data_5ghc_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 5ghc _Structure_validation_residue.Date_analyzed 2017-06-02 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' ' ' HIS . . . . . 0.511 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 43.7 p-80 . . . . . 0 N--CA 1.434 -1.248 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 40.5 pt -119.26 162.14 17.75 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.838 0 CA-C-O 121.634 0.73 . . . . 0.0 111.375 -176.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.498 ' HA ' ' O ' ' A' ' 32' ' ' PHE . 23.7 t-20 -100.11 132.88 45.21 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.27 178.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -122.6 134.56 54.51 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-O 121.102 0.477 . . . . 0.0 109.793 177.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 48.3 mtmt -117.39 144.41 44.99 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.627 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 90.5 t -124.86 134.98 65.48 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.705 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -177.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -117.08 130.11 56.43 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.171 0.51 . . . . 0.0 110.819 -178.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -101.69 178.32 27.32 Favored Glycine 0 N--CA 1.43 -1.71 0 C-N-CA 121.036 -0.602 . . . . 0.0 111.896 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.649 ' NE2' ' H ' ' A' ' 25' ' ' GLN . 0.5 OUTLIER -60.52 -31.74 70.8 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.76 0.791 . . . . 0.0 110.592 -179.002 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -71.33 -16.0 62.42 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.285 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.31 5.95 69.27 Favored Glycine 0 N--CA 1.446 -0.684 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 -175.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 9.2 t -80.84 126.45 31.36 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.627 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 28.3 t -120.42 138.84 49.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-O 121.272 0.558 . . . . 0.0 110.878 -178.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.8 t -122.12 136.85 57.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 177.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -104.74 143.82 32.58 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.742 0.306 . . . . 0.0 110.562 -179.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.498 ' O ' ' HA ' ' A' ' 19' ' ' ASN . 14.4 m-85 . . . . . 0 N--CA 1.47 0.543 0 CA-C-O 120.808 0.337 . . . . 0.0 110.702 -179.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 36.6 pt . . . . . 0 N--CA 1.465 0.284 0 CA-C-O 120.805 0.336 . . . . 0.0 111.007 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.511 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 0.0 OUTLIER -80.7 153.28 27.95 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 121.123 0.487 . . . . 0.0 110.641 178.456 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.5 ptt180 -63.43 -19.37 64.64 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.762 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 67.1 t60 -104.3 -3.55 24.07 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 122.161 0.981 . . . . 0.0 108.728 -176.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 m -86.68 132.32 42.81 Favored Pre-proline 0 N--CA 1.43 -1.441 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.96 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -59.91 122.07 10.83 Favored 'Trans proline' 0 C--O 1.239 0.565 0 C-N-CA 122.482 2.121 . . . . 0.0 112.413 -178.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.649 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.9 OUTLIER -63.37 -17.23 62.4 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.375 0.607 . . . . 0.0 111.102 179.075 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.474 ' N ' HD11 ' A' ' 40' ' ' LEU . 0.8 OUTLIER -50.69 -34.68 27.62 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 123.974 0.91 . . . . 0.0 111.211 179.193 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.551 ' HZ1' ' HB3' ' A' ' 42' ' ' LYS . 7.3 mtpm? -59.15 -51.42 70.11 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.361 179.428 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.649 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.3 pp -68.72 -34.54 75.81 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.738 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 48.2 mtm -63.01 -51.18 67.8 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-O 121.152 0.501 . . . . 0.0 110.863 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -66.58 -34.59 78.22 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-O 121.021 0.438 . . . . 0.0 110.932 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.23 -36.52 84.36 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.08 0.467 . . . . 0.0 110.022 177.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -59.92 -55.63 31.68 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.672 178.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 26.5 p -65.12 -34.98 79.69 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 122.097 -0.377 . . . . 0.0 111.557 -177.098 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -65.89 -38.64 89.3 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.93 0.395 . . . . 0.0 111.751 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -85.27 -30.18 24.0 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.009 0.433 . . . . 0.0 111.165 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -82.66 -21.65 34.91 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -177.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 87.9 40.45 6.66 Favored Glycine 0 N--CA 1.437 -1.272 0 C-N-CA 119.882 -1.152 . . . . 0.0 111.198 -177.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.405 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 4.0 mm? -123.34 161.88 23.82 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.879 0.371 . . . . 0.0 110.262 179.374 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.45 ' HB2' ' HB2' ' A' ' 57' ' ' GLN . 48.3 m -114.79 150.07 35.99 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 110.346 -0.242 . . . . 0.0 110.346 178.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.405 ' HE1' ' SG ' ' A' ' 48' ' ' CYS . 14.2 mmt -64.44 -23.95 67.46 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.216 0.532 . . . . 0.0 111.508 178.488 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.41 -17.48 39.15 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.306 0.574 . . . . 0.0 110.368 176.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.45 ' HB2' ' HB2' ' A' ' 54' ' ' SER . 2.4 mp0 -93.31 -30.13 15.29 Favored 'General case' 0 CA--C 1.507 -0.696 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.896 -178.286 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.7 pt -128.57 178.35 5.06 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.249 0 CA-C-O 121.39 0.614 . . . . 0.0 111.862 -178.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.413 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 15.5 mmt180 -156.55 142.54 18.0 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.394 177.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -97.36 148.3 23.3 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -147.65 134.75 20.39 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-O 121.245 0.545 . . . . 0.0 111.087 -176.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.42 ' HB2' HD13 ' A' ' 67' ' ' ILE . 69.2 t80 -141.41 147.86 38.66 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.44 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 17.3 t70 55.94 23.52 6.71 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-O 121.826 0.822 . . . . 0.0 110.32 -176.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.58 -21.63 21.09 Favored Glycine 0 N--CA 1.423 -2.21 0 CA-C-N 115.7 -0.682 . . . . 0.0 112.638 -179.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -95.31 149.07 35.64 Favored Pre-proline 0 C--N 1.324 -0.54 0 O-C-N 122.518 -0.401 . . . . 0.0 111.502 -177.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -70.96 142.95 43.84 Favored 'Trans proline' 0 C--O 1.235 0.351 0 C-N-CA 122.776 2.317 . . . . 0.0 112.138 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.42 HD13 ' HB2' ' A' ' 62' ' ' PHE . 