 109.401 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.528 ' O ' ' N ' ' A' ' 5' ' ' TRP . 0.0 OUTLIER -162.41 -22.76 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.156 -0.965 . . . . 0.0 109.658 -179.95 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.421 ' O ' ' O ' ' A' ' 5' ' ' TRP . 27.5 t 55.06 -84.21 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.373 -0.829 . . . . 0.0 109.729 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.528 ' N ' ' O ' ' A' ' 3' ' ' GLU . 61.0 m95 -62.64 -135.84 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.003 -1.061 . . . . 0.0 109.582 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -160.95 148.13 15.36 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.171 -0.956 . . . . 0.0 109.631 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.482 ' N ' ' OE2' ' A' ' 7' ' ' GLU . 1.1 pm0 -167.47 41.47 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.675 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.3 tp -174.89 140.6 0.56 Allowed 'General case' 0 N--CA 1.491 1.617 0 N-CA-C 107.883 -1.155 . . . . 0.0 107.883 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.505 ' OD1' ' N ' ' A' ' 12' ' ' ASP . 0.6 OUTLIER -91.37 -21.33 21.05 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.867 -1.146 . . . . 0.0 109.042 179.758 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 83.99 -0.99 89.3 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 108.815 -1.714 . . . . 0.0 108.815 -179.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -169.62 69.71 0.06 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.484 -1.009 . . . . 0.0 109.374 179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.505 ' N ' ' OD1' ' A' ' 9' ' ' ASP . 2.5 p30 -82.78 149.52 60.23 Favored Pre-proline 0 N--CA 1.494 1.738 0 O-C-N 121.139 -0.975 . . . . 0.0 109.104 -179.666 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.495 ' O ' ' N ' ' A' ' 15' ' ' ARG . 3.4 Cg_endo -61.46 -11.05 18.09 Favored 'Trans proline' 0 C--N 1.324 -0.759 0 C-N-CA 121.003 1.135 . . . . 0.0 109.641 179.322 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 33.0 m120 -65.57 67.74 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.268 -0.895 . . . . 0.0 109.642 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.495 ' N ' ' O ' ' A' ' 13' ' ' PRO . 99.2 mtt180 -60.67 173.21 0.76 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.317 -0.864 . . . . 0.0 109.343 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 24.5 p90 -77.25 25.59 0.17 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.205 -0.934 . . . . 0.0 109.538 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.432 ' H ' ' C ' ' A' ' 15' ' ' ARG . 9.5 m120 51.53 69.34 2.57 Favored Pre-proline 0 N--CA 1.491 1.582 0 O-C-N 121.282 -0.887 . . . . 0.0 109.805 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -62.84 -18.76 66.28 Favored 'Trans proline' 0 C--N 1.318 -1.071 0 C-N-CA 121.573 1.515 . . . . 0.0 110.013 -179.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -55.17 -36.84 66.29 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.404 -0.81 . . . . 0.0 110.924 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.5 m -72.21 -40.91 67.47 Favored 'General case' 0 N--CA 1.484 1.266 0 O-C-N 120.802 -1.186 . . . . 0.0 110.523 -178.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -56.24 -34.85 66.74 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.9 -1.125 . . . . 0.0 108.038 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -69.68 -33.6 72.79 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.453 -0.779 . . . . 0.0 109.884 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 98.2 mt -72.85 -60.54 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 O-C-N 120.838 -1.164 . . . . 0.0 109.278 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.51 HD13 ' O ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -45.92 -39.26 8.52 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.297 -0.877 . . . . 0.0 110.798 -179.415 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 30.7 m170 -78.78 -15.86 57.88 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 120.332 -1.48 . . . . 0.0 110.155 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -78.38 96.42 5.33 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.984 -1.073 . . . . 0.0 108.64 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.402 HD13 HG21 ' A' ' 27' ' ' ILE . 14.9 mt -75.9 -48.36 29.42 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.363 0 O-C-N 121.501 -0.749 . . . . 0.0 111.032 -178.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.513 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -89.31 8.04 32.53 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.853 -1.154 . . . . 0.0 110.003 -179.696 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 46.4 p 44.59 54.75 6.28 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.112 -0.993 . . . . 0.0 110.59 178.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.462 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 21.0 p-10 -94.77 -3.18 49.59 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.054 -1.029 . . . . 0.0 108.71 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 79.41 -5.69 59.58 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 -179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -132.43 165.57 31.76 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 178.507 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.1 tp -116.66 123.5 47.42 Favored 'General case' 0 N--CA 1.515 2.82 0 N-CA-C 107.68 -1.229 . . . . 0.0 107.68 178.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 35.4 p-10 -103.94 179.59 4.23 Favored 'General case' 0 N--CA 1.507 2.379 0 CA-C-O 122.06 0.933 . . . . 0.0 111.038 -178.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -68.19 -8.2 36.72 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.389 -179.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.9 mm100 -85.66 -47.11 10.12 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 120.812 -1.18 . . . . 0.0 109.292 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -73.91 -29.4 62.03 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.333 -0.854 . . . . 0.0 108.814 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.0 tp -79.23 -40.56 30.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.45 -0.781 . . . . 0.0 109.792 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 47.5 mm-40 -74.65 -44.15 51.8 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.598 -1.314 . . . . 0.0 109.59 179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.83 -32.57 71.05 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 120.971 -1.081 . . . . 0.0 110.632 -179.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 55.6 tp -76.59 -27.67 55.9 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.906 -1.121 . . . . 0.0 110.481 -178.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -81.73 -50.25 9.49 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 120.686 -1.259 . . . . 0.0 109.27 -179.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 20.7 m -62.24 -44.46 96.5 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.34 -0.85 . . . . 0.0 110.758 -178.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.1 ptmt -67.75 -43.15 80.56 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.799 -1.188 . . . . 0.0 111.17 -177.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -52.89 -36.82 59.8 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.286 -1.508 . . . . 0.0 108.789 -179.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.452 ' C ' ' H ' ' A' ' 48' ' ' LYS . 4.8 tp -67.85 -25.66 65.65 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 179.371 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -60.23 -3.69 0.67 Allowed 'General case' 0 N--CA 1.488 1.454 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.452 ' H ' ' C ' ' A' ' 46' ' ' LEU . 61.1 mttm -119.92 46.55 1.92 Allowed 'General case' 0 N--CA 1.498 1.969 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 179.405 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 60.3 t -149.91 -53.87 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.221 -0.925 . . . . 0.0 109.57 -179.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -81.91 12.55 3.97 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.245 -0.909 . . . . 0.0 109.943 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.8 t70 60.73 103.87 0.03 OUTLIER Pre-proline 0 N--CA 1.501 2.112 0 O-C-N 121.25 -0.906 . . . . 0.0 109.176 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -70.9 170.7 17.31 Favored 'Trans proline' 0 C--N 1.324 -0.747 0 N-CA-C 109.458 -1.016 . . . . 0.0 109.458 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.409 ' CB ' ' NZ ' ' A' ' 53' ' ' LYS . 8.8 mtmp? 59.8 5.91 0.8 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.663 -0.648 . . . . 0.0 109.702 -179.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 57.9 t-20 -86.01 -2.83 58.68 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.565 ' O ' ' N ' ' A' ' 57' ' ' ASP . 19.6 mm-40 50.45 -145.09 0.49 Allowed 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.553 -0.717 . . . . 0.0 109.387 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.526 ' O ' ' N ' ' A' ' 58' ' ' ASP . 44.1 mt-10 48.31 -87.46 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.595 -0.69 . . . . 0.0 109.722 179.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.613 ' C ' ' H ' ' A' ' 59' ' ' MET . 0.7 OUTLIER -60.86 77.5 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.271 -0.893 . . . . 0.0 109.685 179.962 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.526 ' N ' ' O ' ' A' ' 56' ' ' GLU . 8.2 m-20 -59.05 21.56 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.586 -0.696 . . . . 0.0 111.212 -179.428 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.613 ' H ' ' C ' ' A' ' 57' ' ' ASP . 75.0 mmm 52.41 42.69 31.23 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 120.885 -1.134 . . . . 0.0 108.975 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.421 ' O ' ' OE2' ' A' ' 63' ' ' GLU . 37.1 ttp180 -132.86 -67.15 0.65 Allowed 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -179.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.406 ' C ' ' O ' ' A' ' 60' ' ' ARG . 49.6 mm-40 -45.11 -30.36 1.1 Allowed 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.004 -1.06 . . . . 0.0 109.709 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.535 ' C ' ' H ' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -85.09 3.67 37.75 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.274 -0.891 . . . . 0.0 110.396 -179.821 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.549 ' OE1' ' N ' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -53.97 -1.61 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.135 -0.978 . . . . 0.0 110.019 179.844 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.549 ' N ' ' OE1' ' A' ' 63' ' ' GLU . 15.0 mm-40 -72.97 -48.86 32.96 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.046 -1.034 . . . . 0.0 109.662 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -67.97 -39.46 83.32 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.221 -0.924 . . . . 0.0 109.442 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 38.7 ttt180 -55.46 -36.78 66.94 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.362 -0.836 . . . . 0.0 109.447 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.414 ' O ' ' OE1' ' A' ' 71' ' ' GLU . 24.6 mt -81.88 -28.3 33.0 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.038 -1.039 . . . . 0.0 110.043 -179.59 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.9 -40.41 87.73 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.036 -1.04 . . . . 0.0 109.788 -179.309 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.4 mtm -84.75 -50.23 7.77 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.058 -1.026 . . . . 0.0 109.895 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.4 ttp180 -54.04 -27.69 33.79 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.795 -1.191 . . . . 0.0 109.982 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.414 ' OE1' ' O ' ' A' ' 67' ' ' LEU . 37.5 mt-10 -80.23 -51.22 9.2 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.853 -1.154 . . . . 0.0 110.103 -179.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -54.59 -34.48 62.03 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.092 -1.005 . . . . 0.0 110.547 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 72.6 t -73.2 -54.02 16.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 120.665 -1.272 . . . . 0.0 109.938 -179.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.422 ' O ' ' CG ' ' A' ' 78' ' ' ASP . 2.0 mmt -62.41 -17.77 60.01 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.16 -0.962 . . . . 0.0 109.786 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.47 ' HZ3' ' HB2' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -94.29 -38.57 10.94 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.633 -1.292 . . . . 0.0 111.014 -178.926 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.51 ' N ' HD22 ' A' ' 76' ' ' ASN . 1.0 OUTLIER -98.06 -9.16 26.42 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.101 -1.0 . . . . 0.0 112.254 -177.707 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 84.6 t -116.1 -34.1 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.579 0 O-C-N 120.614 -1.304 . . . . 0.0 110.42 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.425 ' OD2' ' OE1' ' A' ' 81' ' ' GLN . 14.5 p-10 -48.93 108.0 0.16 Allowed 'General case' 0 N--CA 1.497 1.925 0 O-C-N 120.684 -1.26 . . . . 0.0 109.099 178.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -83.15 -66.62 0.87 Allowed 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.015 -1.053 . . . . 0.0 110.791 -178.024 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.53 ' O ' ' N ' ' A' ' 82' ' ' ASP . 10.5 m120 -104.62 25.2 10.59 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.109 -0.994 . . . . 0.0 109.351 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.468 ' C ' ' H ' ' A' ' 83' ' ' ARG . 0.2 OUTLIER 37.23 26.28 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.176 0.512 . . . . 0.0 111.135 178.937 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.531 ' C ' ' H ' ' A' ' 84' ' ' LEU . 56.4 t0 -81.32 12.84 3.27 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 178.405 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.468 ' H ' ' C ' ' A' ' 81' ' ' GLN . 72.6 mtt180 65.67 -5.29 0.51 Allowed 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 -178.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.531 ' H ' ' C ' ' A' ' 82' ' ' ASP . 9.9 mt -116.08 133.71 55.73 Favored 'General case' 0 N--CA 1.494 1.732 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 178.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 69.8 t -111.05 130.95 63.57 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.031 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 51.5 p -104.86 159.37 15.85 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.26 -0.9 . . . . 0.0 109.378 179.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.0 tp -61.3 -36.61 80.57 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -57.02 -68.55 0.21 Allowed 'General case' 0 C--N 1.294 -1.839 0 O-C-N 121.534 -0.728 . . . . 0.0 110.866 -178.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.422 ' O ' ' HB3' ' A' ' 92' ' ' ALA . 56.8 mm-40 -63.94 -34.91 79.04 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.193 -0.942 . . . . 0.0 110.938 -178.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 15.6 t80 -58.3 -49.84 75.74 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.589 -1.319 . . . . 0.0 109.102 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 71.1 mt -51.71 -46.13 63.82 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.098 -1.001 . . . . 0.0 108.844 178.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.422 ' HB3' ' O ' ' A' ' 89' ' ' GLU . . . -43.94 -51.36 7.71 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.458 -0.776 . . . . 0.0 110.094 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 93.7 p -58.0 -32.19 67.68 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.313 -0.867 . . . . 0.0 110.734 -179.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.452 ' OG1' ' N ' ' A' ' 95' ' ' GLN . 22.2 p -93.83 -69.67 0.74 Allowed 'General case' 0 N--CA 1.502 2.172 0 O-C-N 120.999 -1.063 . . . . 0.0 110.271 -179.333 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.452 ' N ' ' OG1' ' A' ' 94' ' ' THR . 2.1 pt20 -46.21 170.29 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.008 -1.057 . . . . 0.0 109.755 -179.632 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.511 ' NE ' ' O ' ' A' ' 96' ' ' ARG . 0.4 OUTLIER -164.36 93.44 0.68 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.059 -1.026 . . . . 0.0 109.47 179.897 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.535 ' O ' ' N ' ' A' ' 99' ' ' PHE . 39.6 tptt -167.99 77.43 0.15 Allowed 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.232 -0.917 . . . . 0.0 109.536 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.403 ' O ' ' OE1' ' A' ' 98' ' ' GLU . 0.0 OUTLIER -64.33 66.76 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.38 -0.825 . . . . 0.0 109.882 -179.87 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.535 ' N ' ' O ' ' A' ' 97' ' ' LYS . 77.9 t80 . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 118.024 -0.989 . . . . 0.0 109.379 179.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 61.8 tp . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -72.24 179.5 3.34 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.31 -0.869 . . . . 0.0 109.433 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.465 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 3.3 mp0 -65.46 140.39 58.6 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.137 -0.977 . . . . 0.0 109.383 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 34.1 t -64.51 127.52 25.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.292 -0.88 . . . . 0.0 109.507 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 84.3 m95 -64.75 109.17 1.95 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.268 -0.895 . . . . 0.0 109.554 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -163.88 65.76 0.16 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.236 -0.915 . . . . 0.0 109.366 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 64.1 tt0 -168.02 156.46 8.99 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.084 -1.01 . . . . 0.0 109.568 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.2 tp -148.85 125.61 11.16 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.293 -0.879 . . . . 0.0 109.023 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -97.85 70.33 2.15 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.146 -0.971 . . . . 0.0 109.166 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -162.06 -74.09 0.02 OUTLIER Glycine 0 N--CA 1.489 2.201 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 41.7 mt -130.72 -83.86 0.53 Allowed 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.587 -0.949 . . . . 0.0 109.364 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -154.77 161.72 28.74 Favored Pre-proline 0 N--CA 1.497 1.908 0 O-C-N 121.007 -1.058 . . . . 0.0 108.629 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -58.79 -45.33 29.74 Favored 'Trans proline' 0 C--N 1.32 -0.943 0 C-N-CA 121.354 1.37 . . . . 0.0 109.867 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.615 HD22 ' H ' ' A' ' 14' ' ' ASN . 1.5 p30 -81.84 -118.4 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.109 -0.995 . . . . 0.0 109.473 -179.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.576 HH11 ' CG ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -175.62 174.23 2.28 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.748 -1.22 . . . . 0.0 109.137 -179.955 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -58.56 98.93 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.17 -0.956 . . . . 0.0 108.859 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -136.84 79.92 38.06 Favored Pre-proline 0 N--CA 1.498 1.927 0 O-C-N 121.401 -0.812 . . . . 0.0 109.671 -179.387 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -58.98 -8.74 6.54 Favored 'Trans proline' 0 C--N 1.318 -1.07 0 C-N-CA 121.192 1.262 . . . . 0.0 109.877 -179.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.0 tttp -60.87 -37.18 81.25 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.455 -0.778 . . . . 0.0 110.533 179.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 48.3 m -70.53 -39.14 74.22 Favored 'General case' 0 C--N 1.308 -1.228 0 O-C-N 120.854 -1.154 . . . . 0.0 110.261 -178.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.447 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.11 -39.95 72.98 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.972 -1.08 . . . . 0.0 108.264 179.692 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.447 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 35.9 t80 -64.97 -36.76 85.44 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.319 -0.863 . . . . 0.0 110.543 -179.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.442 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.9 mt -71.5 -61.32 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 O-C-N 120.735 -1.228 . . . . 0.0 109.491 -179.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.474 HD13 ' O ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -46.72 -37.42 8.42 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.098 -1.001 . . . . 0.0 110.178 -179.93 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 12.5 m-70 -74.69 -14.74 60.78 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 120.552 -1.342 . . . . 0.0 109.56 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.442 ' N ' ' O ' ' A' ' 23' ' ' ILE . 65.9 m-20 -76.26 93.22 3.38 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.948 -1.095 . . . . 0.0 108.859 179.052 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 33.0 mt -75.1 -53.18 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 O-C-N 121.135 -0.978 . . . . 0.0 110.731 -178.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.551 ' N ' HD22 ' A' ' 28' ' ' ASN . 1.7 m120 -86.42 13.86 7.61 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 120.844 -1.16 . . . . 0.0 109.955 -179.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.402 ' O ' ' OG ' ' A' ' 29' ' ' SER . 6.7 t 42.54 51.43 4.86 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.416 -0.803 . . . . 0.0 110.516 178.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -94.44 -4.07 48.94 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.11 -0.994 . . . . 0.0 108.33 179.257 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 77.25 -2.11 62.64 Favored Glycine 0 N--CA 1.489 2.167 0 N-CA-C 109.676 -1.37 . . . . 0.0 109.676 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.423 ' O ' HD12 ' A' ' 33' ' ' LEU . 0.9 OUTLIER -140.5 164.82 21.39 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.04 0 O-C-N 121.41 -1.053 . . . . 0.0 108.601 178.929 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.423 HD12 ' O ' ' A' ' 32' ' ' VAL . 3.4 mp -118.43 129.77 55.58 Favored 'General case' 0 N--CA 1.52 3.035 0 N-CA-C 107.872 -1.159 . . . . 0.0 107.872 177.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.452 ' O ' ' N ' ' A' ' 36' ' ' GLN . 26.2 p-10 -108.01 168.62 9.16 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.3 -0.875 . . . . 0.0 110.325 -179.076 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -50.8 -8.79 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.552 -0.717 . . . . 0.0 110.458 -179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.452 ' N ' ' O ' ' A' ' 34' ' ' ASP . 3.1 mm100 -84.09 -38.28 20.98 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 120.973 -1.079 . . . . 0.0 109.026 178.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -77.99 -29.61 49.74 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.211 -0.931 . . . . 0.0 109.012 179.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.543 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 10.4 mp -78.02 -40.53 38.65 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.107 -0.996 . . . . 0.0 108.368 179.369 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -69.03 -44.64 72.31 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.967 -1.083 . . . . 0.0 109.474 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.88 -27.9 65.19 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.323 -0.86 . . . . 