15.9 mt -99.0 147.28 7.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-O 120.983 0.421 . . . . 0.0 110.825 -179.36 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -128.24 172.95 10.56 Favored 'General case' 0 CA--C 1.507 -0.673 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.356 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -75.01 -8.08 55.5 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.235 0.541 . . . . 0.0 110.984 177.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 26.2 p -93.45 -4.17 51.77 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.276 0.56 . . . . 0.0 111.141 178.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -94.68 144.51 25.56 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.487 0.661 . . . . 0.0 112.006 179.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -117.46 149.41 44.72 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.686 177.119 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.431 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 17.8 Cg_endo -59.71 -31.32 94.0 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.939 2.426 . . . . 0.0 113.469 -175.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.28 -23.05 63.78 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -178.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 6.1 mp0 -69.86 -37.35 76.09 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.098 0.475 . . . . 0.0 111.125 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.2 mp -86.48 -5.21 59.21 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 -178.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 55.96 44.48 25.57 Favored 'General case' 0 C--N 1.344 0.332 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.514 179.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.431 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 5.8 ptm -86.12 161.35 18.93 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.003 -177.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -112.18 164.94 12.61 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 -178.112 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.415 ' CB ' ' H ' ' A' ' 19' ' ' ASN . 6.2 p-10 -62.48 144.77 55.59 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.654 0.74 . . . . 0.0 112.137 176.565 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 73.82 17.9 3.47 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.282 -1.326 . . . . 0.0 112.109 179.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -78.19 164.42 24.95 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 120.303 -0.559 . . . . 0.0 109.731 176.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 21.0 m -114.21 138.15 50.84 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.611 0.72 . . . . 0.0 112.868 -175.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.515 HG13 HG23 ' A' ' 22' ' ' VAL . 19.7 mm -99.18 139.34 21.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.443 -0.798 . . . . 0.0 109.858 178.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -98.32 116.78 31.26 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.981 0.42 . . . . 0.0 110.76 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.413 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 73.4 t -111.03 137.87 41.68 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.12 0 CA-C-O 121.189 0.519 . . . . 0.0 110.133 177.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.8 p90 -136.52 156.7 48.22 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.858 -178.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.95 116.05 23.94 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.436 0.636 . . . . 0.0 111.443 -177.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 . . . . . 0 C--N 1.319 -0.74 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.604 177.97 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.516 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 0.3 OUTLIER . . . . . 0 N--CA 1.45 -0.448 0 CA-C-O 122.09 0.948 . . . . 0.0 112.341 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.434 HG13 ' CD2' ' A' ' 20' ' ' LEU . 39.6 pt -131.95 171.03 18.71 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.212 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.159 -177.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.516 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 24.8 t-20 -102.52 126.96 49.76 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-O 120.881 0.372 . . . . 0.0 110.162 179.096 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.468 HD23 HG12 ' A' ' 34' ' ' ILE . 2.7 mm? -118.84 141.54 48.55 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 177.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.402 ' HE2' ' HA ' ' A' ' 81' ' ' GLU . 49.4 mtmt -128.78 141.25 51.37 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-O 121.725 0.774 . . . . 0.0 110.814 -178.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.617 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 3.6 p -120.8 127.61 75.96 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.943 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.262 -177.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -120.83 131.91 54.71 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-O 121.19 0.519 . . . . 0.0 110.052 -179.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -109.19 148.01 16.94 Favored Glycine 0 N--CA 1.426 -1.98 0 C-N-CA 120.519 -0.848 . . . . 0.0 111.241 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.503 ' HG3' ' O ' ' A' ' 86' ' ' VAL . 0.0 OUTLIER -53.56 -12.31 0.46 Allowed 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 179.261 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -73.55 -21.88 60.24 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.505 0.669 . . . . 0.0 110.219 176.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.86 30.15 4.66 Favored Glycine 0 CA--C 1.501 -0.812 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.398 176.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.0 p -124.25 157.93 33.69 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 120.857 0.36 . . . . 0.0 110.735 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.617 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.7 p -149.55 139.2 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-O 121.116 0.484 . . . . 0.0 111.266 -178.263 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.4 t -122.88 138.03 54.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -108.17 144.83 35.05 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.827 0.346 . . . . 0.0 110.553 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.441 ' O ' ' HA ' ' A' ' 19' ' ' ASN . 7.0 m-85 . . . . . 0 N--CA 1.463 0.216 0 CA-C-O 120.898 0.38 . . . . 0.0 110.567 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.468 HG12 HD23 ' A' ' 20' ' ' LEU . 21.2 pt . . . . . 0 CA--C 1.514 -0.408 0 CA-C-O 120.837 0.351 . . . . 0.0 110.514 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.54 ' HB2' ' OG1' ' A' ' 38' ' ' THR . 9.5 mptt -75.6 150.8 37.95 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.2 ppt_? -71.79 -12.91 61.53 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 121.194 0.521 . . . . 0.0 110.951 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -103.1 -4.44 24.5 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 122.115 0.96 . . . . 0.0 108.669 179.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.54 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.8 m -86.39 135.23 36.77 Favored Pre-proline 0 C--N 1.304 -1.386 0 CA-C-N 114.799 -1.092 . . . . 0.0 110.241 -178.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -59.48 124.21 15.01 Favored 'Trans proline' 0 C--O 1.236 0.399 0 C-N-CA 122.668 2.245 . . . . 0.0 112.326 -179.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.591 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.2 pp -66.13 -17.19 64.56 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.298 0.571 . . . . 0.0 111.688 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.47 ' N ' HD13 ' A' ' 40' ' ' LEU . 3.3 p -54.25 -29.34 46.4 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.895 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -64.24 -40.99 97.16 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.461 -179.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.0 pp -73.28 -33.66 65.36 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.055 0.455 . . . . 0.0 110.074 178.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 51.6 mtm -65.66 -49.81 67.25 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.941 -178.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.413 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 38.0 mttp -67.75 -35.4 78.66 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.624 178.714 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.22 -32.02 73.44 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.146 0.498 . . . . 0.0 109.988 178.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -64.11 -55.95 18.35 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.609 178.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.443 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 17.6 p -63.16 -36.11 82.54 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.841 0.353 . . . . 0.0 111.194 -177.451 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 43.9 mt-10 -67.12 -40.35 86.8 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.92 0.391 . . . . 0.0 111.711 -179.484 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 10.3 ptm180 -84.64 -31.28 24.3 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 122.02 -0.425 . . . . 0.0 111.84 -177.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.3 mm-40 -80.7 -22.53 40.27 Favored 'General case' 0 CA--C 1.508 -0.672 0 CA-C-O 121.006 0.431 . . . . 0.0 111.747 -178.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.32 40.98 6.3 Favored Glycine 0 N--CA 1.431 -1.691 0 C-N-CA 120.153 -1.022 . . . . 0.0 111.249 -178.124 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.443 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 3.9 mm? -125.09 166.38 16.51 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.878 -0.415 . . . . 0.0 109.878 179.404 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 57.4 m -117.03 152.95 33.57 Favored 'General case' 0 C--N 1.316 -0.856 0 O-C-N 122.218 -0.301 . . . . 0.0 110.285 178.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.404 ' HE1' ' HG2' ' A' ' 45' ' ' LYS . 12.9 mmt -61.28 -27.44 68.47 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.213 0.53 . . . . 0.0 111.566 178.352 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.76 -12.34 53.92 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.518 0.675 . . . . 0.0 110.49 176.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -96.82 -16.87 20.57 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.159 -178.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.6 pt -140.37 176.75 4.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-O 121.204 0.526 . . . . 0.0 111.32 -179.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.53 ' CG ' ' HG3' ' A' ' 89' ' ' GLN . 3.3 mmt85 -151.53 140.15 20.7 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.914 178.539 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -101.39 138.77 37.96 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.415 -178.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 4.9 ttt180 -140.11 146.96 39.55 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.055 -178.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.441 ' HB2' HD13 ' A' ' 67' ' ' ILE . 78.3 t80 -152.57 143.82 23.22 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 178.253 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 54.71 24.87 5.92 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.351 0.596 . . . . 0.0 111.355 -178.193 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.38 -21.96 32.44 Favored Glycine 0 N--CA 1.443 -0.896 0 CA-C-N 116.161 -0.472 . . . . 0.0 113.141 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -98.84 151.59 37.47 Favored Pre-proline 0 C--N 1.321 -0.639 0 O-C-N 122.434 -0.45 . . . . 0.0 111.52 -177.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -71.27 139.61 35.47 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.499 2.132 . . . . 0.0 111.36 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.441 HD13 ' HB2' ' A' ' 62' ' ' PHE . 39.0 mt -89.58 147.22 5.35 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-O 120.839 0.352 . . . . 0.0 110.418 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.412 HD21 ' HB2' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -114.84 156.83 24.2 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 178.0 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.415 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 14.6 pt-20 -73.25 -12.08 60.73 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.547 0.689 . . . . 0.0 110.997 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 16.4 p -97.61 14.24 27.34 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.344 177.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.412 ' HB2' HD21 ' A' ' 68' ' ' ASN . 2.8 t70 -98.04 151.69 20.08 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.123 0.487 . . . . 0.0 110.817 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.461 ' CG2' ' HD2' ' A' ' 73' ' ' PRO . 1.6 m -113.57 141.02 25.26 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 178.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.491 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 16.2 Cg_endo -54.39 -34.03 79.33 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 123.01 2.474 . . . . 0.0 112.263 -178.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.69 -16.14 63.29 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.865 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' A' ' 72' ' ' THR . 24.8 mm-40 -74.62 -37.49 62.8 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.093 0.473 . . . . 0.0 111.079 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -86.86 -1.24 57.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.222 -178.24 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 60.0 mm-40 58.4 33.56 23.23 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.562 0.696 . . . . 0.0 110.887 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.491 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.1 ptm -78.83 161.28 26.89 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.967 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -125.17 174.4 8.1 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 -178.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.516 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 7.0 p-10 -57.11 144.01 36.38 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 121.438 0.637 . . . . 0.0 112.08 177.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.402 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 58.2 mm-40 77.44 19.64 1.22 Allowed 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 124.901 1.28 . . . . 0.0 111.526 178.091 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.27 150.57 38.83 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.109 177.404 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 16.5 m -112.61 114.21 26.72 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 121.271 0.557 . . . . 0.0 112.053 175.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.459 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 28.9 mm -81.54 142.16 14.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.322 177.223 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -100.07 116.23 31.61 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-O 120.615 0.245 . . . . 0.0 111.102 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.506 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 67.6 t -114.71 135.66 53.86 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-O 121.041 0.448 . . . . 0.0 110.762 177.225 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . 0.403 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 10.7 p90 -135.5 153.77 51.63 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.931 -179.248 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.35 120.92 23.04 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.456 0.646 . . . . 0.0 112.11 -175.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.53 ' HG3' ' CG ' ' A' ' 59' ' ' ARG . 30.3 mm-40 . . . . . 0 C--N 1.319 -0.759 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.686 177.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.583 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 38.8 p-80 . . . . . 0 N--CA 1.438 -1.047 0 CA-C-O 121.75 0.786 . . . . 0.0 112.609 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 29.7 pt -132.86 170.13 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.244 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.64 178.