0.0 110.59 -179.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.424 ' O ' ' OE1' ' A' ' 45' ' ' GLU . 22.4 tp -75.32 -25.77 58.11 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.501 -1.374 . . . . 0.0 110.706 -178.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.543 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 11.4 m-85 -82.88 -39.9 20.94 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 120.296 -1.502 . . . . 0.0 110.287 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 84.8 m -72.42 -41.69 65.94 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.717 -1.239 . . . . 0.0 111.406 -178.442 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.465 ' CE ' ' N ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -73.98 -50.94 17.63 Favored 'General case' 0 N--CA 1.499 1.984 0 O-C-N 120.652 -1.28 . . . . 0.0 109.421 -178.331 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.424 ' OE1' ' O ' ' A' ' 41' ' ' LEU . 15.4 pt-20 -51.14 -28.63 11.36 Favored 'General case' 0 C--N 1.299 -1.63 0 O-C-N 120.987 -1.07 . . . . 0.0 108.971 -179.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.3 tp -84.77 -35.31 22.49 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.261 -0.899 . . . . 0.0 109.292 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.8 tm-20 -52.51 -33.73 46.42 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.295 -0.878 . . . . 0.0 110.257 179.342 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.9 pttt -81.7 17.38 1.48 Allowed 'General case' 0 N--CA 1.496 1.857 0 O-C-N 120.686 -1.259 . . . . 0.0 109.734 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 59.7 t -120.31 -59.39 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.386 -0.821 . . . . 0.0 110.196 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -85.46 -129.94 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.983 -1.073 . . . . 0.0 109.933 -179.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.525 ' C ' ' H ' ' A' ' 53' ' ' LYS . 50.7 p-10 -172.93 78.65 0.42 Allowed Pre-proline 0 N--CA 1.49 1.548 0 O-C-N 121.141 -0.974 . . . . 0.0 109.006 -179.443 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -65.85 17.65 0.09 OUTLIER 'Trans proline' 0 C--N 1.319 -0.986 0 C-N-CA 121.639 1.56 . . . . 0.0 110.889 -179.045 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.529 ' O ' ' ND2' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -136.26 6.96 3.09 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.304 -0.873 . . . . 0.0 109.553 179.795 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.529 ' ND2' ' O ' ' A' ' 53' ' ' LYS . 16.5 m120 -141.55 14.07 2.15 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.196 -0.94 . . . . 0.0 109.858 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.414 ' C ' ' H ' ' A' ' 57' ' ' ASP . 21.8 tp10 -152.48 140.89 20.63 Favored 'General case' 0 C--N 1.308 -1.219 0 O-C-N 120.964 -1.085 . . . . 0.0 108.852 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.546 ' CD ' ' H ' ' A' ' 56' ' ' GLU . 2.3 mp0 -79.12 30.84 0.21 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.235 -0.915 . . . . 0.0 109.341 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.518 ' O ' ' N ' ' A' ' 59' ' ' MET . 13.6 p-10 -72.52 -11.91 60.86 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.298 -0.876 . . . . 0.0 109.838 -179.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 46.04 15.6 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.253 -0.904 . . . . 0.0 109.859 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.518 ' N ' ' O ' ' A' ' 57' ' ' ASP . 37.8 mmm 51.41 49.22 21.43 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.288 -0.883 . . . . 0.0 108.767 -179.395 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.497 ' O ' ' N ' ' A' ' 62' ' ' MET . 41.8 ttp180 -129.05 -57.31 1.16 Allowed 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -179.361 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -45.35 -17.54 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.08 -1.013 . . . . 0.0 110.065 -179.356 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.6 ' SD ' ' N ' ' A' ' 63' ' ' GLU . 0.0 OUTLIER -101.14 -0.38 36.23 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.167 -0.958 . . . . 0.0 109.724 -179.9 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.6 ' N ' ' SD ' ' A' ' 62' ' ' MET . 16.2 pt-20 -43.86 -16.2 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.914 0 CA-C-O 121.564 0.697 . . . . 0.0 109.536 -179.152 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.562 ' N ' ' O ' ' A' ' 62' ' ' MET . 35.6 mt-10 -62.38 -58.66 6.84 Favored 'General case' 0 C--N 1.3 -1.545 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.771 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 -62.93 -35.6 80.65 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.286 -0.884 . . . . 0.0 109.431 179.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 33.5 ttp180 -54.15 -50.41 67.03 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.43 -0.794 . . . . 0.0 109.403 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.637 ' C ' HD12 ' A' ' 67' ' ' LEU . 0.6 OUTLIER -79.65 -26.73 40.99 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.31 -0.868 . . . . 0.0 109.716 -179.65 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.77 -38.65 85.97 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.886 -1.134 . . . . 0.0 109.664 -179.685 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 25.9 mtt -83.79 -50.41 8.15 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.927 -1.108 . . . . 0.0 109.864 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 52.8 ttt180 -50.43 -26.57 5.19 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 120.6 -1.312 . . . . 0.0 110.496 -179.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 65.4 mm-40 -85.16 -51.78 6.39 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.774 -1.203 . . . . 0.0 110.684 -179.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.528 ' CE1' ' OD1' ' A' ' 76' ' ' ASN . 59.2 t-80 -54.82 -39.87 68.96 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.963 -1.086 . . . . 0.0 110.337 -179.281 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 68.9 t -73.29 -53.57 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 120.704 -1.248 . . . . 0.0 109.865 -179.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.445 ' O ' ' CG ' ' A' ' 78' ' ' ASP . 4.0 mmt -63.99 -22.8 67.08 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.014 -1.053 . . . . 0.0 109.815 -179.304 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.403 ' NZ ' ' CB ' ' A' ' 75' ' ' LYS . 7.3 ttpm? -89.42 -35.9 15.76 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.641 -1.287 . . . . 0.0 110.727 -178.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.528 ' OD1' ' CE1' ' A' ' 72' ' ' HIS . 5.5 m120 -100.15 -8.95 23.05 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.027 -1.046 . . . . 0.0 112.339 -178.263 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 90.1 t -118.4 -31.56 1.74 Allowed 'Isoleucine or valine' 0 N--CA 1.513 2.684 0 O-C-N 120.497 -1.377 . . . . 0.0 111.063 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.445 ' CG ' ' O ' ' A' ' 74' ' ' MET . 17.1 p-10 -48.9 103.42 0.05 OUTLIER 'General case' 0 N--CA 1.498 1.928 0 O-C-N 120.499 -1.375 . . . . 0.0 109.158 179.396 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -78.58 -63.55 1.38 Allowed 'General case' 0 C--N 1.298 -1.647 0 O-C-N 120.754 -1.216 . . . . 0.0 110.259 -178.518 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.445 ' ND2' ' O ' ' A' ' 80' ' ' ASN . 1.0 OUTLIER -107.98 26.91 9.79 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.142 -0.974 . . . . 0.0 109.745 179.836 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.433 ' OE1' ' OD2' ' A' ' 78' ' ' ASP . 0.2 OUTLIER 36.64 31.32 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.864 0 CA-C-O 121.203 0.525 . . . . 0.0 111.333 178.817 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.553 ' C ' ' H ' ' A' ' 84' ' ' LEU . 89.9 m-20 -87.34 15.66 6.19 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 178.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.504 ' HG2' HH11 ' A' ' 83' ' ' ARG . 6.5 mtt-85 63.17 -2.94 0.39 Allowed 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 -178.574 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.553 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.8 mp -122.73 134.12 54.46 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 179.309 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 75.6 t -112.61 129.52 68.04 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.111 0 O-C-N 121.634 -0.666 . . . . 0.0 109.407 -179.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 64.5 p -94.57 167.22 11.62 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 120.967 -1.083 . . . . 0.0 109.121 179.187 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.747 ' C ' HD13 ' A' ' 87' ' ' LEU . 1.0 OUTLIER -70.14 -38.36 75.48 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.685 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -58.94 -69.37 0.2 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.415 -0.803 . . . . 0.0 111.431 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.406 ' N ' ' CD ' ' A' ' 89' ' ' GLU . 4.9 mp0 -56.49 -32.28 64.86 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.008 -1.058 . . . . 0.0 110.497 -178.417 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -61.79 -48.93 78.42 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 120.799 -1.188 . . . . 0.0 110.135 -179.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.425 ' O ' ' N ' ' A' ' 95' ' ' GLN . 87.4 mt -51.32 -48.39 62.38 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.809 -1.182 . . . . 0.0 108.899 179.172 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -46.22 -59.88 2.64 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.4 -0.812 . . . . 0.0 110.295 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 44.1 t -48.88 -28.05 3.5 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.156 -0.965 . . . . 0.0 110.511 -179.03 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 43.9 p -96.17 -57.62 2.29 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.093 -1.004 . . . . 0.0 108.987 179.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.425 ' N ' ' O ' ' A' ' 91' ' ' LEU . 26.4 mt-30 -53.08 123.98 13.15 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.18 -0.95 . . . . 0.0 109.011 179.46 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.433 ' O ' ' O ' ' A' ' 97' ' ' LYS . 7.3 ttp180 -166.15 117.62 1.03 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.114 -0.991 . . . . 0.0 109.459 -179.729 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.433 ' O ' ' O ' ' A' ' 96' ' ' ARG . 66.8 mmtt 55.3 105.48 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.321 -0.862 . . . . 0.0 109.435 -179.755 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -68.35 81.3 0.25 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.176 -0.953 . . . . 0.0 109.279 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 74.5 t80 . . . . . 0 N--CA 1.49 1.556 0 CA-C-O 118.06 -0.972 . . . . 0.0 109.432 179.959 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.5 HD23 ' O ' ' A' ' 1' ' ' LEU . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 59.4 mttp -144.77 91.46 2.17 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.187 -0.946 . . . . 0.0 109.356 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.447 ' C ' ' H ' ' A' ' 5' ' ' TRP . 9.0 mm-40 52.65 -174.96 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.291 -0.88 . . . . 0.0 109.471 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 26.8 m -73.6 16.08 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.246 -0.909 . . . . 0.0 109.66 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.447 ' H ' ' C ' ' A' ' 3' ' ' GLU . 3.0 t90 -67.12 -71.16 0.21 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.252 -0.905 . . . . 0.0 109.222 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 52.31 -105.78 0.24 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.209 -0.932 . . . . 0.0 109.33 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 71.8 tt0 -170.27 -42.52 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.868 -1.145 . . . . 0.0 109.468 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.492 ' O ' ' N ' ' A' ' 10' ' ' GLY . 12.9 tp -166.81 96.12 0.52 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.201 -0.937 . . . . 0.0 109.41 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.426 ' N ' ' OD1' ' A' ' 9' ' ' ASP . 17.8 p-10 -66.31 56.73 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.482 -0.761 . . . . 0.0 109.876 -179.709 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 8' ' ' LEU . . . 164.07 81.61 0.04 OUTLIER Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.737 -1.345 . . . . 0.0 109.737 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 63.7 tp -51.39 108.16 0.24 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.324 -1.104 . . . . 0.0 108.887 179.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -160.38 151.03 15.33 Favored Pre-proline 0 N--CA 1.493 1.72 0 O-C-N 121.152 -0.967 . . . . 0.0 109.129 -179.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -57.45 -46.74 25.58 Favored 'Trans proline' 0 C--N 1.324 -0.76 0 C-N-CA 121.083 1.189 . . . . 0.0 109.918 179.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.413 ' O ' ' O ' ' A' ' 15' ' ' ARG . 15.4 m120 -154.76 66.97 0.68 Allowed 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.222 -0.924 . . . . 0.0 109.361 -179.397 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.413 ' O ' ' O ' ' A' ' 14' ' ' ASN . 55.2 mtp180 51.18 -179.68 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.159 -0.963 . . . . 0.0 109.555 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.445 ' O ' ' CD2' ' A' ' 16' ' ' PHE . 64.3 t80 -96.95 32.58 2.09 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.277 -0.889 . . . . 0.0 109.502 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.449 ' C ' HD22 ' A' ' 17' ' ' ASN . 0.4 OUTLIER -170.58 68.16 0.52 Allowed Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.168 -0.958 . . . . 0.0 109.836 -179.858 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -64.65 -23.53 63.51 Favored 'Trans proline' 0 C--N 1.318 -1.045 0 C-N-CA 121.468 1.445 . . . . 0.0 109.751 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 61.1 tttp -59.21 -40.06 84.62 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.365 -0.834 . . . . 0.0 110.937 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 52.5 m -68.3 -41.5 80.8 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 120.767 -1.208 . . . . 0.0 110.525 -178.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -55.54 -36.86 67.24 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.026 -1.046 . . . . 0.0 108.371 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -66.87 -35.61 80.42 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.46 -0.775 . . . . 0.0 110.149 -179.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 97.5 mt -71.36 -60.99 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.254 0 O-C-N 120.702 -1.249 . . . . 0.0 108.985 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 tp -46.21 -37.51 7.23 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.334 -0.854 . . . . 0.0 110.795 -179.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.524 ' O ' ' ND1' ' A' ' 25' ' ' HIS . 0.9 OUTLIER -76.28 -16.22 59.83 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.517 -1.364 . . . . 0.0 109.548 -179.943 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 81.5 m-20 -79.54 94.82 5.69 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.17 -0.956 . . . . 0.0 108.891 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 18.5 mt -75.93 -52.21 18.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 O-C-N 121.322 -0.861 . . . . 0.0 110.819 -178.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.695 ' H ' ' ND2' ' A' ' 28' ' ' ASN . 0.1 OUTLIER -84.57 -2.52 57.51 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 120.969 -1.082 . . . . 0.0 110.032 -179.615 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.496 ' N ' HD22 ' A' ' 28' ' ' ASN . 1.4 m 57.2 53.16 8.04 Favored 'General case' 0 C--N 1.294 -1.828 0 O-C-N 121.19 -0.944 . . . . 0.0 110.345 178.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -96.21 -1.07 48.99 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.163 -0.961 . . . . 0.0 108.468 179.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 76.45 -0.09 65.45 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 -179.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.46 160.35 16.94 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 O-C-N 121.262 -1.14 . . . . 0.0 108.578 178.064 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 80.3 mt -107.85 128.6 54.75 Favored 'General case' 0 N--CA 1.511 2.616 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 178.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.415 ' C ' ' H ' ' A' ' 36' ' ' GLN . 39.2 p-10 -106.58 165.02 11.59 Favored 'General case' 0 N--CA 1.501 2.086 0 CA-C-O 121.757 0.789 . . . . 0.0 110.175 -179.279 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.414 ' O ' ' OE2' ' A' ' 39' ' ' GLU . 62.6 mt-10 -52.76 -8.56 0.09 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.771 -0.581 . . . . 0.0 110.325 -179.614 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.415 ' H ' ' C ' ' A' ' 34' ' ' ASP . 3.0 mm100 -86.33 -48.88 8.1 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.812 -1.18 . . . . 0.0 109.707 179.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 59.3 mt-10 -71.12 -29.19 64.94 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.277 -0.889 . . . . 0.0 109.18 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.4 tp -77.83 -39.04 44.92 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.506 -0.746 . . . . 0.0 109.885 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.53 ' OE1' ' N ' ' A' ' 39' ' ' GLU . 0.2 OUTLIER -74.68 -40.37 61.43 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.847 -1.158 . . . . 0.0 109.916 179.993 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.65 -39.31 73.71 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.075 -1.016 . . . . 0.0 111.686 -178.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 41.3 tp -73.07 -25.53 60.94 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 120.833 -1.167 . . . . 0.0 110.214 -178.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 1.4 m-30 -84.82 -49.65 8.24 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 120.853 -1.154 . . . . 0.0 109.388 -179.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 16.2 m -63.01 -34.7 78.12 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.994 -1.066 . . . . 0.0 110.054 -179.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 30.0 ttpt -70.65 -46.64 62.89 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.073 -1.017 . . . . 0.0 110.246 -179.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -56.21 -27.48 54.89 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.888 -1.132 . . . . 0.0 110.036 -179.402 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 7.2 tp -71.03 -24.29 62.33 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.978 -1.076 . . . . 0.0 109.958 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -81.86 2.86 28.38 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 120.875 -1.141 . . . . 0.0 109.496 179.532 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -105.57 -23.39 12.79 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.233 -0.917 . . . . 0.0 109.524 179.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 55.5 t -90.36 -38.07 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.265 -0.897 . . . . 0.0 109.101 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -88.06 -17.95 29.99 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.25 -0.906 . . . . 0.0 109.792 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 48.24 81.72 0.25 Allowed Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 120.7 -1.25 . . . . 0.0 110.296 178.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -60.07 179.09 0.32 Allowed 'Trans proline' 0 C--N 1.318 -1.078 0 C-N-CA 121.098 1.199 . . . . 0.0 109.513 179.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 9.3 mtmm -131.15 -64.81 0.8 Allowed 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.425 -0.797 . . . . 0.0 110.005 -179.355 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -172.26 97.53 0.16 Allowed 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.227 -0.921 . . . . 0.0 109.079 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 57.15 98.77 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.488 -0.758 . . . . 0.0 109.245 -179.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.473 ' N ' ' CD ' ' A' ' 56' ' ' GLU . 1.5 pm0 -129.72 -168.84 2.01 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -147.05 -57.54 0.26 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.138 -0.976 . . . . 0.0 109.65 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.431 ' OD1' ' N ' ' A' ' 58' ' ' ASP . 12.8 p-10 -46.84 -30.82 2.67 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.151 -0.968 . . . . 0.0 109.717 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.409 ' C ' ' SD ' ' A' ' 59' ' ' MET . 1.5 tmt? -56.3 -34.03 66.12 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.473 -0.767 . . . . 0.0 109.027 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 42.8 ttp180 -79.28 -44.9 20.77 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.262 -0.899 . . . . 0.0 109.138 179.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.427 ' O ' ' OE1' ' A' ' 64' ' ' GLU . 42.7 tt0 -54.59 -11.58 0.59 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.329 -0.857 . . . . 0.0 109.509 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.565 ' C ' ' H ' ' A' ' 64' ' ' GLU . 4.6 tpt -100.19 -6.92 25.37 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.347 -0.846 . . . . 0.0 108.998 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.41 ' HB2' HH21 ' A' ' 66' ' ' ARG . 14.6 pt-20 -53.97 4.64 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.188 -0.945 . . . . 0.0 111.282 -179.238 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.565 ' H ' ' C ' ' A' ' 62' ' ' MET . 20.9 mp0 -61.72 -30.8 71.0 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.63 -1.293 . . . . 0.0 110.045 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -55.23 -27.19 44.46 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.061 -1.024 . . . . 0.0 109.802 -179.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.41 HH21 ' HB2' ' A' ' 63' ' ' GLU . 43.5 mtm180 -70.08 -44.17 69.63 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.002 -1.061 . . . . 0.0 109.691 -179.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 72.3 mt -57.85 -41.78 83.08 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.097 -1.002 . . . . 0.0 110.124 -178.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -70.21 -37.24 75.01 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.286 -0.884 . . . . 0.0 109.867 -179.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -82.52 -32.29 28.77 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.144 -0.972 . . . . 0.0 108.87 179.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 40.7 ttp180 -73.85 -49.74 23.63 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.02 -1.05 . . . . 0.0 109.915 179.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -60.58 -49.43 77.58 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.925 -1.11 . . . . 0.0 110.182 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 8.0 t60 -54.58 -36.41 64.37 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.169 -0.957 . . . . 0.0 110.259 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 69.5 t -75.5 -54.94 12.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 120.611 -1.306 . . . . 0.0 109.916 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.414 ' O ' ' CG ' ' A' ' 78' ' ' ASP . 4.1 mmt -63.32 -19.03 64.26 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.032 -1.043 . . . . 0.0 110.188 -179.163 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 72.7 tttt -93.43 -39.72 10.75 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.903 -1.123 . . . . 0.0 111.215 -178.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.599 ' N ' HD22 ' A' ' 76' ' ' ASN . 1.0 OUTLIER -101.46 -9.47 21.05 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 121.081 -1.012 . . . . 