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.489 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 27.5 t-20 -105.2 129.42 53.58 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 178.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.458 HD22 HG12 ' A' ' 34' ' ' ILE . 2.7 mm? -117.38 142.48 47.06 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -127.56 140.59 52.02 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-O 121.477 0.655 . . . . 0.0 110.155 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.61 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 2.7 p -120.89 126.12 74.85 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.035 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.808 -176.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -115.2 128.22 56.02 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.263 0.554 . . . . 0.0 110.154 -178.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.416 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -99.87 158.66 19.65 Favored Glycine 0 N--CA 1.43 -1.714 0 C-N-CA 120.335 -0.936 . . . . 0.0 111.312 179.421 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.67 -16.49 1.66 Allowed 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 177.668 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -77.38 -21.6 52.97 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.458 0.647 . . . . 0.0 110.844 178.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.01 -8.55 45.77 Favored Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.915 -0.659 . . . . 0.0 111.928 -178.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.9 t -78.85 153.99 30.17 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.61 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.7 p -149.75 140.57 16.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 120.875 0.369 . . . . 0.0 111.071 -177.404 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.4 HG13 ' HD3' ' A' ' 50' ' ' ARG . 4.7 t -123.2 139.59 49.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.483 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -108.82 142.34 39.54 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.842 0.353 . . . . 0.0 110.674 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.413 ' O ' ' HA ' ' A' ' 19' ' ' ASN . 16.7 m-85 . . . . . 0 N--CA 1.468 0.472 0 CA-C-O 121.289 0.566 . . . . 0.0 111.293 -177.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.458 HG12 HD22 ' A' ' 20' ' ' LEU . 27.2 pt . . . . . 0 CA--C 1.513 -0.478 0 CA-C-O 120.844 0.354 . . . . 0.0 110.097 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.583 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 0.0 OUTLIER -77.34 150.01 35.22 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.553 179.843 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 3.4 ppt_? -70.41 -8.35 50.15 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.673 0.749 . . . . 0.0 110.211 179.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 30.1 t-80 -104.48 -8.22 19.25 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 -179.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 m -87.16 137.9 32.72 Favored Pre-proline 0 N--CA 1.44 -0.956 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.108 179.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -60.7 126.48 19.9 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.374 2.05 . . . . 0.0 112.176 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.5 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.3 pp -67.21 -17.75 64.95 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -178.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.462 ' N ' HD12 ' A' ' 40' ' ' LEU . 2.8 p -55.89 -28.86 58.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.886 0.374 . . . . 0.0 111.831 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -60.29 -46.24 90.54 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 120.928 0.394 . . . . 0.0 110.375 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.8 pp -71.83 -35.65 69.95 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.043 0.449 . . . . 0.0 110.436 179.27 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 47.6 mtm -63.07 -46.01 89.46 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.18 0.514 . . . . 0.0 110.863 -178.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.533 ' HB3' ' HZ3' ' A' ' 45' ' ' LYS . 7.5 mtpm? -69.84 -37.05 76.05 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.44 178.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.424 ' O ' ' HG2' ' A' ' 50' ' ' ARG . . . -62.27 -37.76 86.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.157 0.503 . . . . 0.0 109.945 178.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -58.42 -55.64 32.44 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.184 177.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.617 ' SG ' HD11 ' A' ' 58' ' ' ILE . 22.5 m -60.24 -44.93 94.81 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.339 0.59 . . . . 0.0 110.741 -177.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -67.32 -30.85 70.8 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 112.824 0.676 . . . . 0.0 112.824 -176.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.424 ' HG2' ' O ' ' A' ' 46' ' ' ALA . 13.8 ptm180 -90.65 -34.06 15.58 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.823 -0.548 . . . . 0.0 111.551 179.141 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 21.4 mm-40 -78.52 -21.82 48.27 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 121.154 0.502 . . . . 0.0 111.924 -178.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.82 39.83 6.45 Favored Glycine 0 N--CA 1.432 -1.614 0 C-N-CA 119.947 -1.12 . . . . 0.0 110.933 -177.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -123.81 166.18 16.04 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.409 ' HB2' ' HB2' ' A' ' 57' ' ' GLN . 9.7 m -118.31 155.27 30.93 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 178.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.6 mmt -61.93 -28.16 69.34 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-O 121.451 0.644 . . . . 0.0 111.185 177.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.27 -17.89 38.19 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.44 0.638 . . . . 0.0 110.841 177.537 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.409 ' HB2' ' HB2' ' A' ' 54' ' ' SER . 2.8 mp0 -88.58 -25.8 22.28 Favored 'General case' 0 CA--C 1.504 -0.807 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.815 -177.512 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.617 HD11 ' SG ' ' A' ' 48' ' ' CYS . 12.0 pt -133.27 178.65 5.32 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.157 0 CA-C-O 121.497 0.665 . . . . 0.0 112.532 -178.273 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 6.7 mmt180 -148.4 139.4 23.13 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.303 177.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -99.69 141.68 32.17 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.886 179.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -142.33 143.79 32.91 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-O 121.006 0.431 . . . . 0.0 110.937 -176.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -149.28 146.21 27.45 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 17.9 t70 56.82 22.83 7.39 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-O 121.778 0.799 . . . . 0.0 110.481 -178.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.19 -21.05 26.44 Favored Glycine 0 N--CA 1.429 -1.817 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.562 -179.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -95.72 156.46 37.34 Favored Pre-proline 0 C--N 1.329 -0.313 0 O-C-N 122.575 -0.368 . . . . 0.0 111.131 -178.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -77.17 142.04 21.24 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 122.496 2.131 . . . . 0.0 111.589 178.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 38.8 mt -90.04 153.41 3.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 120.949 0.404 . . . . 0.0 110.589 -178.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.524 HD21 ' HB2' ' A' ' 71' ' ' ASP . 0.1 OUTLIER -116.38 162.82 16.95 Favored 'General case' 0 CA--C 1.498 -1.038 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 178.889 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.431 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 0.8 OUTLIER -75.27 -18.82 59.99 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-O 121.39 0.614 . . . . 