0.0 112.33 -177.706 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 87.1 t -110.62 -35.38 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.471 0 O-C-N 120.475 -1.391 . . . . 0.0 109.692 179.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.424 ' OD2' ' OE1' ' A' ' 81' ' ' GLN . 11.9 p-10 -49.1 109.12 0.23 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.763 -1.211 . . . . 0.0 108.649 178.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.593 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -85.3 -62.54 1.51 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 120.914 -1.116 . . . . 0.0 110.397 -177.661 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.498 ' ND2' ' O ' ' A' ' 80' ' ' ASN . 0.7 OUTLIER -104.46 17.43 24.14 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.238 -0.914 . . . . 0.0 109.805 -179.557 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.424 ' OE1' ' OD2' ' A' ' 78' ' ' ASP . 0.3 OUTLIER 43.79 75.01 0.1 Allowed 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.414 -0.804 . . . . 0.0 111.013 177.967 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.583 ' C ' ' H ' ' A' ' 84' ' ' LEU . 45.8 t0 -132.33 19.44 4.4 Favored 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 107.899 -1.149 . . . . 0.0 107.899 178.525 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.525 HH11 ' CG ' ' A' ' 83' ' ' ARG . 5.1 mtt-85 59.62 -3.51 0.11 Allowed 'General case' 0 N--CA 1.491 1.621 0 CA-C-O 121.478 0.656 . . . . 0.0 109.236 -178.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.583 ' H ' ' C ' ' A' ' 82' ' ' ASP . 11.2 mt -123.39 134.96 53.93 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 179.569 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 74.4 t -110.4 128.43 66.68 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.036 0 O-C-N 121.493 -0.754 . . . . 0.0 109.124 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 60.9 p -102.37 156.54 17.52 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.264 -0.898 . . . . 0.0 109.346 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.1 tp -59.06 -39.27 81.55 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.484 -0.76 . . . . 0.0 108.955 179.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -58.8 -68.57 0.25 Allowed 'General case' 0 C--N 1.295 -1.803 0 O-C-N 121.607 -0.683 . . . . 0.0 110.993 -177.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.593 ' CB ' HG21 ' A' ' 79' ' ' THR . 34.6 mm-40 -61.52 -30.28 70.53 Favored 'General case' 0 C--N 1.299 -1.618 0 O-C-N 121.233 -0.917 . . . . 0.0 110.717 -178.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -63.13 -51.68 65.53 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.902 -1.124 . . . . 0.0 109.68 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 78.7 mt -50.33 -45.07 54.58 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.263 -0.898 . . . . 0.0 109.376 179.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -51.52 -57.79 8.08 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.236 -0.915 . . . . 0.0 110.162 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 37.7 t -46.34 -34.34 4.5 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.24 -0.913 . . . . 0.0 110.518 -179.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 44.0 p -86.85 -51.68 5.93 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.003 -1.06 . . . . 0.0 109.063 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -53.46 144.24 17.43 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.053 -1.03 . . . . 0.0 108.784 179.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.521 ' NH1' ' O ' ' A' ' 98' ' ' GLU . 0.0 OUTLIER -164.11 49.93 0.13 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.027 -1.046 . . . . 0.0 109.1 -179.655 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.494 ' O ' ' N ' ' A' ' 99' ' ' PHE . 25.6 mtpt -50.04 -37.75 34.61 Favored 'General case' 0 N--CA 1.485 1.323 0 O-C-N 121.048 -1.032 . . . . 0.0 109.356 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.607 ' H ' ' CD ' ' A' ' 98' ' ' GLU . 2.8 mp0 -48.41 95.01 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.165 -0.959 . . . . 0.0 109.241 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.494 ' N ' ' O ' ' A' ' 97' ' ' LYS . 65.7 m-85 . . . . . 0 N--CA 1.498 1.941 0 CA-C-O 117.957 -1.02 . . . . 0.0 110.385 -179.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.57 ' N ' HD22 ' A' ' 1' ' ' LEU . 3.5 mm? . . . . . 0 N--CA 1.49 1.532 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -51.06 -45.44 61.37 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.206 -0.934 . . . . 0.0 109.546 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -63.34 -178.81 0.28 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.207 -0.933 . . . . 0.0 109.543 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.449 HG22 ' N ' ' A' ' 5' ' ' TRP . 8.5 p -59.08 157.98 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.292 -0.88 . . . . 0.0 109.446 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.449 ' N ' HG22 ' A' ' 4' ' ' VAL . 29.8 t90 -170.55 0.5 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.281 -0.887 . . . . 0.0 109.585 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.461 ' CD ' ' N ' ' A' ' 6' ' ' GLU . 4.4 mp0 -80.01 -158.74 0.18 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.229 -0.92 . . . . 0.0 109.53 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.482 ' CD ' ' N ' ' A' ' 7' ' ' GLU . 1.1 pm0 -164.41 17.18 0.06 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.21 -0.931 . . . . 0.0 109.249 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.3 tp -166.18 141.44 4.65 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -135.17 30.96 3.25 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.068 -1.02 . . . . 0.0 109.422 -179.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.465 ' O ' ' C ' ' A' ' 11' ' ' LEU . . . 172.73 82.69 0.05 OUTLIER Glycine 0 N--CA 1.488 2.109 0 N-CA-C 108.995 -1.642 . . . . 0.0 108.995 -179.539 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.465 ' C ' ' O ' ' A' ' 10' ' ' GLY . 18.7 tp -32.09 127.46 0.24 Allowed 'General case' 0 N--CA 1.509 2.523 0 O-C-N 122.28 -0.541 . . . . 0.0 110.603 -179.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.514 ' C ' ' H ' ' A' ' 14' ' ' ASN . 4.4 m-20 -57.73 150.54 46.77 Favored Pre-proline 0 N--CA 1.49 1.536 0 O-C-N 121.153 -0.967 . . . . 0.0 109.115 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -59.79 4.22 0.17 Allowed 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 121.312 1.341 . . . . 0.0 110.506 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.523 ' CG ' ' H ' ' A' ' 15' ' ' ARG . 8.6 t-20 -127.2 -148.15 0.38 Allowed 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.527 HH11 ' CG ' ' A' ' 15' ' ' ARG . 0.3 OUTLIER 44.53 93.27 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.656 -0.653 . . . . 0.0 109.73 179.877 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -135.17 70.28 1.44 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.423 -0.798 . . . . 0.0 109.452 -179.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.8 m120 50.76 76.1 0.58 Allowed Pre-proline 0 N--CA 1.489 1.5 0 O-C-N 121.246 -0.909 . . . . 0.0 109.556 179.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -59.48 -11.76 14.95 Favored 'Trans proline' 0 C--N 1.319 -1.006 0 C-N-CA 121.445 1.43 . . . . 0.0 110.274 -179.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 48.4 tttm -56.05 -48.22 76.43 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.337 -0.852 . . . . 0.0 110.495 179.685 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 46.2 m -59.66 -37.98 80.19 Favored 'General case' 0 C--N 1.306 -1.296 0 O-C-N 120.963 -1.086 . . . . 0.0 110.444 -178.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.401 ' CD2' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.35 -47.71 78.27 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.915 -1.116 . . . . 0.0 108.126 179.717 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.401 ' N ' ' CD2' ' A' ' 21' ' ' PHE . 20.7 t80 -54.51 -32.7 58.56 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.527 -0.733 . . . . 0.0 109.896 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.48 ' O ' ' N ' ' A' ' 25' ' ' HIS . 96.5 mt -75.04 -61.94 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.223 0 O-C-N 120.814 -1.179 . . . . 0.0 109.676 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 24' ' ' LEU . 20.5 mt -47.74 -13.23 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.785 -1.197 . . . . 0.0 110.742 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.503 ' O ' ' ND1' ' A' ' 25' ' ' HIS . 1.0 OUTLIER -104.62 -14.02 15.76 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 120.526 -1.359 . . . . 0.0 110.582 -179.417 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.472 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 20.6 p-10 -79.59 70.33 6.05 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 120.827 -1.17 . . . . 0.0 109.238 179.662 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.414 HD12 ' OE2' ' A' ' 37' ' ' GLU . 8.1 mt -50.1 -53.18 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 O-C-N 121.041 -1.037 . . . . 0.0 111.127 -179.13 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.761 ' H ' ' ND2' ' A' ' 28' ' ' ASN . 0.0 OUTLIER -85.85 -1.85 57.67 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.891 -1.131 . . . . 0.0 110.095 -179.412 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.403 ' N ' HD22 ' A' ' 28' ' ' ASN . 19.9 p 53.34 50.82 16.69 Favored 'General case' 0 C--N 1.292 -1.895 0 O-C-N 121.289 -0.882 . . . . 0.0 110.49 178.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -95.11 3.41 54.79 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 178.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 74.47 1.13 60.31 Favored Glycine 0 N--CA 1.489 2.213 0 N-CA-C 109.776 -1.329 . . . . 0.0 109.776 -179.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.67 163.39 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.093 0 O-C-N 121.131 -1.217 . . . . 0.0 108.931 178.371 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 68.4 mt -113.7 124.83 53.24 Favored 'General case' 0 N--CA 1.513 2.709 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 178.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -105.61 163.0 13.01 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 121.614 -0.679 . . . . 0.0 109.931 -179.3 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -49.23 -32.29 10.34 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.418 -0.801 . . . . 0.0 111.625 -178.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -64.61 -33.06 75.05 Favored 'General case' 0 C--N 1.293 -1.877 0 O-C-N 120.558 -1.339 . . . . 0.0 109.244 179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.414 ' OE2' HD12 ' A' ' 27' ' ' ILE . 33.8 mm-40 -74.34 -38.14 63.34 Favored 'General case' 0 N--CA 1.496 1.852 0 C-N-CA 119.269 -0.972 . . . . 0.0 108.831 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 2.9 mt -81.58 -39.18 24.96 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.141 -0.975 . . . . 0.0 109.264 178.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -59.97 -39.93 87.33 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 120.628 -1.295 . . . . 0.0 108.775 179.096 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.21 -29.39 62.77 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.295 -0.878 . . . . 0.0 110.369 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.524 ' O ' HD23 ' A' ' 41' ' ' LEU . 0.8 OUTLIER -76.45 -24.3 53.89 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.195 -0.941 . . . . 0.0 110.289 -179.173 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -82.7 -50.5 8.65 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.672 -1.267 . . . . 0.0 109.646 -179.454 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 31.3 m -60.4 -41.74 94.48 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.368 -0.833 . . . . 0.0 111.233 -179.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -73.77 -47.48 38.67 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.039 -1.038 . . . . 0.0 111.808 -177.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.403 ' CD ' ' CD2' ' A' ' 41' ' ' LEU . 18.9 mt-10 -53.91 -28.04 34.26 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.446 -1.408 . . . . 0.0 109.685 -178.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.46 ' C ' ' H ' ' A' ' 48' ' ' LYS . 30.7 mt -77.05 -31.33 56.13 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.926 -1.109 . . . . 0.0 110.441 -179.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.426 ' OE1' ' O ' ' A' ' 47' ' ' GLU . 0.9 OUTLIER -62.89 1.74 0.38 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.8 -1.188 . . . . 0.0 109.627 179.887 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.46 ' H ' ' C ' ' A' ' 46' ' ' LEU . 43.1 mttt -123.9 31.05 5.95 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.188 -0.945 . . . . 0.0 109.679 179.23 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 44.6 t -148.38 -59.01 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 O-C-N 120.915 -1.116 . . . . 0.0 110.338 -179.641 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.581 ' CZ ' ' SD ' ' A' ' 62' ' ' MET . 84.2 m-85 -85.62 -18.81 32.19 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.977 -1.077 . . . . 0.0 110.358 -179.066 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.509 ' C ' ' H ' ' A' ' 53' ' ' LYS . 25.3 m-20 51.91 71.62 1.44 Allowed Pre-proline 0 N--CA 1.49 1.526 0 O-C-N 120.97 -1.081 . . . . 0.0 109.211 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -65.73 14.51 0.1 Allowed 'Trans proline' 0 C--N 1.317 -1.089 0 C-N-CA 121.753 1.635 . . . . 0.0 110.658 -179.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.509 ' H ' ' C ' ' A' ' 51' ' ' ASP . 66.6 mttm -121.42 25.85 9.18 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.451 -0.78 . . . . 0.0 109.745 -179.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -160.17 26.03 0.17 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.117 -0.989 . . . . 0.0 109.916 179.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.462 ' O ' ' C ' ' A' ' 56' ' ' GLU . 36.2 mt-10 -156.33 73.01 0.78 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.107 -0.996 . . . . 0.0 109.342 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.472 ' N ' ' CD ' ' A' ' 56' ' ' GLU . 1.4 mp0 32.8 -104.95 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.844 -0.535 . . . . 0.0 110.763 179.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.47 ' OD1' ' N ' ' A' ' 57' ' ' ASP . 10.0 p-10 -147.55 29.82 0.93 Allowed 'General case' 0 N--CA 1.496 1.832 0 O-C-N 120.996 -1.065 . . . . 0.0 109.888 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.42 ' OD1' ' N ' ' A' ' 58' ' ' ASP . 0.6 OUTLIER -71.22 -1.27 12.04 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.973 -1.08 . . . . 0.0 109.609 -179.817 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -54.19 -32.28 55.15 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.256 -0.903 . . . . 0.0 109.059 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.557 ' O ' ' N ' ' A' ' 62' ' ' MET . 99.5 mtt180 -82.1 -36.28 27.73 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.33 -0.856 . . . . 0.0 109.694 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -46.1 -12.72 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.885 -1.134 . . . . 0.0 110.25 -179.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.581 ' SD ' ' CZ ' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -122.62 4.79 9.54 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.331 -0.855 . . . . 0.0 109.639 179.878 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.445 ' CD ' HH21 ' A' ' 66' ' ' ARG . 1.4 tt0 -44.17 -16.47 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.019 0 O-C-N 121.458 -0.776 . . . . 0.0 109.471 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.547 ' N ' ' O ' ' A' ' 62' ' ' MET . 74.5 mm-40 -61.01 -24.68 66.35 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.253 -0.905 . . . . 0.0 110.139 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -72.68 -41.87 64.88 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.156 -0.965 . . . . 0.0 109.752 -179.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.445 HH21 ' CD ' ' A' ' 63' ' ' GLU . 5.9 mtm180 -50.91 -38.24 48.84 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.169 -0.957 . . . . 0.0 108.902 -179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 64.8 mt -75.05 -28.81 60.55 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.163 -0.961 . . . . 0.0 109.422 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.51 ' HG2' HH11 ' A' ' 68' ' ' ARG . 0.0 OUTLIER -64.67 -40.69 95.85 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.112 -0.992 . . . . 0.0 109.498 -179.683 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 9.1 mtm -86.07 -50.3 7.14 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 120.988 -1.07 . . . . 0.0 109.367 179.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 24.8 ttt-85 -58.51 -41.71 86.05 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.915 -1.116 . . . . 0.0 110.576 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -74.9 -52.18 11.93 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 120.808 -1.183 . . . . 0.0 110.671 -179.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 17.6 t60 -54.32 -41.13 68.65 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 120.942 -1.099 . . . . 0.0 110.294 -179.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.442 ' HA ' HD21 ' A' ' 76' ' ' ASN . 75.3 t -71.34 -49.07 50.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 120.689 -1.257 . . . . 0.0 109.522 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 16.9 mtp -67.81 -19.85 65.12 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.201 -0.937 . . . . 0.0 110.877 -179.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 35.1 pttt -88.11 -32.2 18.81 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 120.302 -1.499 . . . . 0.0 110.721 -179.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.629 HD22 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -104.91 -27.07 11.93 Favored 'General case' 0 N--CA 1.506 2.337 0 O-C-N 121.104 -0.997 . . . . 0.0 112.587 -178.09 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.629 ' H ' HD22 ' A' ' 76' ' ' ASN . 40.2 t -92.61 -33.7 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.468 0 O-C-N 120.253 -1.53 . . . . 0.0 110.236 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 79.2 m-20 -66.04 105.24 1.3 Allowed 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.467 -1.396 . . . . 0.0 108.001 178.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.475 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -83.48 -54.16 5.17 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.298 -0.876 . . . . 0.0 111.417 -178.176 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.427 ' O ' ' C ' ' A' ' 81' ' ' GLN . 6.1 m120 -100.12 24.84 8.12 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.287 -0.883 . . . . 0.0 109.642 -179.438 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.427 ' C ' ' O ' ' A' ' 80' ' ' ASN . 0.9 OUTLIER 32.45 37.05 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 178.857 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.569 ' C ' ' H ' ' A' ' 84' ' ' LEU . 26.0 t0 -88.69 13.73 11.66 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 178.414 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 40.8 mtp180 61.93 -2.52 0.29 Allowed 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 -178.476 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.569 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.5 mp -122.92 134.53 54.36 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 106.695 -1.594 . . . . 0.0 106.695 178.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 69.0 t -112.84 129.98 67.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.049 0 O-C-N 121.687 -0.633 . . . . 0.0 110.21 -178.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 30.1 p -101.78 173.9 6.2 Favored 'General case' 0 N--CA 1.499 1.999 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.9 tp -73.14 -34.76 66.27 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.164 -0.96 . . . . 0.0 109.236 179.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -61.32 -68.24 0.33 Allowed 'General case' 0 C--N 1.293 -1.852 0 O-C-N 121.034 -1.041 . . . . 0.0 111.379 -177.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.475 ' CB ' HG21 ' A' ' 79' ' ' THR . 6.4 mm-40 -60.01 -31.36 69.86 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.242 -0.911 . . . . 0.0 110.719 -178.325 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -64.26 -52.37 59.0 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.912 -1.118 . . . . 0.0 110.136 -179.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.505 ' O ' ' N ' ' A' ' 95' ' ' GLN . 77.5 mt -49.97 -42.49 48.91 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.124 -0.985 . . . . 0.0 109.301 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -53.39 -57.64 9.92 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.297 -0.877 . . . . 0.0 110.304 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 42.9 t -48.31 -28.9 3.4 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.122 -0.986 . . . . 0.0 109.992 -179.158 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.423 ' OG1' ' N ' ' A' ' 95' ' ' GLN . 33.2 p -98.96 -65.86 0.94 Allowed 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.242 -0.911 . . . . 0.0 108.993 179.677 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.505 ' N ' ' O ' ' A' ' 91' ' ' LEU . 23.8 mt-30 -43.02 -48.87 6.1 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.392 -0.817 . . . . 0.0 110.315 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 20.6 mmm180 52.47 54.44 10.65 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.957 -1.089 . . . . 0.0 109.583 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 63.8 tttm -51.07 -24.45 3.92 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.306 -0.872 . . . . 0.0 109.465 179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -74.79 93.48 2.62 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.372 -0.83 . . . . 0.0 109.585 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 118.006 -0.997 . . . . 0.0 109.424 179.999 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 24.0 mt . . . . . 0 N--CA 1.49 1.555 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -61.95 -30.51 70.97 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.282 -0.886 . . . . 0.0 109.677 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -67.46 128.94 38.3 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.193 -0.942 . . . . 0.0 109.509 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 10.6 p -169.12 134.24 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.218 -0.927 . . . . 0.0 109.483 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.419 ' CE3' ' O ' ' A' ' 5' ' ' TRP . 23.1 p-90 -87.37 66.05 8.96 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.252 -0.905 . . . . 0.0 109.633 -179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 54.7 tt0 -101.89 150.73 22.88 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.372 -0.83 . . . . 0.0 109.46 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.476 ' O ' ' CB ' ' A' ' 8' ' ' LEU . 7.4 tp10 66.4 169.86 0.23 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.321 -0.862 . . . . 0.0 109.013 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.476 ' CB ' ' O ' ' A' ' 7' ' ' GLU . 2.3 tp 74.15 36.71 0.66 Allowed 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.277 -0.889 . . . . 0.0 108.873 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -73.14 -24.57 60.6 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.27 -0.894 . . . . 0.0 109.576 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.444 ' O ' ' N ' ' A' ' 12' ' ' ASP . . . -77.74 -73.84 1.04 Allowed Glycine 0 N--CA 1.488 2.155 0 N-CA-C 109.211 -1.556 . . . . 0.0 109.211 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.647 HD22 ' N ' ' A' ' 11' ' ' LEU . 3.2 mm? -63.71 81.59 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.254 -1.144 . . . . 0.0 109.036 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.444 ' N ' ' O ' ' A' ' 10' ' ' GLY . 1.0 OUTLIER -68.76 153.43 95.93 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.208 -0.932 . . . . 0.0 108.677 179.909 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_endo -61.45 172.11 3.74 Favored 'Trans proline' 0 C--N 1.321 -0.879 0 C-N-CA 121.328 1.352 . . . . 0.0 109.618 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 71.8 m-20 -104.76 82.13 1.85 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.565 -0.71 . . . . 0.0 109.302 -179.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.6 ptp180 -138.42 -6.68 1.54 Allowed 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.491 -0.756 . . . . 0.0 109.146 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -77.62 -109.15 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.305 -0.872 . . . . 0.0 109.499 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.677 HD22 ' N ' ' A' ' 17' ' ' ASN . 0.6 OUTLIER 45.58 65.13 6.91 Favored Pre-proline 0 N--CA 1.493 1.68 0 O-C-N 121.296 -0.878 . . . . 0.0 109.725 -179.778 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -68.3 -20.33 42.88 Favored 'Trans proline' 0 C--N 1.318 -1.066 0 C-N-CA 121.585 1.523 . . . . 0.0 110.54 -179.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 78.3 tttt -68.32 -49.42 60.48 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.176 -0.953 . . . . 0.0 111.362 -178.244 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.1 m -63.89 -41.34 97.74 Favored 'General case' 0 N--CA 1.485 1.283 0 O-C-N 120.723 -1.236 . . . . 0.0 110.53 -178.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.47 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.05 -39.56 72.21 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.948 -1.095 . . . . 0.0 108.357 -179.803 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.47 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 53.1 t80 -63.35 -34.0 76.76 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.188 -0.945 . . . . 0.0 110.074 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.47 ' O ' ' N ' ' A' ' 26' ' ' ASP . 97.0 mt -69.92 -59.83 3.11 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 O-C-N 120.714 -1.241 . . . . 0.0 109.099 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.7 tp -45.15 -38.91 5.6 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.325 -0.859 . . . . 0.0 110.377 -179.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.405 ' ND1' HD21 ' A' ' 41' ' ' LEU . 13.7 m-70 -75.15 -17.01 60.49 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 120.428 -1.42 . . . . 0.0 109.402 179.488 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.47 ' N ' ' O ' ' A' ' 23' ' ' ILE . 75.7 m-20 -80.02 92.25 5.57 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.094 -1.004 . . . . 0.0 109.066 179.624 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 49.1 mt -76.3 -45.17 35.36 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.429 0 O-C-N 121.318 -0.863 . . . . 0.0 110.635 -178.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.512 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -94.04 8.21 42.28 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.788 -1.195 . . . . 0.0 110.12 -179.626 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 54.3 p 44.67 64.16 1.45 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.152 -0.967 . . . . 0.0 110.749 178.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -104.39 4.93 33.93 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.257 -0.902 . . . . 0.0 108.914 179.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 70.93 -0.05 31.53 Favored Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -139.2 165.32 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.033 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 177.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.437 HD12 ' HA ' ' A' ' 33' ' ' LEU . 6.2 tp -106.76 110.16 22.26 Favored 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 178.27 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -80.55 147.87 30.61 Favored 'General case' 0 N--CA 1.498 1.93 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.305 -178.477 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -52.32 -38.52 58.78 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.45 -0.781 . . . . 0.0 110.406 -179.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 5.9 mm100 -64.02 -34.21 77.49 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 120.927 -1.108 . . . . 0.0 108.605 179.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -73.46 -33.86 65.08 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 108.132 -1.062 . . . . 0.0 108.132 179.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.2 tp -76.5 -37.22 57.12 Favored 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -72.63 -49.7 30.16 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.957 -1.089 . . . . 0.0 110.119 -179.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.17 -50.46 61.04 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.895 -1.128 . . . . 0.0 110.902 -178.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.405 HD21 ' ND1' ' A' ' 25' ' ' HIS . 40.2 tp -56.16 -26.03 48.92 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.075 -1.015 . . . . 0.0 110.035 -178.702 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -83.13 -49.3 9.64 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 120.896 -1.127 . . . . 0.0 109.379 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 30.1 m -63.37 -41.0 98.78 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 120.943 -1.098 . . . . 0.0 110.22 -179.303 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.9 ttpt -73.4 -49.05 29.14 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.028 -1.045 . . . . 0.0 110.982 -178.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -54.62 -26.55 33.53 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.541 -1.349 . . . . 0.0 109.088 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.445 ' C ' ' H ' ' A' ' 48' ' ' LYS . 5.7 tp -80.43 -36.07 34.2 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.468 -0.77 . . . . 0.0 109.88 -179.484 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -67.09 5.02 0.75 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 120.939 -1.101 . . . . 0.0 109.11 179.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.445 ' H ' ' C ' ' A' ' 46' ' ' LEU . 37.0 mtpt -112.72 -6.9 13.84 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.503 -0.748 . . . . 0.0 109.038 179.486 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 77.9 t -97.9 -61.27 2.32 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.3 -0.875 . . . . 0.0 108.846 179.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -67.21 -137.33 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 178.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -166.03 67.25 1.07 Allowed Pre-proline 0 N--CA 1.49 1.526 0 O-C-N 120.923 -1.11 . . . . 0.0 109.267 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -63.41 173.18 4.53 Favored 'Trans proline' 0 C--N 1.317 -1.12 0 C-N-CA 121.259 1.306 . . . . 0.0 109.814 -179.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 5.4 mtmm -139.07 49.53 1.85 Allowed 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.681 ' N ' HD22 ' A' ' 54' ' ' ASN . 0.9 OUTLIER 51.33 48.56 22.75 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 -179.301 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -106.55 139.19 41.41 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.697 -0.627 . . . . 0.0 109.622 -179.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -76.61 -7.46 55.29 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.184 -0.947 . . . . 0.0 109.441 179.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -143.97 94.45 2.59 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.328 -0.857 . . . . 0.0 109.697 -179.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -166.02 -22.23 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.182 -0.949 . . . . 0.0 109.544 179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.494 ' O ' ' SD ' ' A' ' 62' ' ' MET . 55.0 mtp -98.87 29.93 3.58 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.33 -0.856 . . . . 0.0 109.379 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -104.59 -55.16 2.39 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.376 -0.828 . . . . 0.0 109.724 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.592 ' CD ' ' H ' ' A' ' 61' ' ' GLU . 5.2 mp0 -39.6 -42.26 1.15 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.195 -0.94 . . . . 0.0 111.416 -178.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.589 ' N ' ' SD ' ' A' ' 62' ' ' MET . 0.0 OUTLIER -83.87 6.05 22.96 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 120.717 -1.239 . . . . 0.0 110.481 -179.21 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.461 ' N ' ' SD ' ' A' ' 62' ' ' MET . 2.9 pp20? -45.56 -15.28 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.267 -0.896 . . . . 0.0 109.331 -179.614 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.553 ' N ' ' O ' ' A' ' 62' ' ' MET . 26.4 mm-40 -63.13 -57.6 10.03 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.519 -0.738 . . . . 0.0 109.053 178.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -64.17 -35.93 82.41 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.478 -0.764 . . . . 0.0 109.584 -179.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 24.9 ttp180 -55.69 -49.3 73.34 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.29 -0.881 . . . . 0.0 109.649 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.644 ' C ' HD12 ' A' ' 67' ' ' LEU . 0.5 OUTLIER -78.83 -26.85 44.22 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.19 -0.944 . . . . 0.0 109.948 -179.622 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.515 ' HG2' HH11 ' A' ' 68' ' ' ARG . 0.0 OUTLIER -65.55 -38.76 90.54 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 120.959 -1.088 . . . . 0.0 109.889 -179.452 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 9.0 mtt -85.05 -29.56 24.83 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.121 -0.987 . . . . 0.0 109.857 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -72.95 -40.86 65.03 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.861 -1.149 . . . . 0.0 110.29 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -73.02 -47.28 46.34 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 120.793 -1.192 . . . . 0.0 110.501 -179.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 35.4 t-80 -55.75 -40.87 73.13 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.147 -0.971 . . . . 0.0 110.863 -179.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.413 ' HA ' HD21 ' A' ' 76' ' ' ASN . 66.0 t -72.6 -54.18 16.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 120.551 -1.343 . . . . 0.0 110.126 -179.466 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.7 mmt -61.11 -19.72 61.81 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.141 -0.975 . . . . 0.0 110.018 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 43.4 tttp -82.64 -40.05 21.27 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.662 -1.273 . . . . 0.0 111.399 -178.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.677 HD22 ' N ' ' A' ' 77' ' ' VAL . 0.0 OUTLIER -102.91 -20.77 14.14 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 120.983 -1.073 . . . . 0.0 112.35 -177.842 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.677 ' N ' HD22 ' A' ' 76' ' ' ASN . 31.3 t -97.83 -32.02 3.91 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.391 0 O-C-N 120.455 -1.403 . . . . 0.0 110.025 -179.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -53.28 107.76 0.27 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.724 -1.235 . . . . 0.0 109.302 179.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -81.18 -69.11 0.63 Allowed 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.339 -0.85 . . . . 0.0 112.815 -177.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.466 ' O ' ' N ' ' A' ' 82' ' ' ASP . 9.5 m120 -107.88 27.8 8.86 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 120.879 -1.138 . . . . 0.0 110.748 -177.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.481 ' C ' ' H ' ' A' ' 83' ' ' ARG . 0.3 OUTLIER 42.13 23.24 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.751 0 O-C-N 121.58 -0.7 . . . . 0.0 111.245 178.794 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.504 ' C ' ' H ' ' A' ' 84' ' ' LEU . 37.3 t0 -82.78 13.97 3.51 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 177.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.481 ' H ' ' C ' ' A' ' 81' ' ' GLN . 44.0 mtm180 64.05 -2.25 0.59 Allowed 'General case' 0 N--CA 1.486 1.363 0 CA-C-N 115.37 -0.832 . . . . 0.0 108.797 -179.036 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.504 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.3 mt -115.46 133.57 55.9 Favored 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 179.013 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 78.1 t -109.58 130.98 61.7 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 53.8 p -107.03 153.27 22.85 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.138 -0.976 . . . . 0.0 109.81 -179.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.4 tp -55.36 -34.62 64.43 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 179.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 58.3 mt-10 -57.09 -69.42 0.16 Allowed 'General case' 0 C--N 1.296 -1.743 0 O-C-N 121.43 -0.794 . . . . 0.0 111.862 -178.095 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -68.97 -33.24 73.37 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.862 -1.149 . . . . 0.0 110.895 -177.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -56.38 -50.93 70.13 Favored 'General case' 0 N--CA 1.487 1.413 0 O-C-N 120.765 -1.21 . . . . 0.0 108.777 179.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.492 ' O ' ' N ' ' A' ' 95' ' ' GLN . 52.9 mt -51.65 -49.72 61.77 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.187 -0.945 . . . . 0.0 109.337 179.152 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -44.48 -46.07 9.53 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.415 -0.803 . . . . 0.0 109.85 -179.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 53.5 p -57.27 -34.97 69.19 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.363 -0.836 . . . . 0.0 109.712 179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 22.2 p -94.06 -51.33 4.89 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.199 -0.938 . . . . 0.0 109.222 179.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.492 ' N ' ' O ' ' A' ' 91' ' ' LEU . 20.0 mm100 -68.26 124.58 23.87 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.246 -0.909 . . . . 0.0 109.422 179.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 23.4 mmm180 -130.72 -24.28 2.46 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.402 -0.811 . . . . 0.0 109.185 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 56.4 tttp -44.2 108.86 0.12 Allowed 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.374 -0.829 . . . . 0.0 110.101 -179.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 77.2 mt-10 -85.31 89.79 7.75 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.161 -0.962 . . . . 0.0 109.411 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 88.3 t80 . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 117.976 -1.011 . . . . 0.0 109.418 179.932 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.59 ' N ' HD12 ' A' ' 1' ' ' LEU . 8.6 mp . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.311 -0.625 . . . . 0.0 109.311 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 73.4 tttt 51.35 -127.33 2.39 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.299 -0.876 . . . . 0.0 109.405 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -68.6 116.71 9.44 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.155 -0.966 . . . . 0.0 109.488 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 26.1 t -75.54 -8.86 12.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.227 -0.921 . . . . 0.0 109.492 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 90.3 t90 -144.17 134.71 24.75 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.247 -0.908 . . . . 0.0 109.321 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -167.93 111.96 0.65 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.215 -0.928 . . . . 0.0 109.357 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -167.53 137.38 2.78 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.222 -0.923 . . . . 0.0 109.79 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.9 tp -105.01 -31.68 9.09 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 121.565 -0.709 . . . . 0.0 109.191 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 -68.84 76.01 0.3 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.221 -0.925 . . . . 0.0 109.532 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -149.35 58.65 0.45 Allowed Glycine 0 N--CA 1.495 2.587 0 N-CA-C 109.576 -1.409 . . . . 0.0 109.576 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 35.5 mt 46.11 53.39 9.32 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.286 -1.126 . . . . 0.0 109.809 179.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.98 152.64 76.5 Favored Pre-proline 0 N--CA 1.489 1.521 0 O-C-N 121.187 -0.946 . . . . 0.0 108.698 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -54.94 -42.92 64.45 Favored 'Trans proline' 0 C--N 1.321 -0.894 0 C-N-CA 120.989 1.126 . . . . 0.0 109.62 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -84.52 44.08 1.02 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.237 -0.914 . . . . 0.0 109.223 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.542 HH11 ' CG ' ' A' ' 15' ' ' ARG . 0.3 OUTLIER -53.56 133.74 41.14 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.378 -0.827 . . . . 0.0 109.623 -179.947 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -170.14 -36.38 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.295 -0.878 . . . . 0.0 109.451 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 50.22 68.6 3.27 Favored Pre-proline 0 N--CA 1.49 1.549 0 O-C-N 121.26 -0.9 . . . . 0.0 109.68 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -63.9 -21.97 68.81 Favored 'Trans proline' 0 C--N 1.318 -1.051 0 C-N-CA 121.402 1.401 . . . . 0.0 109.895 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -58.26 -37.38 74.83 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.165 -0.959 . . . . 0.0 110.801 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 52.7 m -71.52 -40.98 69.75 Favored 'General case' 0 C--N 1.307 -1.263 0 O-C-N 120.742 -1.224 . . . . 0.0 110.565 -178.568 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -55.85 -35.16 66.12 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 120.88 -1.137 . . . . 0.0 107.969 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -68.2 -33.3 74.18 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.423 -0.798 . . . . 0.0 109.268 179.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.505 ' O ' ' OD1' ' A' ' 26' ' ' ASP . 96.7 mt -73.13 -61.51 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.217 0 O-C-N 120.882 -1.136 . . . . 0.0 108.992 179.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.515 HD13 ' O ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -44.37 -27.69 0.46 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.889 -1.132 . . . . 0.0 110.725 -179.644 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.528 ' ND1' ' N ' ' A' ' 25' ' ' HIS . 0.2 OUTLIER -90.21 -13.73 34.91 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.142 -1.599 . . . . 0.0 110.31 179.887 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.505 ' OD1' ' O ' ' A' ' 23' ' ' ILE . 20.3 p-10 -74.45 62.37 0.99 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.779 -1.2 . . . . 0.0 109.553 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 64.4 mt -48.83 -52.06 10.48 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 O-C-N 120.929 -1.107 . . . . 0.0 110.977 -179.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.523 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -90.1 12.47 17.71 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 120.818 -1.176 . . . . 0.0 110.056 -179.459 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.402 ' C ' ' O ' ' A' ' 28' ' ' ASN . 26.5 p 42.23 50.91 4.55 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.261 -0.9 . . . . 0.0 110.699 178.683 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.408 ' O ' ' OD1' ' A' ' 30' ' ' ASP . 10.9 t70 -95.04 -3.89 47.45 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.03 -1.044 . . . . 0.0 108.53 179.365 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.61 4.51 87.72 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 -179.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -143.78 164.19 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 O-C-N 121.177 -1.19 . . . . 0.0 108.876 178.521 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.0 mp -115.43 121.06 41.61 Favored 'General case' 0 N--CA 1.518 2.934 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 177.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.544 ' N ' ' OD1' ' A' ' 34' ' ' ASP . 0.2 OUTLIER -105.68 172.91 6.55 Favored 'General case' 0 N--CA 1.505 2.286 0 CA-C-O 121.766 0.794 . . . . 0.0 111.108 -177.82 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -53.92 -40.6 66.84 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.493 -0.755 . . . . 0.0 112.156 -178.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.493 ' NE2' ' C ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -61.88 -24.45 66.94 Favored 'General case' 0 C--N 1.295 -1.764 0 O-C-N 120.161 -1.587 . . . . 0.0 108.717 -179.799 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -81.09 -40.89 23.41 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.12 -0.987 . . . . 0.0 109.653 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.49 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 6.4 mt -75.81 -30.41 59.02 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.885 -1.134 . . . . 0.0 108.716 178.544 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -60.72 -46.2 91.32 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 120.887 -1.133 . . . . 0.0 108.699 178.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.44 -29.58 62.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.455 -0.778 . . . . 0.0 110.706 -179.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -72.67 -25.76 61.38 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.057 -1.027 . . . . 0.0 110.248 -178.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.49 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 38.1 m-85 -80.67 -49.27 11.45 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 120.862 -1.149 . . . . 0.0 109.732 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 28.2 m -59.39 -48.7 80.65 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.142 -0.974 . . . . 0.0 111.266 -178.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 12.8 ptpt -66.71 -41.26 88.24 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.811 -1.181 . . . . 0.0 111.674 -177.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -56.86 -28.22 61.45 Favored 'General case' 0 C--N 1.298 -1.67 0 O-C-N 120.304 -1.498 . . . . 0.0 108.466 -179.054 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 15.4 mt -85.9 -26.38 25.63 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.363 -0.836 . . . . 0.0 110.163 179.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.5 1.17 1.26 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 120.966 -1.084 . . . . 0.0 110.552 -178.633 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.3 pttp -120.87 42.15 3.11 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.289 -0.882 . . . . 0.0 110.873 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -171.77 -38.45 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 120.669 -1.27 . . . . 0.0 110.6 178.057 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 11.9 m-85 -95.07 -12.23 26.91 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.839 -1.163 . . . . 0.0 109.556 -179.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.534 ' C ' ' H ' ' A' ' 53' ' ' LYS . 0.5 OUTLIER 50.58 75.86 0.61 Allowed Pre-proline 0 N--CA 1.49 1.548 0 O-C-N 121.086 -1.009 . . . . 0.0 109.661 179.618 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -65.82 13.39 0.12 Allowed 'Trans proline' 0 C--N 1.318 -1.051 0 C-N-CA 121.612 1.541 . . . . 0.0 110.367 -179.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.534 ' H ' ' C ' ' A' ' 51' ' ' ASP . 5.1 mtmp? -107.21 -31.68 8.13 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.489 -0.757 . . . . 0.0 109.403 179.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.418 ' OD1' ' O ' ' A' ' 51' ' ' ASP . 