0.0 110.349 178.984 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 8.3 t -98.96 11.97 37.33 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.375 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.524 ' HB2' HD21 ' A' ' 68' ' ' ASN . 0.9 OUTLIER -95.53 154.09 17.38 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-O 120.959 0.409 . . . . 0.0 110.596 -179.594 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -114.03 147.83 38.66 Favored Pre-proline 0 C--N 1.316 -0.891 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.249 178.575 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.559 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 18.6 Cg_endo -58.91 -28.65 88.1 Favored 'Trans proline' 0 C--O 1.238 0.514 0 C-N-CA 122.79 2.327 . . . . 0.0 112.018 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -77.91 -14.77 59.44 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.506 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.8 tp60 -68.32 -42.35 79.5 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.653 0.74 . . . . 0.0 109.56 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -91.05 -1.8 57.74 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.146 -179.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 56.94 34.75 25.37 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.277 179.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.559 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 4.7 ptm -68.92 159.8 31.99 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.012 0.434 . . . . 0.0 110.851 -178.357 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -115.98 166.53 11.89 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.173 -176.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.489 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 9.7 p-10 -61.1 141.37 57.47 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.39 0.614 . . . . 0.0 111.775 177.014 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 81.83 17.06 0.43 Allowed 'General case' 0 C--O 1.236 0.355 0 C-N-CA 125.419 1.487 . . . . 0.0 110.877 -179.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.423 ' OD1' HD11 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -61.52 148.73 41.12 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.523 178.496 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 29.4 m -111.07 110.52 21.1 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 121.419 0.628 . . . . 0.0 112.252 176.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.443 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 28.1 mm -79.45 139.37 18.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.523 177.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -98.12 113.86 25.88 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.915 0.388 . . . . 0.0 110.541 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.416 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 82.0 t -111.55 134.72 53.03 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 CA-C-O 121.292 0.568 . . . . 0.0 111.019 178.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -131.27 166.78 20.43 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.546 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.506 ' NE2' HG21 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -95.1 133.02 39.37 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.597 0.713 . . . . 0.0 111.93 -174.387 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 . . . . . 0 C--N 1.318 -0.78 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.717 177.124 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 11.4 p-80 . . . . . 0 N--CA 1.448 -0.567 0 CA-C-O 121.114 0.483 . . . . 0.0 110.682 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 29.2 pt -127.53 170.91 16.62 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.122 0 CA-C-O 121.295 0.569 . . . . 0.0 110.725 -178.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.44 ' HA ' ' O ' ' A' ' 32' ' ' PHE . 25.3 t-20 -107.28 122.5 46.67 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.838 179.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.423 HD13 ' OD2' ' A' ' 82' ' ' ASP . 2.8 mm? -113.16 139.58 48.64 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 178.558 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -125.01 141.29 52.22 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 -178.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.565 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 85.6 t -120.7 130.31 74.69 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.697 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.121 -177.118 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -116.37 123.81 48.53 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-O 121.293 0.568 . . . . 0.0 110.295 -179.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.455 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -96.13 158.72 21.84 Favored Glycine 0 N--CA 1.426 -2.001 0 C-N-CA 120.238 -0.982 . . . . 0.0 110.98 178.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -52.57 -16.42 0.92 Allowed 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 178.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -76.14 -22.13 55.8 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.387 0.613 . . . . 0.0 110.854 178.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 99.33 9.93 49.54 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 -177.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.4 t -96.45 125.05 40.67 Favored 'General case' 0 N--CA 1.44 -0.94 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.565 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 16.3 t -118.08 141.16 38.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 121.062 0.458 . . . . 0.0 110.953 -179.008 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.426 HG13 ' HD3' ' A' ' 50' ' ' ARG . 16.2 t -124.56 138.7 53.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 178.163 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -107.89 142.41 38.01 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.748 0.308 . . . . 0.0 110.591 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.49 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 15.9 m-85 . . . . . 0 C--N 1.329 -0.324 0 CA-C-O 120.99 0.424 . . . . 0.0 110.687 -178.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 22.3 pt . . . . . 0 CA--C 1.516 -0.356 0 CA-C-O 120.751 0.31 . . . . 0.0 110.48 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 86.3 mttt -77.28 150.36 35.3 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 178.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.4 ptt180 -69.37 -18.47 63.78 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.302 0.573 . . . . 0.0 111.092 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 49.3 t-80 -103.33 -1.14 29.2 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 122.329 1.061 . . . . 0.0 108.867 -176.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.441 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.7 m -91.17 138.21 25.94 Favored Pre-proline 0 C--N 1.304 -1.381 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.46 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -58.0 120.06 7.71 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.676 2.251 . . . . 0.0 112.085 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.587 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.3 pt? -66.93 -15.95 64.02 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.21 0.529 . . . . 0.0 111.364 -179.022 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.518 ' HB2' ' O ' ' A' ' 69' ' ' GLU . 44.4 t -49.71 -32.87 14.41 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.219 177.5 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 39.2 mtmt -60.57 -47.48 86.02 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 120.978 0.418 . . . . 0.0 110.305 179.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.2 pp -72.67 -35.75 67.77 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.468 -179.456 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 63.3 mtm -62.61 -48.0 81.29 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 120.997 0.427 . . . . 0.0 110.831 179.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.442 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 47.9 mttp -66.72 -35.57 80.42 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.144 0.497 . . . . 0.0 110.344 177.