52.2 p30 -66.6 12.33 0.07 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.375 -0.828 . . . . 0.0 109.951 179.533 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.604 ' O ' ' N ' ' A' ' 57' ' ' ASP . 36.2 mt-10 49.82 -147.48 0.33 Allowed 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.0 -1.063 . . . . 0.0 109.505 179.462 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 56.83 -70.76 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.94 -0.475 . . . . 0.0 110.076 179.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.634 ' C ' ' H ' ' A' ' 59' ' ' MET . 25.3 t70 -76.52 81.0 3.21 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.113 -0.992 . . . . 0.0 109.442 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -56.62 12.17 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.565 -0.709 . . . . 0.0 110.77 -179.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.634 ' H ' ' C ' ' A' ' 57' ' ' ASP . 68.8 mmm 56.4 16.26 2.36 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.082 -1.011 . . . . 0.0 109.296 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 28.7 ttm180 -97.42 -49.61 4.84 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.452 -0.78 . . . . 0.0 109.155 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -55.58 -50.91 68.83 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.996 -1.065 . . . . 0.0 110.588 -179.015 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.529 ' O ' ' N ' ' A' ' 64' ' ' GLU . 0.2 OUTLIER -72.2 -3.97 26.57 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.994 -1.066 . . . . 0.0 110.929 -178.548 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.428 ' C ' ' O ' ' A' ' 62' ' ' MET . 15.4 pt-20 -38.09 -26.13 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.28 0 O-C-N 121.662 -0.649 . . . . 0.0 110.296 -179.636 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.529 ' N ' ' O ' ' A' ' 62' ' ' MET . 75.5 mm-40 -56.41 -24.0 41.96 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.285 -0.884 . . . . 0.0 109.457 179.447 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -76.88 -46.48 24.38 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.209 -0.932 . . . . 0.0 109.775 -179.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 37.4 mtm180 -52.95 -45.14 67.57 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.155 -0.966 . . . . 0.0 108.983 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 30.1 mt -68.92 -27.67 65.97 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.203 -0.936 . . . . 0.0 109.586 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.3 -41.04 94.5 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.289 -0.882 . . . . 0.0 109.526 -179.62 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.9 mtt -85.8 -50.11 7.4 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.944 -1.098 . . . . 0.0 109.382 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.547 ' CG ' HH11 ' A' ' 70' ' ' ARG . 0.9 OUTLIER -56.1 -45.16 79.55 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.027 -1.045 . . . . 0.0 110.669 -179.703 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -75.55 -52.36 10.8 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.0 -1.063 . . . . 0.0 111.146 -178.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.515 ' O ' ' ND2' ' A' ' 76' ' ' ASN . 13.8 t60 -55.49 -39.77 70.86 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.062 -1.024 . . . . 0.0 110.455 -179.249 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.418 ' HA ' HD21 ' A' ' 76' ' ' ASN . 72.1 t -71.87 -53.79 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.76 0 O-C-N 120.654 -1.279 . . . . 0.0 109.782 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.439 ' O ' ' OD1' ' A' ' 78' ' ' ASP . 3.0 mmt -64.67 -15.5 61.41 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.242 -0.911 . . . . 0.0 110.335 -179.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -93.86 -38.78 11.05 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.719 -1.238 . . . . 0.0 111.084 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.629 HD22 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -100.61 -26.24 13.89 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 120.947 -1.096 . . . . 0.0 112.039 -178.178 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.629 ' H ' HD22 ' A' ' 76' ' ' ASN . 40.3 t -90.63 -36.14 7.97 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.279 0 O-C-N 120.268 -1.52 . . . . 0.0 109.197 179.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.439 ' OD1' ' O ' ' A' ' 74' ' ' MET . 10.0 p-10 -49.27 109.49 0.27 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 120.808 -1.182 . . . . 0.0 108.659 178.534 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.603 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -86.94 -64.18 1.19 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 120.994 -1.066 . . . . 0.0 110.318 -177.567 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.81 ' H ' HD22 ' A' ' 80' ' ' ASN . 0.1 OUTLIER -102.41 16.28 26.73 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.244 -0.91 . . . . 0.0 109.574 -179.651 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.43 ' OE1' ' OD2' ' A' ' 78' ' ' ASP . 0.4 OUTLIER 42.96 74.0 0.13 Allowed 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.495 -0.753 . . . . 0.0 111.09 178.127 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.581 ' C ' ' H ' ' A' ' 84' ' ' LEU . 38.9 t0 -129.45 18.36 5.84 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 107.552 -1.277 . . . . 0.0 107.552 178.313 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 78.2 mtt180 61.88 -4.71 0.18 Allowed 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 -178.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.581 ' H ' ' C ' ' A' ' 82' ' ' ASP . 9.8 mt -124.26 134.45 53.23 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 75.0 t -109.91 129.42 64.87 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.529 -0.732 . . . . 0.0 109.083 -179.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 65.4 p -101.79 162.15 13.13 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 121.195 -0.941 . . . . 0.0 109.187 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.8 tp -63.8 -37.64 88.12 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -58.33 -68.72 0.23 Allowed 'General case' 0 C--N 1.293 -1.872 0 O-C-N 121.468 -0.77 . . . . 0.0 110.894 -178.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.603 ' CB ' HG21 ' A' ' 79' ' ' THR . 8.3 mm-40 -61.95 -30.55 70.99 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.324 -0.86 . . . . 0.0 110.863 -178.368 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -64.26 -51.6 62.8 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.763 -1.21 . . . . 0.0 109.539 -179.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.485 ' O ' ' N ' ' A' ' 95' ' ' GLN . 67.4 mt -49.12 -44.31 42.26 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.224 -0.923 . . . . 0.0 109.224 179.399 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -51.16 -58.81 5.15 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.326 -0.859 . . . . 0.0 110.054 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 43.2 t -45.61 -29.99 1.38 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.135 -0.978 . . . . 0.0 109.968 -179.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 29.9 p -95.86 -58.61 2.05 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.241 -0.912 . . . . 0.0 108.856 179.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.485 ' N ' ' O ' ' A' ' 91' ' ' LEU . 2.9 tt0 -41.59 -48.55 4.04 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.544 -0.723 . . . . 0.0 110.472 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.448 ' HE ' ' CA ' ' A' ' 96' ' ' ARG . 0.0 OUTLIER -55.96 87.87 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.841 -1.162 . . . . 0.0 109.536 -179.861 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.484 ' N ' ' O ' ' A' ' 95' ' ' GLN . 88.6 tttt -45.53 113.18 0.55 Allowed 'General case' 0 N--CA 1.486 1.354 0 O-C-N 121.268 -0.895 . . . . 0.0 109.843 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 54.5 tt0 -58.34 92.77 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.169 -0.957 . . . . 0.0 109.524 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 69.9 t80 . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 118.0 -1.0 . . . . 0.0 109.412 179.864 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 17.1 mt . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 54.9 mttp -148.55 67.81 1.07 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.266 -0.896 . . . . 0.0 109.345 -179.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -168.64 134.37 1.75 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.301 -0.874 . . . . 0.0 109.322 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 23.2 t -147.02 -20.01 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 O-C-N 121.293 -0.88 . . . . 0.0 109.418 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 72.7 t-105 -56.57 113.32 1.57 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.181 -0.95 . . . . 0.0 109.388 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -78.79 53.04 1.3 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.308 -0.87 . . . . 0.0 109.633 -179.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.462 ' CD ' HH22 ' A' ' 15' ' ' ARG . 43.1 mt-10 52.62 -163.43 0.08 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.3 -0.875 . . . . 0.0 109.14 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.7 pp -159.04 133.63 7.98 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.22 -0.925 . . . . 0.0 109.492 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -89.46 77.96 7.21 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.218 -0.926 . . . . 0.0 109.624 -179.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -163.86 -28.01 0.02 OUTLIER Glycine 0 N--CA 1.491 2.319 0 C-N-CA 119.621 -1.276 . . . . 0.0 109.951 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 94.3 mt -149.23 60.48 1.04 Allowed 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.21 -1.171 . . . . 0.0 108.685 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -74.85 148.99 85.32 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 120.981 -1.074 . . . . 0.0 109.307 -179.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_endo -62.62 -37.69 55.94 Favored 'Trans proline' 0 C--N 1.324 -0.741 0 C-N-CA 121.199 1.266 . . . . 0.0 109.715 179.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.506 ' CG ' ' H ' ' A' ' 15' ' ' ARG . 19.0 t30 -140.21 -114.56 0.14 Allowed 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.404 -0.81 . . . . 0.0 109.293 -179.212 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.506 ' H ' ' CG ' ' A' ' 14' ' ' ASN . 97.4 mtt180 52.95 -173.28 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 120.644 -1.285 . . . . 0.0 109.513 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -62.83 156.56 23.69 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.31 -0.869 . . . . 0.0 109.993 -179.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.496 HD22 ' C ' ' A' ' 17' ' ' ASN . 0.1 OUTLIER -159.75 66.38 2.73 Favored Pre-proline 0 N--CA 1.491 1.602 0 O-C-N 121.305 -0.872 . . . . 0.0 109.295 179.633 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo -64.82 -17.19 58.74 Favored 'Trans proline' 0 C--N 1.318 -1.066 0 C-N-CA 121.535 1.49 . . . . 0.0 110.299 -179.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 43.4 tttm -57.48 -36.84 71.98 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.247 -0.908 . . . . 0.0 110.767 -179.269 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.4 m -69.13 -39.37 78.92 Favored 'General case' 0 C--N 1.306 -1.291 0 O-C-N 120.804 -1.185 . . . . 0.0 110.091 -179.125 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.419 ' CE2' ' CD2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -56.72 -40.5 75.78 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.091 -1.006 . . . . 0.0 108.508 -179.951 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -64.11 -36.28 83.51 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.358 -0.839 . . . . 0.0 110.583 -179.318 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.415 ' O ' ' N ' ' A' ' 26' ' ' ASP . 84.0 mt -73.96 -61.33 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.247 0 O-C-N 120.71 -1.244 . . . . 0.0 109.323 -179.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 34.9 tp -46.31 -30.78 2.2 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.098 -1.001 . . . . 0.0 110.743 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.419 ' CD2' ' CE2' ' A' ' 21' ' ' PHE . 1.1 m80 -84.75 -14.73 47.38 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.27 -1.519 . . . . 0.0 109.424 179.537 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.415 ' N ' ' O ' ' A' ' 23' ' ' ILE . 95.0 m-20 -74.81 94.18 2.73 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.151 -0.968 . . . . 0.0 108.895 179.131 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.413 HD13 HG21 ' A' ' 27' ' ' ILE . 25.7 mt -76.64 -51.6 18.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.346 0 O-C-N 121.414 -0.804 . . . . 0.0 110.964 -178.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.52 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.9 OUTLIER -87.65 7.91 27.81 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 120.753 -1.217 . . . . 0.0 110.03 -179.494 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 24.8 p 44.03 48.88 7.41 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.165 -0.959 . . . . 0.0 110.528 178.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.511 ' N ' ' OD1' ' A' ' 30' ' ' ASP . 19.6 p-10 -91.98 0.01 57.48 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.128 -0.982 . . . . 0.0 108.489 179.1 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 79.28 -2.77 69.51 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 109.791 -1.324 . . . . 0.0 109.791 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -138.61 164.16 26.83 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 O-C-N 121.286 -1.126 . . . . 0.0 108.673 178.374 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.7 tp -113.92 110.04 19.46 Favored 'General case' 0 N--CA 1.511 2.576 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 177.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -88.72 -176.09 5.13 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.472 -0.768 . . . . 0.0 110.751 -177.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 49.4 tt0 -73.46 -44.49 57.96 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.523 -0.736 . . . . 0.0 111.372 -178.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.51 ' NE2' ' C ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -59.29 -25.0 63.75 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 120.455 -1.403 . . . . 0.0 108.323 -179.768 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -85.02 -33.68 22.47 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 179.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.4 tp -74.65 -32.27 62.22 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.42 -0.8 . . . . 0.0 109.283 179.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.24 -46.51 60.9 Favored 'General case' 0 C--N 1.305 -1.342 0 O-C-N 121.28 -0.888 . . . . 0.0 109.733 -179.524 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.53 -35.51 73.2 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.103 -0.998 . . . . 0.0 110.514 -179.305 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.6 mt -69.3 -25.76 64.39 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.938 -1.101 . . . . 0.0 109.325 -179.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.412 ' CZ ' ' SD ' ' A' ' 69' ' ' MET . 0.1 OUTLIER -81.58 -51.81 7.86 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 120.881 -1.137 . . . . 0.0 109.781 -179.13 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 68.6 m -69.4 -47.08 65.29 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.218 -0.926 . . . . 0.0 111.345 -178.392 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 18.4 ttpt -74.6 -47.5 32.01 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.018 -1.051 . . . . 0.0 111.811 -177.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -57.22 -29.38 63.69 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.224 -1.548 . . . . 0.0 109.708 -179.044 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.483 ' C ' ' H ' ' A' ' 48' ' ' LYS . 12.6 tp -71.87 -24.1 61.62 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.232 -0.918 . . . . 0.0 109.844 -179.58 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -56.48 -5.48 0.21 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.297 -0.877 . . . . 0.0 109.232 179.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.483 ' H ' ' C ' ' A' ' 46' ' ' LEU . 39.2 mttp -108.65 37.36 2.54 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.368 -0.833 . . . . 0.0 109.86 -179.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 85.3 t -151.01 -60.09 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 O-C-N 121.04 -1.038 . . . . 0.0 109.67 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 40.8 m-85 -79.71 -20.32 46.75 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.14 -0.975 . . . . 0.0 109.753 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 48.81 73.73 0.94 Allowed Pre-proline 0 N--CA 1.493 1.695 0 O-C-N 120.76 -1.212 . . . . 0.0 109.554 179.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -60.78 174.59 1.62 Allowed 'Trans proline' 0 C--N 1.315 -1.207 0 C-N-CA 121.308 1.339 . . . . 0.0 110.026 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.503 ' CG ' ' H ' ' A' ' 54' ' ' ASN . 0.0 OUTLIER -150.46 -90.55 0.07 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.546 -0.721 . . . . 0.0 109.224 -179.816 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.522 ' ND2' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -165.75 90.46 0.46 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.185 -0.947 . . . . 0.0 109.447 -179.937 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -143.5 -177.86 5.6 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.285 -0.884 . . . . 0.0 109.492 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 80.0 mt-10 -81.54 -13.2 58.37 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.323 -0.861 . . . . 0.0 109.789 -179.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.533 ' O ' ' N ' ' A' ' 59' ' ' MET . 77.2 m-20 -102.53 44.81 0.99 Allowed 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.315 -0.866 . . . . 0.0 109.135 179.791 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -42.78 90.26 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.684 -0.635 . . . . 0.0 110.741 -179.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.533 ' N ' ' O ' ' A' ' 57' ' ' ASP . 61.2 mtp 53.3 50.37 17.73 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.548 -0.72 . . . . 0.0 109.104 -179.717 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.575 ' O ' ' N ' ' A' ' 62' ' ' MET . 42.2 ttm180 -122.55 -59.56 1.61 Allowed 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.67 -0.644 . . . . 0.0 109.394 -179.58 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -41.54 -16.54 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.092 -1.005 . . . . 0.0 111.193 -178.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.575 ' N ' ' O ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -116.3 3.44 13.37 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.239 -0.913 . . . . 0.0 110.122 179.794 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.493 ' N ' ' SD ' ' A' ' 62' ' ' MET . 1.8 tt0 -42.8 -17.77 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.438 -0.789 . . . . 0.0 109.674 -178.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 62' ' ' MET . 50.9 mt-10 -59.37 -56.74 18.15 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.309 -0.87 . . . . 0.0 109.175 179.104 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 17.1 tp10 -58.3 -38.38 76.94 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.27 -0.894 . . . . 0.0 109.675 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.422 ' CG ' HH11 ' A' ' 66' ' ' ARG . 0.0 OUTLIER -53.51 -51.8 61.64 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.361 -0.837 . . . . 0.0 109.915 -179.767 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.633 ' C ' HD12 ' A' ' 67' ' ' LEU . 0.6 OUTLIER -79.68 -27.34 40.78 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.228 -0.92 . . . . 0.0 110.037 -179.149 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -62.05 -39.27 91.8 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.98 -1.075 . . . . 0.0 109.883 -179.347 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . 0.412 ' SD ' ' CZ ' ' A' ' 42' ' ' PHE . 17.8 ttm -86.11 -33.02 21.02 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.05 -1.031 . . . . 0.0 109.859 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 66.4 ttt180 -65.07 -30.33 71.28 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 120.593 -1.317 . . . . 0.0 109.363 179.17 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 67.0 mt-10 -77.81 -48.18 17.14 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.205 -0.934 . . . . 0.0 109.975 -179.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.519 ' CD2' ' OD1' ' A' ' 76' ' ' ASN . 29.4 t60 -59.63 -35.15 73.81 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.16 -0.962 . . . . 0.0 110.007 -179.488 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 69.6 t -74.47 -54.17 15.27 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 120.708 -1.245 . . . . 0.0 109.381 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.486 ' SD ' ' OD2' ' A' ' 78' ' ' ASP . 2.7 mmt -58.78 -22.41 58.15 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.087 -1.008 . . . . 0.0 109.298 179.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 22.8 ttpt -94.4 -27.66 15.93 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.801 -1.187 . . . . 0.0 110.759 -179.237 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.519 ' OD1' ' CD2' ' A' ' 72' ' ' HIS . 12.9 m120 -105.95 -12.1 15.94 Favored 'General case' 0 N--CA 1.506 2.349 0 O-C-N 121.159 -0.963 . . . . 0.0 112.643 -177.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 57.3 t -118.13 -34.86 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.533 0 O-C-N 120.372 -1.455 . . . . 0.0 111.397 -178.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.486 ' OD2' ' SD ' ' A' ' 74' ' ' MET . 0.9 OUTLIER -67.15 99.48 0.68 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.241 -1.537 . . . . 0.0 107.574 178.929 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.417 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -80.77 -52.25 7.73 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.213 -0.93 . . . . 0.0 111.891 -177.476 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.529 ' O ' ' N ' ' A' ' 82' ' ' ASP . 9.5 t-20 -99.63 24.1 8.69 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.061 -1.024 . . . . 0.0 109.532 -179.406 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.443 ' C ' ' H ' ' A' ' 83' ' ' ARG . 0.9 OUTLIER 32.95 30.51 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.754 0 CA-C-O 120.985 0.421 . . . . 0.0 112.062 178.697 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.545 ' C ' ' H ' ' A' ' 84' ' ' LEU . 87.0 m-20 -81.03 10.6 4.95 Favored 'General case' 0 C--N 1.299 -1.613 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 178.406 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.443 ' H ' ' C ' ' A' ' 81' ' ' GLN . 25.3 mtp180 65.12 -4.03 0.55 Allowed 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 -178.391 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.545 ' H ' ' C ' ' A' ' 82' ' ' ASP . 4.6 mp -118.48 134.47 55.05 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 178.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 88.9 t -112.3 129.39 67.91 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.076 0 O-C-N 121.617 -0.677 . . . . 0.0 109.541 -178.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 22.0 p -103.36 167.22 9.95 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.262 -0.898 . . . . 0.0 108.722 178.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.726 ' C ' HD13 ' A' ' 87' ' ' LEU . 1.2 tm? -65.15 -35.47 81.21 Favored 'General case' 0 C--N 1.297 -1.705 0 O-C-N 121.383 -0.823 . . . . 0.0 108.782 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -61.75 -70.06 0.21 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.946 -1.096 . . . . 0.0 112.811 -178.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.417 ' CB ' HG21 ' A' ' 79' ' ' THR . 1.7 mt-10 -59.37 -32.66 70.33 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.773 -1.204 . . . . 0.0 110.914 -177.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -58.83 -50.92 72.16 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 120.92 -1.113 . . . . 0.0 109.901 -179.366 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.434 ' O ' ' N ' ' A' ' 95' ' ' GLN . 78.7 mt -52.78 -48.94 66.49 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 120.924 -1.11 . . . . 0.0 109.602 179.472 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -46.66 -44.69 18.7 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.27 -0.894 . . . . 0.0 110.077 -179.52 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 46.5 m -62.41 -30.66 71.38 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.279 -0.888 . . . . 0.0 110.266 -179.309 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 44.6 p -95.94 -57.6 2.32 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.018 -1.051 . . . . 0.0 109.081 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.434 ' N ' ' O ' ' A' ' 91' ' ' LEU . 27.7 mt-30 -50.99 118.17 3.01 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.176 -0.953 . . . . 0.0 109.187 179.6 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -169.21 55.39 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.197 -0.939 . . . . 0.0 109.138 -179.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 87.3 mttt 52.61 40.53 30.23 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.291 -0.881 . . . . 0.0 109.343 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 54.18 59.95 3.89 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.259 -0.9 . . . . 0.0 109.335 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.445 ' CD2' ' O ' ' A' ' 99' ' ' PHE . 61.5 t80 . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 117.979 -1.01 . . . . 0.0 109.534 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.576 ' N ' HD12 ' A' ' 1' ' ' LEU . 9.4 mp . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -80.67 83.48 6.43 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.194 -0.942 . . . . 0.0 109.472 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.443 ' CD ' ' N ' ' A' ' 3' ' ' GLU . 5.9 mp0 -64.37 -166.16 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.251 -0.906 . . . . 0.0 109.471 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 37.1 t -56.45 -34.72 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.164 -0.96 . . . . 0.0 109.425 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 66.5 m95 -60.7 163.63 5.37 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.319 -0.863 . . . . 0.0 109.484 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -168.42 96.24 0.4 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.163 -0.96 . . . . 0.0 109.454 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 53.0 -109.66 0.49 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.425 -0.797 . . . . 0.0 109.087 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.467 ' C ' ' H ' ' A' ' 10' ' ' GLY . 0.4 OUTLIER -153.39 36.49 0.47 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.247 -0.908 . . . . 0.0 109.488 179.783 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 65.6 -4.51 0.58 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.411 -0.806 . . . . 0.0 109.403 -179.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.467 ' H ' ' C ' ' A' ' 8' ' ' LEU . . . 59.73 60.13 9.28 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 179.789 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 17.1 mt -70.56 51.61 0.13 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.258 -1.142 . . . . 0.0 108.88 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.429 ' N ' ' O ' ' A' ' 10' ' ' GLY . 35.5 t0 -170.22 70.98 0.6 Allowed Pre-proline 0 N--CA 1.49 1.529 0 O-C-N 121.339 -0.851 . . . . 0.0 108.81 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.447 ' O ' ' N ' ' A' ' 15' ' ' ARG . 3.2 Cg_exo -57.23 -16.03 20.62 Favored 'Trans proline' 0 C--N 1.315 -1.189 0 C-N-CA 121.197 1.265 . . . . 0.0 110.241 -178.187 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.452 HD22 ' C ' ' A' ' 14' ' ' ASN . 0.3 OUTLIER -68.37 68.19 0.13 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.259 -0.901 . . . . 0.0 109.359 179.932 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.447 ' N ' ' O ' ' A' ' 13' ' ' PRO . 33.9 ptt180 -158.31 -158.73 0.74 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.346 -0.846 . . . . 0.0 109.404 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.404 ' O ' ' O ' ' A' ' 15' ' ' ARG . 83.4 m-85 -54.96 -172.29 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.245 -0.909 . . . . 0.0 109.636 -179.89 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.465 ' C ' HD22 ' A' ' 17' ' ' ASN . 0.4 OUTLIER 49.07 63.17 10.86 Favored Pre-proline 0 N--CA 1.49 1.569 0 O-C-N 121.33 -0.856 . . . . 0.0 110.059 -179.695 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -65.93 -21.92 56.44 Favored 'Trans proline' 0 C--N 1.319 -0.975 0 C-N-CA 121.588 1.525 . . . . 0.0 110.033 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 69.7 tttt -57.3 -35.85 70.35 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.216 -0.928 . . . . 0.0 110.887 -179.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 55.4 m -71.01 -41.24 71.15 Favored 'General case' 0 C--N 1.306 -1.303 0 O-C-N 120.785 -1.197 . . . . 0.0 110.272 -178.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.482 ' CD1' ' N ' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -56.37 -36.91 69.36 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.042 -1.036 . . . . 0.0 108.487 -179.835 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.482 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 36.4 t80 -67.15 -34.81 78.37 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.335 -0.853 . . . . 0.0 110.135 -179.614 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 96.1 mt -74.54 -61.18 1.8 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.241 0 O-C-N 120.731 -1.23 . . . . 0.0 109.39 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.3 tp -46.57 -37.57 8.24 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.066 -1.021 . . . . 0.0 110.811 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.408 ' ND1' ' N ' ' A' ' 25' ' ' HIS . 0.6 OUTLIER -75.99 -18.26 59.37 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.367 -1.458 . . . . 0.0 109.709 179.959 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -75.98 90.67 3.01 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.131 -0.981 . . . . 0.0 108.783 179.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.41 HD13 HG21 ' A' ' 27' ' ' ILE . 13.9 mt -71.23 -52.26 28.28 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 O-C-N 121.319 -0.863 . . . . 0.0 110.801 -178.64 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.54 ' N ' HD22 ' A' ' 28' ' ' ASN . 1.8 m120 -84.08 11.6 7.72 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 120.831 -1.168 . . . . 0.0 109.83 -179.83 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 10.0 t 43.88 43.76 5.41 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.222 -0.924 . . . . 0.0 110.373 178.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -87.35 -3.41 59.03 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.009 -1.057 . . . . 0.0 108.819 179.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.38 -0.34 75.42 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -142.42 161.5 19.2 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 O-C-N 121.196 -1.179 . . . . 0.0 108.783 178.621 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.6 mp -113.12 131.74 55.72 Favored 'General case' 0 N--CA 1.517 2.91 0 N-CA-C 107.764 -1.198 . . . . 0.0 107.764 177.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 39.8 p-10 -106.51 174.2 5.99 Favored 'General case' 0 N--CA 1.504 2.258 0 O-C-N 121.371 -0.831 . . . . 0.0 109.934 -179.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -59.63 -7.69 1.63 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.431 -0.793 . . . . 0.0 110.088 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.9 mm100 -85.29 -40.22 16.83 Favored 'General case' 0 C--N 1.297 -1.706 0 O-C-N 121.052 -1.03 . . . . 0.0 109.845 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -67.79 -33.03 74.01 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.157 -0.964 . . . . 0.0 109.56 -179.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.459 ' O ' ' CD2' ' A' ' 42' ' ' PHE . 1.4 mt -80.45 -38.48 29.95 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.958 -1.089 . . . . 0.0 109.38 179.192 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.49 ' OE1' ' N ' ' A' ' 39' ' ' GLU . 0.0 OUTLIER -59.76 -41.81 91.88 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.882 -1.137 . . . . 0.0 108.794 179.481 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.07 -29.21 61.76 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.236 -0.915 . . . . 0.0 111.142 -179.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.49 ' O ' HD23 ' A' ' 41' ' ' LEU . 0.8 OUTLIER -76.76 -26.63 54.75 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 120.896 -1.127 . . . . 0.0 110.819 -178.654 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.459 ' CD2' ' O ' ' A' ' 38' ' ' LEU . 28.9 m-85 -80.49 -49.19 11.71 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 120.42 -1.425 . . . . 0.0 108.929 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 53.5 m -64.04 -39.35 93.9 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.245 -0.909 . . . . 0.0 110.277 -179.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 28.2 ttpt -74.92 -47.58 28.98 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.199 -0.938 . . . . 0.0 111.404 -178.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 6.7 tm-20 -53.68 -28.86 36.01 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.719 -1.238 . . . . 0.0 109.849 -178.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 21.1 mt -78.13 -24.63 47.32 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.119 -0.988 . . . . 0.0 109.973 -179.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -78.09 -2.6 38.14 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 120.828 -1.17 . . . . 0.0 110.272 -179.087 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.507 ' CB ' ' NZ ' ' A' ' 48' ' ' LYS . 6.4 mtmp? -113.57 26.05 10.73 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.072 -1.018 . . . . 0.0 109.891 -179.519 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 57.3 t -149.14 -48.14 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 121.11 -0.994 . . . . 0.0 109.654 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.578 ' CZ ' ' SD ' ' A' ' 62' ' ' MET . 68.7 m-85 -83.48 -24.85 31.59 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.972 -1.08 . . . . 0.0 109.214 179.714 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 12.9 t70 63.05 69.19 0.87 Allowed Pre-proline 0 N--CA 1.502 2.141 0 O-C-N 121.36 -0.838 . . . . 0.0 109.969 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -60.27 178.29 0.45 Allowed 'Trans proline' 0 C--N 1.315 -1.204 0 C-N-CA 121.312 1.342 . . . . 0.0 109.565 179.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 16.2 mtmt -120.32 -91.46 0.56 Allowed 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.521 -0.737 . . . . 0.0 109.587 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.478 ' ND2' ' O ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -179.46 96.59 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.015 -1.053 . . . . 0.0 109.013 179.944 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -145.03 179.23 7.49 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.174 -0.954 . . . . 0.0 109.43 -179.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 64.5 mt-10 -53.36 -92.8 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.11 -0.994 . . . . 0.0 109.016 179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.567 ' C ' ' H ' ' A' ' 59' ' ' MET . 30.1 t70 -135.59 26.56 3.4 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.13 -0.981 . . . . 0.0 109.462 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -62.49 14.39 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.059 -1.025 . . . . 0.0 110.451 -179.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.567 ' H ' ' C ' ' A' ' 57' ' ' ASP . 0.0 OUTLIER -80.55 -4.71 55.01 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.755 -1.215 . . . . 0.0 108.129 179.256 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.4 ' O ' ' CG ' ' A' ' 63' ' ' GLU . 30.3 ttp180 -45.37 -39.16 6.56 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.629 -0.669 . . . . 0.0 109.673 179.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.582 ' C ' ' H ' ' A' ' 63' ' ' GLU . 63.2 mm-40 -61.27 167.12 3.34 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 120.688 -1.257 . . . . 0.0 108.73 179.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.578 ' SD ' ' CZ ' ' A' ' 50' ' ' TYR . 9.3 tpt 56.56 -10.9 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.319 -0.863 . . . . 0.0 111.282 179.456 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.582 ' H ' ' C ' ' A' ' 61' ' ' GLU . 15.8 pt-20 -60.87 2.97 0.09 Allowed 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.498 -1.376 . . . . 0.0 110.105 -179.705 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.484 ' H ' ' C ' ' A' ' 62' ' ' MET . 59.1 mt-10 -67.33 -44.12 79.89 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.035 -1.041 . . . . 0.0 110.506 -179.231 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.4 tp10 -69.54 -27.36 65.09 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.905 -1.122 . . . . 0.0 109.698 -179.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -53.8 -37.66 63.74 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.13 -0.981 . . . . 0.0 108.581 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 25.0 mt -79.45 -28.72 41.62 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.459 -0.776 . . . . 0.0 109.303 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 15.7 tpt180 -65.42 -37.24 86.36 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.211 -0.93 . . . . 0.0 109.677 -179.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 13.7 mtt -85.34 -37.93 19.36 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.922 -1.111 . . . . 0.0 109.677 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.536 ' CG ' HH11 ' A' ' 70' ' ' ARG . 0.0 OUTLIER -66.25 -51.88 53.17 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.022 -1.049 . . . . 0.0 110.393 -179.386 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -69.85 -51.55 32.43 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.152 -0.967 . . . . 0.0 110.934 -178.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.491 ' CE1' ' OD1' ' A' ' 76' ' ' ASN . 62.0 t-80 -55.73 -42.03 74.77 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.921 -1.112 . . . . 0.0 110.516 -178.792 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 77.4 t -73.05 -54.21 16.37 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 120.645 -1.285 . . . . 0.0 109.804 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.462 ' SD ' ' NH1' ' A' ' 70' ' ' ARG . 37.2 mtp -65.36 -19.67 66.05 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.971 -1.081 . . . . 0.0 110.264 -179.098 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 20.5 ttpp -94.79 -32.66 13.2 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.727 -1.233 . . . . 0.0 110.237 -179.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.491 ' OD1' ' CE1' ' A' ' 72' ' ' HIS . 6.3 m120 -100.57 -8.79 22.64 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.203 -0.936 . . . . 0.0 111.792 -178.464 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 85.5 t -117.13 -38.04 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.539 0 O-C-N 120.593 -1.317 . . . . 0.0 110.376 179.253 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.401 ' OD2' ' O ' ' A' ' 74' ' ' MET . 83.9 m-20 -49.47 112.38 0.63 Allowed 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.606 -1.309 . . . . 0.0 108.983 178.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.59 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -87.58 -59.24 2.3 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.284 -0.885 . . . . 0.0 110.41 -177.903 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.422 ' ND2' ' O ' ' A' ' 80' ' ' ASN . 1.1 t-20 -103.43 25.53 9.51 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.309 -0.869 . . . . 0.0 109.447 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.403 ' C ' ' O ' ' A' ' 80' ' ' ASN . 1.3 mm100 34.63 48.22 0.29 Allowed 'General case' 0 N--CA 1.494 1.752 0 CA-C-O 121.054 0.454 . . . . 0.0 112.146 178.363 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.578 ' C ' ' H ' ' A' ' 84' ' ' LEU . 12.8 p-10 -99.72 15.33 27.16 Favored 'General case' 0 N--CA 1.495 1.809 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 178.463 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.449 HH11 ' HG3' ' A' ' 83' ' ' ARG . 10.5 mtm-85 63.06 -2.83 0.38 Allowed 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 -178.345 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.578 ' H ' ' C ' ' A' ' 82' ' ' ASP . 4.8 mp -125.62 135.3 52.03 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 179.524 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 70.2 t -112.81 129.71 67.94 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.083 0 O-C-N 121.552 -0.718 . . . . 0.0 109.615 -178.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 68.8 p -98.1 163.01 12.93 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.225 -0.922 . . . . 0.0 109.13 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.733 ' C ' HD13 ' A' ' 87' ' ' LEU . 1.4 tm? -66.04 -38.61 88.81 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 179.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -59.38 -69.71 0.19 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.344 -0.848 . . . . 0.0 111.456 -179.607 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.59 ' CB ' HG21 ' A' ' 79' ' ' THR . 33.5 mm-40 -57.24 -30.07 64.31 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.101 -0.999 . . . . 0.0 110.36 -178.495 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -61.5 -51.22 69.56 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.024 -1.048 . . . . 0.0 110.076 -179.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.526 ' O ' ' N ' ' A' ' 95' ' ' GLN . 92.4 mt -52.81 -44.98 67.03 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.984 -1.073 . . . . 0.0 109.354 179.294 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -46.9 -49.68 20.0 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.185 -0.947 . . . . 0.0 109.911 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 41.9 m -60.5 -26.27 66.7 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.249 -0.907 . . . . 0.0 110.179 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.451 ' OG1' ' N ' ' A' ' 95' ' ' GLN . 26.4 p -102.37 -63.4 1.16 Allowed 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.213 -0.929 . . . . 0.0 110.047 -179.544 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.526 ' N ' ' O ' ' A' ' 91' ' ' LEU . 1.2 tp-100 -48.12 -60.42 2.65 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.154 -0.966 . . . . 0.0 109.897 -179.482 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.564 ' CG ' HH11 ' A' ' 96' ' ' ARG . 0.0 OUTLIER -48.79 -35.73 15.06 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.868 -1.145 . . . . 0.0 110.03 -179.402 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -54.29 -19.93 6.22 Favored 'General case' 0 N--CA 1.484 1.266 0 O-C-N 120.868 -1.145 . . . . 0.0 109.851 -179.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 53.9 tt0 -72.79 77.1 1.13 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.245 -0.909 . . . . 0.0 109.407 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 55.6 t80 . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 118.012 -0.994 . . . . 0.0 109.472 179.953 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.542 ' N ' HD12 ' A' ' 1' ' ' LEU . 9.7 mp . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp 54.22 63.64 2.1 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.429 -0.794 . . . . 0.0 109.663 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.51 ' OE2' ' CH2' ' A' ' 5' ' ' TRP . 6.8 pt-20 -70.94 70.16 0.49 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.386 -0.821 . . . . 0.0 109.065 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 58.8 t -71.92 102.09 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.339 -0.851 . . . . 0.0 109.878 -179.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.51 ' CH2' ' OE2' ' A' ' 3' ' ' GLU . 8.2 m0 -90.96 92.22 8.66 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.187 -0.945 . . . . 0.0 109.578 179.628 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 55.67 87.38 0.05 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.316 -0.865 . . . . 0.0 110.147 179.453 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.404 ' O ' ' O ' ' A' ' 8' ' ' LEU . 72.8 mt-10 52.82 175.48 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.451 -0.781 . . . . 0.0 109.892 179.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.404 ' O ' ' O ' ' A' ' 7' ' ' GLU . 24.0 mt 60.39 157.61 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.065 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 -179.357 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -73.78 -25.99 60.42 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.78 -1.2 . . . . 0.0 109.312 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 177.7 -73.81 0.07 OUTLIER Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.817 -1.313 . . . . 0.0 109.817 179.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 31.7 mt -132.43 109.02 9.53 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.538 -0.978 . . . . 0.0 109.868 -179.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.445 ' OD1' ' N ' ' A' ' 12' ' ' ASP . 19.9 p-10 -90.59 147.45 36.39 Favored Pre-proline 0 N--CA 1.493 1.711 0 O-C-N 121.288 -0.882 . . . . 0.0 108.678 179.249 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.474 ' C ' ' H ' ' A' ' 15' ' ' ARG . 4.9 Cg_endo -61.38 -29.13 85.06 Favored 'Trans proline' 0 N--CA 1.48 0.68 0 C-N-CA 121.349 1.366 . . . . 0.0 110.593 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -71.55 32.57 0.05 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.967 -1.083 . . . . 0.0 110.218 -179.037 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.474 ' H ' ' C ' ' A' ' 13' ' ' PRO . 3.2 ptm180 -59.91 174.99 0.42 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.07 -1.019 . . . . 0.0 109.054 179.587 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 51.8 p90 -170.44 142.23 2.09 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.07 -1.019 . . . . 0.0 109.843 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -170.07 65.24 0.5 Allowed Pre-proline 0 N--CA 1.489 1.52 0 O-C-N 121.277 -0.889 . . . . 0.0 109.954 179.708 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -65.35 -22.44 59.94 Favored 'Trans proline' 0 C--N 1.319 -1.009 0 C-N-CA 121.509 1.473 . . . . 0.0 109.698 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -56.24 -36.07 68.09 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.352 -0.842 . . . . 0.0 110.991 -179.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 69.9 m -73.17 -41.64 63.65 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 120.687 -1.258 . . . . 0.0 110.617 -178.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -56.39 -35.02 67.27 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.919 -1.113 . . . . 0.0 108.184 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -69.25 -34.96 75.6 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.323 -0.861 . . . . 0.0 109.836 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.485 ' O ' ' N ' ' A' ' 26' ' ' ASP . 96.9 mt -69.89 -59.69 3.25 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.157 0 O-C-N 120.798 -1.189 . . . . 0.0 109.006 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 tp -44.49 -36.39 2.92 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.353 -0.842 . . . . 0.0 110.735 -179.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.509 ' ND1' ' N ' ' A' ' 25' ' ' HIS . 0.3 OUTLIER -80.57 -14.19 58.42 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 120.391 -1.443 . . . . 