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.83 -35.31 80.19 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.297 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -63.5 -54.38 37.18 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.788 178.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 22.5 p -64.01 -36.4 83.86 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 120.726 0.298 . . . . 0.0 111.314 -176.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.442 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 44.3 mt-10 -66.6 -42.05 87.51 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.749 0.309 . . . . 0.0 111.673 -179.172 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.426 ' HD3' HG13 ' A' ' 30' ' ' VAL . 9.9 ptm180 -79.21 -27.03 42.52 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.251 0.548 . . . . 0.0 110.77 -178.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 23.4 mm-40 -84.03 -20.64 32.39 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 94.29 7.04 61.01 Favored Glycine 0 N--CA 1.444 -0.803 0 C-N-CA 120.339 -0.934 . . . . 0.0 112.817 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -98.13 174.27 6.61 Favored 'General case' 0 C--N 1.321 -0.672 0 O-C-N 122.071 -0.664 . . . . 0.0 111.199 -179.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.8 m -125.1 158.84 32.86 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.617 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.0 mmt -62.87 -27.21 69.19 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.134 0.492 . . . . 0.0 111.954 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.421 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.18 -14.38 47.08 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.482 0.658 . . . . 0.0 110.527 177.485 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -92.1 -25.87 18.55 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.779 -178.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.438 HG23 ' NE2' ' A' ' 88' ' ' GLN . 12.8 pt -136.42 178.93 4.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.181 0.515 . . . . 0.0 111.442 -178.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.448 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 7.8 mmt180 -154.74 140.9 18.49 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.708 177.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -97.91 142.35 29.76 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.639 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.01 137.98 28.06 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-O 121.119 0.485 . . . . 0.0 111.029 -176.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -143.64 147.48 34.39 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.9 t70 59.43 21.2 9.58 Favored 'General case' 0 N--CA 1.482 1.16 0 CA-C-O 122.181 0.991 . . . . 0.0 109.701 -178.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.15 -20.36 21.65 Favored Glycine 0 N--CA 1.42 -2.394 0 CA-C-N 115.532 -0.758 . . . . 0.0 112.299 -178.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -95.6 149.53 36.21 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-O 121.124 0.488 . . . . 0.0 111.336 -177.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_exo -66.57 138.08 48.58 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.787 2.325 . . . . 0.0 111.823 177.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 53.2 mt -89.04 150.57 3.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 110.17 -0.307 . . . . 0.0 110.17 179.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.572 HD21 ' HB2' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -120.2 152.99 36.91 Favored 'General case' 0 CA--C 1.502 -0.897 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 177.865 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.518 ' O ' ' HB2' ' A' ' 41' ' ' SER . 7.3 pt-20 -72.59 -18.07 61.64 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-O 121.296 0.57 . . . . 0.0 111.569 -177.655 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.9 t -92.98 7.7 42.96 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-O 120.934 0.397 . . . . 0.0 111.383 -178.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.572 ' HB2' HD21 ' A' ' 68' ' ' ASN . 0.9 OUTLIER -101.05 171.77 7.42 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.204 0.526 . . . . 0.0 111.335 -179.678 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.427 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.6 OUTLIER -124.29 149.8 62.08 Favored Pre-proline 0 C--N 1.319 -0.758 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.877 177.901 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.6 -31.39 92.17 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.056 2.504 . . . . 0.0 112.684 -178.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.63 -18.9 63.63 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.938 0.399 . . . . 0.0 111.346 -179.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.427 ' HB2' ' O ' ' A' ' 72' ' ' THR . 26.4 mm-40 -70.67 -37.85 73.69 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.212 0.529 . . . . 0.0 110.685 178.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.402 HD11 ' H ' ' A' ' 76' ' ' LEU . 0.9 OUTLIER -90.52 5.9 45.82 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 179.433 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 45.43 33.68 1.37 Allowed 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.004 1.322 . . . . 0.0 112.213 -179.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.1 ptm -69.6 160.89 30.71 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.366 -179.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -119.76 166.96 12.56 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.258 -176.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.459 ' O ' ' HB2' ' A' ' 81' ' ' GLU . 5.9 p-10 -59.84 145.61 44.96 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.119 0.485 . . . . 0.0 111.579 177.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.459 ' HB2' ' O ' ' A' ' 80' ' ' ASP . 3.4 mm-40 79.8 16.3 0.82 Allowed 'General case' 0 C--O 1.233 0.213 0 C-N-CA 124.862 1.265 . . . . 0.0 110.936 -178.845 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.423 ' OD2' HD13 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -63.84 147.97 50.52 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.161 177.956 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 11.7 m -110.87 110.33 20.88 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.43 0.633 . . . . 0.0 111.748 176.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.537 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 13.2 mm -80.02 139.67 17.89 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.216 178.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -96.79 113.07 24.59 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.887 0.375 . . . . 0.0 110.582 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.455 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 43.9 t -111.02 134.82 52.09 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 CA-C-O 121.55 0.69 . . . . 0.0 110.808 177.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.6 p90 -134.2 153.89 51.57 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.81 -178.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.438 ' NE2' HG23 ' A' ' 58' ' ' ILE . 4.9 tp60 -78.49 114.12 17.11 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.044 0.45 . . . . 0.0 110.824 -177.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 . . . . . 0 C--N 1.32 -0.682 0 CA-C-O 121.479 0.657 . . . . 0.0 110.061 178.427 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.531 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 30.5 p-80 . . . . . 0 N--CA 1.451 -0.397 0 CA-C-O 121.567 0.698 . . . . 0.0 112.613 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 35.0 pt -133.19 170.74 19.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.94 179.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.48 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 11.2 m120 -97.29 138.57 34.55 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 178.091 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.451 HD21 HG12 ' A' ' 34' ' ' ILE . 3.2 mm? -130.14 138.26 50.56 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 174.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -126.25 142.4 51.54 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-O 121.175 0.512 . . . . 0.0 110.334 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.564 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 90.4 t -124.02 133.91 67.99 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.147 -177.388 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -111.46 129.13 56.13 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 121.211 0.529 . . . . 