0.0 109.536 179.758 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.485 ' N ' ' O ' ' A' ' 23' ' ' ILE . 82.1 m-20 -78.34 93.29 4.65 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.174 -0.954 . . . . 0.0 109.236 179.598 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 75.5 mt -77.3 -51.8 17.78 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.437 0 O-C-N 121.407 -0.808 . . . . 0.0 110.65 -178.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.714 ' H ' ' ND2' ' A' ' 28' ' ' ASN . 0.0 OUTLIER -88.18 -3.12 58.92 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.917 -1.115 . . . . 0.0 110.234 -179.41 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.488 ' N ' HD22 ' A' ' 28' ' ' ASN . 4.5 t 52.86 57.83 5.96 Favored 'General case' 0 C--N 1.295 -1.796 0 O-C-N 121.263 -0.898 . . . . 0.0 110.402 179.111 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -99.9 7.17 45.08 Favored 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 72.88 5.47 64.93 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.876 -1.29 . . . . 0.0 109.876 -179.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -144.18 164.85 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.985 0 O-C-N 121.196 -1.179 . . . . 0.0 108.565 177.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 tp -112.81 128.6 56.48 Favored 'General case' 0 N--CA 1.512 2.643 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 178.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 40.0 p-10 -104.91 163.04 12.82 Favored 'General case' 0 N--CA 1.504 2.265 0 CA-C-O 121.896 0.855 . . . . 0.0 110.606 -178.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.596 ' CD ' ' H ' ' A' ' 35' ' ' GLU . 1.7 mp0 -57.73 -8.95 1.03 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.911 -0.493 . . . . 0.0 111.069 -179.216 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -85.12 -36.64 20.98 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.765 -1.209 . . . . 0.0 109.548 -179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 -81.12 -34.9 32.22 Favored 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 179.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 5.4 tp -72.75 -42.02 64.51 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.614 -0.679 . . . . 0.0 110.029 179.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -71.85 -34.03 68.93 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.553 -1.342 . . . . 0.0 108.892 179.401 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.3 -28.63 62.2 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.256 -0.902 . . . . 0.0 110.285 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.428 ' O ' HD23 ' A' ' 41' ' ' LEU . 0.7 OUTLIER -70.63 -31.2 68.07 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.913 -1.117 . . . . 0.0 109.855 -179.111 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -77.8 -47.98 17.63 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 120.509 -1.37 . . . . 0.0 109.812 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 54.3 m -57.45 -44.24 84.62 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.069 -1.02 . . . . 0.0 111.321 -178.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.8 mtmt -74.46 -47.9 30.66 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.894 -1.129 . . . . 0.0 111.959 -177.658 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -57.55 -27.9 63.05 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 120.459 -1.401 . . . . 0.0 110.069 -178.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.455 ' C ' ' H ' ' A' ' 48' ' ' LYS . 24.1 mt -70.14 -25.68 63.59 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 120.849 -1.157 . . . . 0.0 109.646 -179.731 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.408 ' OE2' ' O ' ' A' ' 47' ' ' GLU . 0.1 OUTLIER -65.31 3.76 0.61 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.042 -1.036 . . . . 0.0 109.67 -179.845 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.455 ' H ' ' C ' ' A' ' 46' ' ' LEU . 7.7 mtmp? -106.86 -1.95 21.88 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.239 -0.913 . . . . 0.0 109.673 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 61.7 t -114.88 -59.15 3.28 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 121.535 -0.728 . . . . 0.0 109.641 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -83.5 -159.77 0.38 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.107 -0.996 . . . . 0.0 109.376 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.407 ' O ' ' OD1' ' A' ' 51' ' ' ASP . 18.5 p30 -147.23 66.22 10.03 Favored Pre-proline 0 N--CA 1.494 1.772 0 O-C-N 121.262 -0.899 . . . . 0.0 109.414 179.824 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -64.53 174.4 4.42 Favored 'Trans proline' 0 C--N 1.318 -1.04 0 C-N-CA 121.55 1.5 . . . . 0.0 109.762 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.454 ' C ' ' H ' ' A' ' 55' ' ' GLU . 23.0 mtmt -97.58 51.79 1.08 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.305 -0.872 . . . . 0.0 109.026 179.51 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.512 ' ND2' ' O ' ' A' ' 54' ' ' ASN . 0.4 OUTLIER 57.76 5.28 0.33 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.367 -0.833 . . . . 0.0 109.51 -179.756 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.454 ' H ' ' C ' ' A' ' 53' ' ' LYS . 69.9 mm-40 -140.38 129.35 23.38 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.343 -0.848 . . . . 0.0 109.223 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.444 ' CG ' HH22 ' A' ' 66' ' ' ARG . 2.4 mp0 -66.4 95.82 0.33 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.144 -0.972 . . . . 0.0 109.369 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -170.65 46.53 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.19 -0.944 . . . . 0.0 109.457 179.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -171.6 -0.39 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.272 -0.893 . . . . 0.0 109.386 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 58.6 mtp -98.64 3.56 47.87 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.105 -0.997 . . . . 0.0 109.018 179.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.57 ' O ' ' N ' ' A' ' 62' ' ' MET . 68.6 ttt180 -45.16 -54.91 6.28 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.432 -0.792 . . . . 0.0 109.729 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.598 ' CD ' ' H ' ' A' ' 61' ' ' GLU . 16.8 mp0 -43.45 -12.78 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.442 -0.786 . . . . 0.0 111.368 -178.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.57 ' N ' ' O ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -134.99 5.59 3.33 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 120.871 -1.143 . . . . 0.0 109.811 -179.909 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.3 mt-10 -47.85 -12.1 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.295 -0.878 . . . . 0.0 109.116 179.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.527 ' N ' ' O ' ' A' ' 62' ' ' MET . 13.3 mp0 -63.17 -28.92 70.38 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.214 -0.929 . . . . 0.0 110.035 -179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -69.56 -49.09 57.56 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.012 -1.055 . . . . 0.0 109.815 -179.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.444 HH22 ' CG ' ' A' ' 56' ' ' GLU . 47.8 mtt180 -48.27 -38.35 18.51 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.366 -0.834 . . . . 0.0 109.753 -179.292 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.901 HD12 ' O ' ' A' ' 67' ' ' LEU . 0.0 OUTLIER -82.68 -33.09 27.78 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.024 -1.048 . . . . 0.0 109.832 -178.936 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 4.4 tpp180 -63.8 -38.82 92.53 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.111 -0.993 . . . . 0.0 110.009 -179.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 4.0 mtt -83.65 -51.12 7.55 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.068 -1.02 . . . . 0.0 109.272 179.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 29.1 ttp180 -51.07 -41.05 59.67 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.842 -1.161 . . . . 0.0 109.79 179.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -74.91 -52.52 11.05 Favored 'General case' 0 C--N 1.305 -1.343 0 O-C-N 120.841 -1.162 . . . . 0.0 111.166 -178.276 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.457 ' CD2' ' OD1' ' A' ' 76' ' ' ASN . 23.5 t60 -55.95 -36.85 68.24 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.92 -1.112 . . . . 0.0 110.059 -179.587 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 78.9 t -75.56 -55.32 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 120.68 -1.263 . . . . 0.0 109.798 -179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 35.7 mtp -62.48 -18.06 61.01 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.304 -0.872 . . . . 0.0 109.889 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 43.3 tttp -94.01 -37.66 11.55 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.656 -1.277 . . . . 0.0 109.929 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.457 ' OD1' ' CD2' ' A' ' 72' ' ' HIS . 11.9 m120 -98.23 -11.05 23.09 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.146 -0.971 . . . . 0.0 112.05 -178.15 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 64.5 t -111.26 -35.76 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.559 0 O-C-N 120.458 -1.401 . . . . 0.0 109.911 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -57.88 109.46 0.73 Allowed 'General case' 0 N--CA 1.496 1.855 0 O-C-N 120.477 -1.39 . . . . 0.0 108.123 177.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.543 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -85.06 -55.15 4.2 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.173 -0.955 . . . . 0.0 111.102 -178.158 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.527 ' O ' ' N ' ' A' ' 82' ' ' ASP . 23.9 m120 -101.95 25.15 9.02 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.231 -0.918 . . . . 0.0 109.687 -179.442 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.419 ' C ' ' H ' ' A' ' 83' ' ' ARG . 0.6 OUTLIER 33.83 29.37 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 178.609 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.527 ' N ' ' O ' ' A' ' 80' ' ' ASN . 19.8 p-10 -81.36 9.98 6.36 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 178.428 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.454 HH11 ' HG3' ' A' ' 83' ' ' ARG . 8.4 mtm-85 66.86 -5.43 0.66 Allowed 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 -178.731 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.523 ' H ' ' C ' ' A' ' 82' ' ' ASP . 13.6 mt -116.81 134.89 54.23 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 107.583 -1.265 . . . . 0.0 107.583 178.661 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 82.0 t -111.49 129.92 65.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.976 0 O-C-N 121.576 -0.703 . . . . 0.0 109.948 -178.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 31.9 p -105.53 159.87 15.61 Favored 'General case' 0 N--CA 1.5 2.063 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.6 tp -60.92 -36.78 80.18 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.382 -0.824 . . . . 0.0 109.223 179.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -60.18 -69.56 0.21 Allowed 'General case' 0 C--N 1.295 -1.788 0 O-C-N 121.254 -0.904 . . . . 0.0 111.495 -177.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.543 ' CB ' HG21 ' A' ' 79' ' ' THR . 14.3 mm-40 -60.42 -30.31 69.53 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.161 -0.962 . . . . 0.0 110.334 -178.396 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -64.91 -51.95 59.12 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 120.874 -1.142 . . . . 0.0 109.893 -179.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 57.3 mt -48.25 -44.87 33.78 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.142 -0.974 . . . . 0.0 109.294 179.651 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -54.69 -60.3 3.54 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.403 -0.811 . . . . 0.0 110.497 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 22.0 t -42.44 -35.17 0.97 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.445 -0.784 . . . . 0.0 111.349 -178.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 50.7 p -84.28 -51.06 7.3 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 120.671 -1.268 . . . . 0.0 108.767 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 44.5 mm-40 -53.02 126.03 19.2 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.008 -1.058 . . . . 0.0 108.71 179.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.431 ' O ' ' O ' ' A' ' 97' ' ' LYS . 0.7 OUTLIER -153.9 83.27 1.15 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.999 -1.063 . . . . 0.0 109.582 -179.508 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.431 ' O ' ' O ' ' A' ' 96' ' ' ARG . 21.5 ttpp 53.48 101.97 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.219 -0.926 . . . . 0.0 109.711 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -58.55 90.96 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.144 -0.972 . . . . 0.0 109.361 179.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.409 ' N ' ' O ' ' A' ' 97' ' ' LYS . 30.1 m-85 . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 117.938 -1.03 . . . . 0.0 109.399 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.575 ' N ' HD12 ' A' ' 1' ' ' LEU . 8.8 mp . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 59.7 tttm -63.29 -18.07 63.2 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.281 -0.887 . . . . 0.0 109.418 -179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -55.3 132.42 47.89 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.319 -0.863 . . . . 0.0 109.508 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 29.2 t -58.74 130.84 22.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.319 -0.863 . . . . 0.0 109.517 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 69.0 m95 -61.22 110.91 1.53 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.252 -0.905 . . . . 0.0 109.425 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -58.28 -175.49 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.273 -0.892 . . . . 0.0 109.281 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -168.61 72.7 0.09 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.24 -0.912 . . . . 0.0 109.412 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.0 tp -109.89 67.77 0.66 Allowed 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.566 -0.709 . . . . 0.0 109.14 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -82.75 -24.54 33.47 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.214 -0.929 . . . . 0.0 109.289 179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -167.85 -37.3 0.02 OUTLIER Glycine 0 N--CA 1.489 2.196 0 N-CA-C 109.286 -1.526 . . . . 0.0 109.286 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 53.3 tp -49.05 122.87 6.32 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.29 -1.124 . . . . 0.0 108.949 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -76.39 150.3 82.39 Favored Pre-proline 0 N--CA 1.491 1.576 0 O-C-N 121.23 -0.919 . . . . 0.0 109.07 -179.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_endo -61.44 -18.51 59.8 Favored 'Trans proline' 0 C--N 1.325 -0.678 0 C-N-CA 121.011 1.14 . . . . 0.0 110.093 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.512 ' OD1' ' CE2' ' A' ' 16' ' ' PHE . 23.8 t-20 -74.83 64.17 1.25 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 120.965 -1.084 . . . . 0.0 109.7 -179.703 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.584 HH11 ' CG ' ' A' ' 15' ' ' ARG . 0.3 OUTLIER -97.79 77.74 2.54 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.304 -0.872 . . . . 0.0 109.497 179.965 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.512 ' CE2' ' OD1' ' A' ' 14' ' ' ASN . 49.4 m-85 -58.36 145.52 37.84 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.165 -0.96 . . . . 0.0 109.304 179.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -171.57 68.09 0.45 Allowed Pre-proline 0 N--CA 1.492 1.633 0 O-C-N 121.303 -0.873 . . . . 0.0 109.678 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -63.95 -21.37 68.7 Favored 'Trans proline' 0 C--N 1.317 -1.081 0 C-N-CA 121.354 1.37 . . . . 0.0 109.862 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 55.8 tttp -55.41 -38.64 69.2 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.434 -0.791 . . . . 0.0 111.15 -179.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 49.4 m -70.78 -41.9 71.06 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 120.477 -1.389 . . . . 0.0 110.37 -178.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.514 ' CE2' ' NE2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -54.46 -44.88 72.93 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 179.761 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.421 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 20.9 t80 -57.67 -34.0 68.92 Favored 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.468 -0.77 . . . . 0.0 109.548 179.524 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.52 ' O ' ' N ' ' A' ' 25' ' ' HIS . 92.8 mt -72.41 -61.64 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 O-C-N 120.819 -1.175 . . . . 0.0 108.559 179.403 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.6 tp -45.48 -14.32 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.072 -1.018 . . . . 0.0 110.846 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.52 ' N ' ' O ' ' A' ' 23' ' ' ILE . 0.6 OUTLIER -104.21 -12.69 16.53 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 120.644 -1.285 . . . . 0.0 110.215 179.909 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.477 ' OD1' ' O ' ' A' ' 23' ' ' ILE . 33.7 p-10 -78.64 67.3 4.36 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.87 -1.144 . . . . 0.0 109.446 179.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 69.1 mt -50.53 -51.91 17.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 O-C-N 121.191 -0.943 . . . . 0.0 110.993 -179.3 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.527 ' ND2' ' O ' ' A' ' 28' ' ' ASN . 0.7 OUTLIER -89.38 12.44 16.28 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 120.721 -1.237 . . . . 0.0 110.128 -179.454 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.419 ' O ' ' OG ' ' A' ' 29' ' ' SER . 6.9 t 41.71 51.78 4.0 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.355 -0.841 . . . . 0.0 110.774 178.661 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -95.28 1.66 54.56 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.987 -1.071 . . . . 0.0 108.395 179.252 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 74.22 -0.17 54.69 Favored Glycine 0 N--CA 1.489 2.168 0 N-CA-C 109.453 -1.459 . . . . 0.0 109.453 -179.659 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -143.84 162.46 15.68 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 O-C-N 121.289 -1.124 . . . . 0.0 108.905 178.666 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 73.0 mt -107.94 110.76 22.58 Favored 'General case' 0 N--CA 1.513 2.715 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 177.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -86.17 -178.33 6.48 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.481 -0.762 . . . . 0.0 110.127 -179.2 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -73.3 -43.06 61.6 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.292 -0.88 . . . . 0.0 111.468 -178.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.503 ' NE2' ' C ' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -61.86 -24.57 67.0 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 120.36 -1.463 . . . . 0.0 108.589 -179.885 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 64.3 mt-10 -86.51 -32.42 20.76 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.375 -0.828 . . . . 0.0 109.069 179.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.0 tp -72.38 -34.96 68.33 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.343 -0.848 . . . . 0.0 109.554 179.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -74.71 -51.18 14.97 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.315 -0.866 . . . . 0.0 110.73 -179.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -64.24 -32.99 74.8 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.924 -1.11 . . . . 0.0 110.713 -178.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 39.0 tp -74.1 -31.01 62.62 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.85 -1.156 . . . . 0.0 109.942 -179.127 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -84.01 -50.71 7.75 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 120.46 -1.4 . . . . 0.0 109.823 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 43.1 m -64.99 -42.52 94.44 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.066 -1.022 . . . . 0.0 110.447 -179.155 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 22.7 ttpt -72.59 -45.42 59.24 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.185 -0.947 . . . . 0.0 111.514 -178.221 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.2 tm-20 -53.77 -40.53 66.31 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 120.503 -1.373 . . . . 0.0 110.573 -178.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 14.6 mt -53.61 -25.25 16.69 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.871 -1.143 . . . . 0.0 110.131 -179.392 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -60.23 -24.98 65.29 Favored 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.21 -0.931 . . . . 0.0 110.018 -179.135 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 83.6 mttt -99.74 41.38 1.16 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.172 -0.955 . . . . 0.0 110.181 -179.263 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 59.2 t -150.06 -59.33 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 121.04 -1.038 . . . . 0.0 109.526 179.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -88.99 -131.37 0.08 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.217 -0.927 . . . . 0.0 109.905 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.521 ' C ' ' H ' ' A' ' 53' ' ' LYS . 1.7 p-10 -142.68 111.57 5.8 Favored Pre-proline 0 N--CA 1.495 1.818 0 O-C-N 121.266 -0.896 . . . . 0.0 108.61 -179.275 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -69.95 42.92 0.37 Allowed 'Trans proline' 0 C--O 1.213 -0.774 0 N-CA-C 109.662 -0.938 . . . . 0.0 109.662 -179.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.521 ' H ' ' C ' ' A' ' 51' ' ' ASP . 55.3 mttt 72.78 9.44 5.54 Favored 'General case' 0 N--CA 1.501 2.086 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.566 179.126 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -86.55 -15.21 40.66 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.021 -1.049 . . . . 0.0 108.817 179.117 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -157.89 132.82 8.59 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.364 -0.835 . . . . 0.0 109.467 179.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 49.42 -170.63 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.192 -0.943 . . . . 0.0 109.425 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -145.88 112.75 6.03 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.198 -0.939 . . . . 0.0 108.576 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -160.5 4.24 0.07 Allowed 'General case' 0 C--N 1.302 -1.5 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 179.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.519 ' O ' ' SD ' ' A' ' 62' ' ' MET . 0.5 OUTLIER -84.48 -11.66 55.73 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.531 -0.731 . . . . 0.0 109.046 -179.887 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.541 ' O ' ' N ' ' A' ' 62' ' ' MET . 26.3 ttm180 -97.29 -58.67 1.96 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.176 -0.953 . . . . 0.0 109.247 179.635 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.595 ' CD ' ' H ' ' A' ' 61' ' ' GLU . 24.9 mp0 -36.92 -23.53 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.689 -0.632 . . . . 0.0 112.092 -178.484 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.568 ' O ' ' N ' ' A' ' 64' ' ' GLU . 0.1 OUTLIER -109.02 4.13 22.85 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 120.971 -1.081 . . . . 0.0 110.605 -179.646 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.42 ' N ' ' SD ' ' A' ' 62' ' ' MET . 15.9 pt-20 -39.19 -23.01 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.109 0 CA-C-O 121.405 0.621 . . . . 0.0 110.154 -179.39 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.568 ' N ' ' O ' ' A' ' 62' ' ' MET . 31.3 mm-40 -67.01 -24.02 65.98 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.506 -0.747 . . . . 0.0 109.589 179.305 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -69.0 -28.0 66.2 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.255 -0.903 . . . . 0.0 110.102 -179.242 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 25.0 mtm180 -60.44 -47.99 83.7 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.172 -0.955 . . . . 0.0 109.219 -179.632 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.636 ' C ' HD12 ' A' ' 67' ' ' LEU . 0.7 OUTLIER -74.5 -27.62 60.63 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.276 -0.89 . . . . 0.0 110.075 -179.518 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.475 ' O ' ' NE ' ' A' ' 68' ' ' ARG . 8.7 tpm_? -65.71 -37.96 87.87 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.841 -1.162 . . . . 0.0 109.37 -179.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.6 mtt -84.16 -50.69 7.68 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.224 -0.922 . . . . 0.0 109.131 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.496 ' HG2' HH11 ' A' ' 70' ' ' ARG . 7.1 ttt-85 -52.14 -32.75 37.08 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.979 -1.076 . . . . 0.0 110.02 179.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 -86.42 -53.48 4.97 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 120.921 -1.112 . . . . 0.0 110.814 -178.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 11.2 t-80 -54.88 -34.6 63.17 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.911 -1.118 . . . . 0.0 110.006 -179.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.41 ' HA ' HD21 ' A' ' 76' ' ' ASN . 54.6 t -74.52 -53.88 15.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 120.672 -1.267 . . . . 0.0 109.738 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.452 ' SD ' ' NH1' ' A' ' 70' ' ' ARG . 29.8 mtp -65.41 -15.67 62.84 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.065 -1.022 . . . . 0.0 110.225 -179.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 42.4 tttp -85.23 -37.98 19.46 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.453 -1.404 . . . . 0.0 110.526 -179.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.671 HD22 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -105.18 -24.3 12.77 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 121.123 -0.985 . . . . 0.0 112.558 -178.027 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.671 ' H ' HD22 ' A' ' 76' ' ' ASN . 34.1 t -91.18 -36.75 8.39 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.422 0 O-C-N 120.235 -1.541 . . . . 0.0 110.032 -179.362 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 81.4 m-20 -66.7 105.06 1.45 Allowed 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.411 -1.431 . . . . 0.0 107.606 178.098 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.41 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.1 OUTLIER -83.5 -53.49 5.65 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.327 -0.858 . . . . 0.0 111.587 -177.733 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.471 ' O ' ' N ' ' A' ' 82' ' ' ASP . 6.2 m120 -98.59 23.91 8.08 Favored 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.15 -0.968 . . . . 0.0 109.46 -179.345 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.429 ' C ' ' O ' ' A' ' 80' ' ' ASN . 1.3 mm100 31.37 35.07 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 178.786 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.548 ' C ' ' H ' ' A' ' 84' ' ' LEU . 81.3 m-20 -84.99 12.54 7.38 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 178.532 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.531 HH11 ' CG ' ' A' ' 83' ' ' ARG . 3.9 mtt-85 65.03 -4.13 0.53 Allowed 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 -178.485 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.548 ' H ' ' C ' ' A' ' 82' ' ' ASP . 5.6 mp -119.31 133.9 55.49 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 107.031 -1.47 . . . . 0.0 107.031 179.157 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 92.9 t -112.85 129.54 68.29 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 O-C-N 121.643 -0.66 . . . . 0.0 110.143 -178.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 25.6 p -102.02 174.8 5.77 Favored 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 178.161 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -75.07 -32.8 61.57 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.999 -1.063 . . . . 0.0 109.192 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -64.05 -66.51 0.53 Allowed 'General case' 0 C--N 1.294 -1.818 0 O-C-N 120.922 -1.111 . . . . 0.0 111.514 -178.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.423 ' HG2' ' H ' ' A' ' 89' ' ' GLU . 4.2 mm-40 -59.27 -33.64 71.3 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.909 -1.12 . . . . 0.0 110.435 -177.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -66.29 -50.84 62.31 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 120.736 -1.228 . . . . 0.0 109.404 179.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 1.9 mp -46.74 -46.39 20.33 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.308 -0.87 . . . . 0.0 108.853 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -52.93 -58.31 7.37 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.221 -0.925 . . . . 0.0 110.277 -179.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 25.4 m -44.31 -27.47 0.43 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.239 -0.913 . . . . 0.0 109.952 -179.402 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 31.8 p -100.02 -57.97 2.02 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.314 -0.866 . . . . 0.0 108.741 179.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -46.49 121.89 3.75 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.268 -0.895 . . . . 0.0 109.58 179.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 14.0 tpt180 -170.99 65.11 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.216 -0.927 . . . . 0.0 109.546 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -45.15 110.03 0.21 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.341 -0.85 . . . . 0.0 110.003 -179.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -79.02 75.21 5.54 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.204 -0.935 . . . . 0.0 109.556 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 64.3 t80 . . . . . 0 N--CA 1.494 1.75 0 CA-C-O 117.998 -1.001 . . . . 0.0 109.335 -179.936 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 21.2 mt . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.535 ' O ' ' N ' ' A' ' 4' ' ' VAL . 55.8 mttp -140.92 81.89 1.81 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.274 -0.891 . . . . 0.0 109.174 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 62.25 -72.12 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.57 -0.706 . . . . 0.0 109.655 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.535 ' N ' ' O ' ' A' ' 2' ' ' LYS . 23.5 t -49.36 125.14 2.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.244 -0.91 . . . . 0.0 109.563 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . . . . . . . . . 12.4 m-90 -74.97 -126.62 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.169 -0.957 . . . . 0.0 109.439 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -167.52 -75.54 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.149 -0.969 . . . . 0.0 109.647 -179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.405 ' CG ' ' N ' ' A' ' 8' ' ' LEU . 30.4 tt0 -169.68 165.32 10.09 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.2 -0.937 . . . . 0.0 109.354 -179.797 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.474 ' O ' ' N ' ' A' ' 10' ' ' GLY . 0.2 OUTLIER -144.28 101.71 3.74 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.204 -0.935 . . . . 0.0 109.134 179.787 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -63.18 77.37 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.311 -0.868 . . . . 0.0 109.604 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.474 ' N ' ' O ' ' A' ' 8' ' ' LEU . . . -151.24 38.11 0.84 Allowed Glycine 0 N--CA 1.494 2.505 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.602 HD22 ' N ' ' A' ' 11' ' ' LEU . 3.4 mm? 51.07 96.94 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.316 -1.108 . . . . 0.0 109.236 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -53.94 148.92 19.18 Favored Pre-proline 0 N--CA 1.49 1.55 0 O-C-N 121.208 -0.932 . . . . 0.0 108.963 -179.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -60.55 -46.28 18.1 Favored 'Trans proline' 0 C--N 1.323 -0.78 0 C-N-CA 120.961 1.107 . . . . 0.0 109.774 179.614 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 17.5 t-20 -149.11 -54.34 0.18 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.084 -1.01 . . . . 0.0 109.536 -179.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.436 HH11 ' HG3' ' A' ' 15' ' ' ARG . 3.4 ptm180 -49.15 134.04 18.18 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.236 -0.915 . . . . 0.0 109.587 -179.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.492 ' C ' ' ND2' ' A' ' 17' ' ' ASN . 35.9 t80 -82.17 -120.86 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.346 -0.847 . . . . 0.0 109.307 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.492 ' ND2' ' C ' ' A' ' 16' ' ' PHE . 2.3 m-80 -146.38 69.11 12.57 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.172 -0.955 . . . . 0.0 109.259 -179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -62.96 -20.49 71.66 Favored 'Trans proline' 0 C--N 1.319 -1.001 0 C-N-CA 121.545 1.496 . . . . 0.0 110.269 -179.415 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -55.81 -36.64 67.66 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.312 -0.868 . . . . 0.0 111.135 -179.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 58.4 m -74.04 -43.27 58.46 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 120.679 -1.263 . . . . 0.0 110.562 -178.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.502 ' CE2' ' CD2' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -54.85 -33.97 62.37 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 179.909 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -69.76 -34.52 73.9 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.422 -0.799 . . . . 0.0 109.816 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 97.4 mt -71.87 -60.68 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 O-C-N 120.832 -1.167 . . . . 0.0 108.907 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 tp -46.01 -37.93 7.2 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.313 -0.867 . . . . 0.0 111.048 -179.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.502 ' CD2' ' CE2' ' A' ' 21' ' ' PHE . 0.3 OUTLIER -79.17 -15.11 58.57 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.433 -1.417 . . . . 0.0 110.082 -179.526 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -79.84 96.27 6.28 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.02 -1.05 . . . . 0.0 108.717 179.347 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 48.3 mt -74.55 -51.98 21.06 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 O-C-N 121.455 -0.778 . . . . 0.0 110.736 -178.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.555 ' N ' HD22 ' A' ' 28' ' ' ASN . 1.8 m120 -86.78 8.57 22.16 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 120.787 -1.195 . . . . 0.0 109.948 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.443 ' O ' ' OG ' ' A' ' 29' ' ' SER . 5.2 t 44.32 57.47 4.31 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.166 -0.959 . . . . 0.0 110.496 178.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -100.31 0.2 39.66 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.079 -1.013 . . . . 0.0 108.654 179.461 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 78.67 -2.51 67.71 Favored Glycine 0 N--CA 1.489 2.209 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -144.31 160.22 15.21 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.052 -1.263 . . . . 0.0 108.621 178.052 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 17.6 mt -110.89 128.96 55.98 Favored 'General case' 0 N--CA 1.512 2.626 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.448 ' C ' ' H ' ' A' ' 36' ' ' GLN . 24.6 p-10 -105.12 166.83 10.12 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.504 -0.748 . . . . 0.0 109.643 -179.544 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -52.27 -6.34 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.578 -0.701 . . . . 0.0 110.79 -179.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.448 ' H ' ' C ' ' A' ' 34' ' ' ASP . 2.3 mm100 -85.77 -42.66 14.0 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 120.807 -1.183 . . . . 0.0 109.862 -179.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -80.71 -31.18 36.23 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 6.0 tp -76.37 -36.82 57.95 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.43 -0.794 . . . . 0.0 109.281 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -74.62 -51.35 14.73 Favored 'General case' 0 N--CA 1.484 1.275 0 O-C-N 120.935 -1.103 . . . . 0.0 109.429 179.385 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -61.21 -29.53 69.87 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.325 -0.859 . . . . 0.0 110.33 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 41.6 tp -76.71 -27.7 55.57 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.167 -0.958 . . . . 0.0 110.542 -178.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -82.88 -40.06 20.75 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 120.354 -1.466 . . . . 0.0 110.006 -179.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 17.7 m -69.94 -55.16 10.38 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.78 -1.2 . . . . 0.0 109.842 -179.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.4 -45.39 93.74 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.303 -0.873 . . . . 0.0 111.059 -178.401 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -60.31 -27.82 67.62 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.429 -1.419 . . . . 0.0 109.795 -179.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.488 ' C ' ' H ' ' A' ' 48' ' ' LYS . 11.6 tp -68.93 -23.49 64.17 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.132 -0.98 . . . . 0.0 108.644 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -61.58 4.12 0.11 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.421 -0.799 . . . . 0.0 109.795 178.498 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.514 ' CB ' ' NZ ' ' A' ' 48' ' ' LYS . 7.8 mtmp? -108.91 172.42 6.86 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 179.086 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 3.8 t 66.34 -42.32 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.259 -0.901 . . . . 0.0 109.701 -179.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.465 ' H ' ' C ' ' A' ' 48' ' ' LYS . 44.7 m-85 -96.35 -167.01 1.5 Allowed 'General case' 0 N--CA 1.496 1.872 0 O-C-N 120.971 -1.08 . . . . 0.0 109.586 -179.849 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.514 ' C ' ' H ' ' A' ' 53' ' ' LYS . 5.3 p-10 -142.46 73.17 20.77 Favored Pre-proline 0 N--CA 1.498 1.936 0 O-C-N 121.404 -0.81 . . . . 0.0 109.188 -179.722 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -66.66 15.72 0.11 Allowed 'Trans proline' 0 C--N 1.318 -1.035 0 C-N-CA 121.709 1.606 . . . . 0.0 110.66 -179.354 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.514 ' H ' ' C ' ' A' ' 51' ' ' ASP . 30.3 mmtp -125.7 27.42 6.45 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.467 -0.77 . . . . 0.0 109.436 -179.838 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.414 ' ND2' ' O ' ' A' ' 54' ' ' ASN . 1.0 OUTLIER -171.68 36.96 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.157 -0.965 . . . . 0.0 109.797 179.942 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -156.3 134.19 11.13 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.05 -1.031 . . . . 0.0 109.449 -179.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 75.8 mt-10 -65.91 -174.08 0.21 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.309 -0.869 . . . . 0.0 109.595 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.642 ' O ' ' N ' ' A' ' 59' ' ' MET . 8.4 m-20 58.54 88.85 0.06 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.111 -0.993 . . . . 0.0 109.523 -179.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.532 ' O ' ' N ' ' A' ' 60' ' ' ARG . 16.6 p-10 -42.39 80.2 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.933 0 CA-C-O 121.322 0.582 . . . . 0.0 111.672 -178.669 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.642 ' N ' ' O ' ' A' ' 57' ' ' ASP . 70.6 mtp 45.69 14.8 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.441 -0.787 . . . . 0.0 109.852 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.532 ' N ' ' O ' ' A' ' 58' ' ' ASP . 49.4 ttt180 -52.63 -54.19 36.56 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 179.462 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.522 ' C ' ' H ' ' A' ' 63' ' ' GLU . 0.8 OUTLIER -57.18 165.66 1.32 Allowed 'General case' 0 C--N 1.3 -1.553 0 O-C-N 120.553 -1.342 . . . . 0.0 107.56 178.363 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.462 ' C ' ' N ' ' A' ' 64' ' ' GLU . 14.2 tpt 61.57 -13.12 0.05 Allowed 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.236 -0.915 . . . . 0.0 110.544 -179.858 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.522 ' H ' ' C ' ' A' ' 61' ' ' GLU . 13.8 pt-20 -54.31 -11.37 0.5 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.267 -1.52 . . . . 0.0 108.383 179.373 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.462 ' N ' ' C ' ' A' ' 62' ' ' MET . 63.3 mm-40 -71.42 -62.62 1.34 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.547 -0.72 . . . . 0.0 109.379 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.474 ' OE1' ' NE ' ' A' ' 68' ' ' ARG . 4.1 tp10 -44.57 -38.69 4.39 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.651 -0.656 . . . . 0.0 109.917 -179.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? -46.94 -35.98 7.14 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 179.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 33.4 mt -82.93 -26.54 31.32 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.527 -0.733 . . . . 0.0 109.619 179.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.474 ' NE ' ' OE1' ' A' ' 65' ' ' GLU . 1.3 tmm_? -65.9 -39.0 90.21 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.9 -1.125 . . . . 0.0 109.735 -179.304 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' MET . . . . . . . . . . . . . 5.7 mtt -84.97 -50.37 7.54 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.192 -0.943 . . . . 0.0 109.553 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.509 ' NH1' ' SD ' ' A' ' 74' ' ' MET . 11.0 ttt-85 -54.21 -27.85 37.07 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.759 -1.213 . . . . 0.0 110.21 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -84.27 -51.78 6.74 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 120.801 -1.187 . . . . 0.0 110.75 -179.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -54.28 -38.67 66.12 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.088 -1.007 . . . . 0.0 110.823 -179.472 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' VAL . . . . . 0.404 ' HA ' HD21 ' A' ' 76' ' ' ASN . 55.3 t -75.09 -54.49 14.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 O-C-N 120.343 -1.473 . . . . 0.0 110.117 -179.522 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.509 ' SD ' ' NH1' ' A' ' 70' ' ' ARG . 27.5 mtp -62.81 -14.11 41.56 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.227 -0.921 . . . . 0.0 110.291 -179.137 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 42.8 tttm -89.59 -39.45 13.25 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.641 -1.287 . . . . 0.0 110.842 -178.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.658 HD22 ' H ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -103.61 -27.58 12.24 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.126 -0.984 . . . . 0.0 112.279 -178.053 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.658 ' H ' HD22 ' A' ' 76' ' ' ASN . 21.6 t -85.21 -29.29 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.233 0 O-C-N 120.144 -1.598 . . . . 0.0 109.118 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.462 ' CG ' ' O ' ' A' ' 74' ' ' MET . 15.2 p-10 -63.28 106.17 0.85 Allowed 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.915 -1.115 . . . . 0.0 108.462 178.52 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . 0.502 HG21 ' CB ' ' A' ' 89' ' ' GLU . 0.0 OUTLIER -86.72 -53.49 4.91 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.107 -1.621 . . . . 0.0 110.73 -178.542 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.499 ' O ' ' N ' ' A' ' 82' ' ' ASP . 2.8 m120 -104.12 24.87 10.75 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.301 -0.874 . . . . 0.0 109.737 -179.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLN . . . . . 0.421 ' CA ' HE21 ' A' ' 81' ' ' GLN . 0.1 OUTLIER 34.31 30.14 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.862 0 O-C-N 122.041 -0.412 . . . . 0.0 111.932 178.362 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.552 ' C ' ' H ' ' A' ' 84' ' ' LEU . 18.5 p-10 -82.08 9.95 7.57 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.637 -1.29 . . . . 0.0 107.667 178.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.517 HH11 ' CG ' ' A' ' 83' ' ' ARG . 4.1 mtt-85 64.34 -4.31 0.43 Allowed 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 -178.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.552 ' H ' ' C ' ' A' ' 82' ' ' ASP . 6.6 mp -118.38 134.37 55.11 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 178.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 94.6 t -112.4 130.45 66.1 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.047 0 O-C-N 121.564 -0.71 . . . . 0.0 110.336 -178.359 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 16.9 p -105.93 166.41 10.5 Favored 'General case' 0 N--CA 1.499 1.999 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 178.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.9 tp -64.54 -36.63 84.84 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.273 -0.892 . . . . 0.0 109.344 179.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.536 ' H ' ' CD ' ' A' ' 88' ' ' GLU . 8.8 mp0 -61.49 -68.16 0.34 Allowed 'General case' 0 C--N 1.293 -1.874 0 O-C-N 120.751 -1.218 . . . . 0.0 111.806 -177.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.502 ' CB ' HG21 ' A' ' 79' ' ' THR . 1.0 OUTLIER -58.71 -33.66 70.44 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 120.738 -1.226 . . . . 0.0 110.479 -177.91 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 9.9 t80 -64.34 -51.39 63.6 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.865 -1.147 . . . . 0.0 108.821 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 2.7 mp -48.93 -42.71 38.13 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.415 ' HB3' ' O ' ' A' ' 89' ' ' GLU . . . -47.99 -61.38 2.0 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.257 -0.902 . . . . 0.0 109.701 179.616 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 95.1 p -48.04 -33.05 7.42 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.282 -0.886 . . . . 0.0 110.302 -179.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 14.2 p -98.96 14.63 28.43 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.212 -0.93 . . . . 0.0 109.483 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 4.6 mm100 -138.93 123.24 18.18 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 179.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.542 ' CG ' HH11 ' A' ' 96' ' ' ARG . 0.0 OUTLIER -171.04 -28.41 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.093 -1.005 . . . . 0.0 109.721 -179.786 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.7 pttt -179.09 162.82 1.26 Allowed 'General case' 0 C--N 1.307 -1.27 0 O-C-N 121.448 -0.782 . . . . 0.0 109.593 179.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.428 ' OE2' ' O ' ' A' ' 98' ' ' GLU . 0.4 OUTLIER -170.21 102.92 0.28 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.322 -0.862 . . . . 0.0 109.348 179.808 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 . . . . . 0 N--CA 1.491 1.575 0 CA-C-O 118.004 -0.998 . . . . 0.0 109.59 -179.813 . . . . . . . . 0 0 . 1 stop_ save_