0.0 110.945 -177.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -100.47 167.28 20.05 Favored Glycine 0 N--CA 1.435 -1.397 0 C-N-CA 121.238 -0.505 . . . . 0.0 111.874 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.656 ' NE2' ' H ' ' A' ' 25' ' ' GLN . 0.2 OUTLIER -65.64 -30.19 70.86 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.44 0.638 . . . . 0.0 110.487 -177.075 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -73.67 -12.78 60.84 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.1 -178.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 102.3 0.61 50.69 Favored Glycine 0 C--O 1.227 -0.327 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.167 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.9 t -82.52 149.08 27.73 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 120.895 0.379 . . . . 0.0 110.202 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.564 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 47.5 t -142.7 135.28 26.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 -177.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.8 t -120.79 136.24 58.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -104.36 140.34 38.03 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.75 0.309 . . . . 0.0 110.266 178.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.412 ' O ' ' HA ' ' A' ' 19' ' ' ASN . 19.8 m-85 . . . . . 0 C--N 1.324 -0.506 0 CA-C-O 121.016 0.436 . . . . 0.0 111.215 -178.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.451 HG12 HD21 ' A' ' 20' ' ' LEU . 20.9 pt . . . . . 0 N--CA 1.467 0.412 0 CA-C-O 120.945 0.402 . . . . 0.0 111.013 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.531 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 23.8 mtpp -77.7 146.23 36.11 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.995 0.426 . . . . 0.0 110.632 178.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.4 ppt_? -71.8 -13.71 61.77 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.314 0.578 . . . . 0.0 111.025 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 32.0 t60 -98.91 -5.38 30.87 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.475 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.8 m -91.66 136.17 26.86 Favored Pre-proline 0 C--N 1.305 -1.341 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.321 -178.42 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.91 126.19 19.03 Favored 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 122.473 2.115 . . . . 0.0 111.83 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.556 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.2 pp -64.78 -16.55 63.19 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.777 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.497 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 4.0 p -51.8 -31.96 29.35 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 122.873 0.469 . . . . 0.0 111.679 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -61.67 -49.13 77.75 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.01 0.433 . . . . 0.0 110.342 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.556 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.6 pp -67.48 -35.08 78.46 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 121.053 0.454 . . . . 0.0 110.142 179.357 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 48.3 mtm -63.55 -49.3 73.98 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 121.087 0.47 . . . . 0.0 110.896 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.418 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 16.5 mtpp -67.54 -36.94 81.96 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.269 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.426 ' O ' ' HG2' ' A' ' 50' ' ' ARG . . . -62.03 -38.8 90.06 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.128 0.489 . . . . 0.0 109.851 178.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -58.74 -53.71 55.33 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.108 177.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 29.6 p -65.99 -36.51 83.48 Favored 'General case' 0 N--CA 1.453 -0.285 0 O-C-N 121.981 -0.449 . . . . 0.0 111.184 -177.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.418 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 45.2 mt-10 -66.11 -40.2 90.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.797 0.332 . . . . 0.0 111.547 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.426 ' HG2' ' O ' ' A' ' 46' ' ' ALA . 13.9 ptm180 -80.29 -30.5 38.26 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.052 0.453 . . . . 0.0 111.117 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -83.97 -16.13 45.23 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -178.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 92.61 6.77 63.76 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 119.955 -1.117 . . . . 0.0 112.954 179.065 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -98.94 175.22 6.01 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.444 0.64 . . . . 0.0 111.197 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.413 ' HB2' ' OE1' ' A' ' 57' ' ' GLN . 68.7 m -126.06 159.89 31.58 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.652 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.6 mmt -66.43 -25.16 66.62 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.3 0.572 . . . . 0.0 111.428 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.32 -18.34 34.14 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.677 0.751 . . . . 0.0 110.285 176.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.413 ' OE1' ' HB2' ' A' ' 54' ' ' SER . 1.3 mp0 -89.2 -28.15 20.17 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.812 -179.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 11.2 pt -136.46 177.29 6.44 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 CA-C-O 121.354 0.597 . . . . 0.0 112.007 -177.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.462 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 15.9 mmt180 -151.9 143.43 23.5 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.65 178.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -99.01 144.73 27.82 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.71 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.604 ' HG2' ' N ' ' A' ' 62' ' ' PHE . 0.8 OUTLIER -142.14 151.0 41.84 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-O 121.224 0.535 . . . . 0.0 111.211 -177.521 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.604 ' N ' ' HG2' ' A' ' 61' ' ' ARG . 66.7 t80 -155.77 146.81 22.38 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 177.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 22.5 t70 56.72 23.88 8.39 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-O 121.795 0.807 . . . . 0.0 110.251 -177.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.38 -16.41 29.75 Favored Glycine 0 N--CA 1.431 -1.638 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.945 -178.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -97.99 147.41 33.03 Favored Pre-proline 0 C--N 1.326 -0.44 0 O-C-N 122.414 -0.462 . . . . 0.0 110.716 -179.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.97 138.77 34.65 Favored 'Trans proline' 0 CA--C 1.533 0.465 0 C-N-CA 122.544 2.163 . . . . 0.0 112.091 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 31.6 mt -88.14 151.96 3.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 120.889 0.376 . . . . 0.0 110.285 -178.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -128.79 172.08 11.62 Favored 'General case' 0 CA--C 1.499 -1.003 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.497 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 7.1 pt-20 -78.77 -8.43 58.75 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 121.508 0.671 . . . . 0.0 110.064 177.197 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 23.5 p -93.29 -1.77 55.68 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.158 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -104.0 144.03 32.08 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.299 0.571 . . . . 0.0 112.277 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.515 ' OG1' ' HG2' ' A' ' 75' ' ' GLN . 0.6 OUTLIER -111.65 157.95 37.87 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.981 176.612 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.547 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 17.9 Cg_endo -58.59 -28.62 86.52 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.755 2.303 . . . . 0.0 112.16 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -78.87 -10.74 59.9 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.907 -178.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.515 ' HG2' ' OG1' ' A' ' 72' ' ' THR . 23.5 mm-40 -79.26 -38.88 34.42 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.1 0.476 . . . . 0.0 111.683 -178.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.438 HD13 ' H ' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -93.59 1.01 56.81 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 179.621 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 54.01 48.64 20.66 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.815 0.817 . . . . 0.0 110.705 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.547 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.4 ptm -82.42 152.96 25.93 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.283 -179.325 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.53 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 13.3 pt-20 -99.34 163.97 12.31 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.142 -177.274 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.48 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 7.3 p-10 -57.37 143.93 38.11 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 121.36 0.6 . . . . 0.0 110.737 173.481 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 68.07 20.98 8.9 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.821 -179.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.53 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 0.5 OUTLIER -69.56 155.39 40.56 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 120.414 -0.514 . . . . 0.0 109.976 179.218 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 24.4 m -102.1 119.93 39.61 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 -174.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.514 HG13 HG23 ' A' ' 22' ' ' VAL . 19.8 mm -90.5 136.53 23.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.292 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -100.67 118.59 37.11 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.064 0.459 . . . . 0.0 110.676 178.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.462 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 76.1 t -111.14 140.39 30.64 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.518 0 CA-C-O 121.051 0.453 . . . . 0.0 110.0 177.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.3 p90 -136.31 153.66 51.09 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -83.46 117.48 23.1 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 121.144 0.497 . . . . 0.0 110.714 -176.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.47 ' HA ' ' OE1' ' A' ' 89' ' ' GLN . 11.6 mm-40 . . . . . 0 C--N 1.316 -0.852 0 CA-C-O 121.437 0.637 . . . . 0.0 111.293 178.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.481 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 22.0 p-80 . . . . . 0 N--CA 1.455 -0.213 0 CA-C-O 121.081 0.467 . . . . 0.0 111.233 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 42.8 pt -136.87 170.65 17.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.443 -179.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 23.2 t-20 -105.51 134.2 49.01 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.179 179.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.497 HD13 ' OD1' ' A' ' 82' ' ' ASP . 2.7 mm? -126.41 145.07 50.62 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 177.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -129.86 144.24 51.21 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-O 121.297 0.57 . . . . 0.0 110.402 -178.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.635 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 4.7 p -125.01 132.25 71.54 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.874 -176.623 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -122.33 138.74 54.41 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.18 0.514 . . . . 0.0 110.662 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -112.98 160.4 13.14 Favored Glycine 0 N--CA 1.437 -1.275 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -62.71 -19.13 63.6 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.677 0.751 . . . . 0.0 110.02 -179.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -81.27 11.01 4.66 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.871 -177.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 71.45 39.52 61.25 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 119.893 -1.146 . . . . 0.0 113.186 179.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.5 t -132.06 147.37 52.44 Favored 'General case' 0 C--N 1.31 -1.114 0 O-C-N 122.038 -0.683 . . . . 0.0 110.287 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.635 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.5 p -146.72 137.16 17.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.124 0.488 . . . . 0.0 111.523 -178.327 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 t -123.85 138.05 54.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 178.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -107.8 140.73 40.45 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.819 0.342 . . . . 0.0 110.939 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 . . . . . 0 N--CA 1.468 0.466 0 CA-C-O 121.125 0.488 . . . . 0.0 111.31 -177.676 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.48 HG12 HD21 ' A' ' 20' ' ' LEU . 21.2 pt . . . . . 0 C--O 1.217 -0.646 0 CA-C-O 120.815 0.341 . . . . 0.0 110.309 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.481 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 1.7 mtpm? -94.82 151.11 19.51 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-O 120.903 0.383 . . . . 0.0 110.269 -178.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.9 ptt180 -67.08 -23.95 65.91 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.043 0.449 . . . . 0.0 111.762 -177.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -103.13 3.15 35.54 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 122.341 1.067 . . . . 0.0 109.044 -176.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.473 ' OG1' ' HD3' ' A' ' 35' ' ' LYS . 1.8 m -95.87 138.26 21.73 Favored Pre-proline 0 N--CA 1.428 -1.57 0 CA-C-N 114.523 -1.217 . . . . 0.0 110.186 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -58.46 122.37 11.56 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.777 2.318 . . . . 0.0 112.149 -178.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.501 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.0 OUTLIER -70.37 -16.17 62.94 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.328 0.585 . . . . 0.0 111.242 -179.318 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.441 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 4.2 p -50.68 -29.75 11.95 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.554 178.286 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -60.49 -47.93 83.99 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.21 0.528 . . . . 0.0 110.016 177.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.0 OUTLIER -69.6 -37.74 77.01 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.019 179.089 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 57.4 mtm -61.95 -46.78 87.81 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 120.941 0.401 . . . . 0.0 111.287 -179.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.4 ' HE2' ' HB3' ' A' ' 45' ' ' LYS . 30.7 mtpt -67.3 -38.1 84.43 Favored 'General case' 0 CA--C 1.511 -0.529 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.578 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.39 -34.66 77.16 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.174 0.512 . . . . 0.0 109.947 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -62.5 -56.54 17.13 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.771 177.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.423 ' SG ' ' HE2' ' A' ' 55' ' ' MET . 25.8 p -65.42 -37.07 85.82 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 122.091 -0.38 . . . . 0.0 111.512 -176.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -70.72 -29.78 66.15 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -178.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 10.2 ptm85 -89.77 -30.88 17.7 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 121.961 -0.462 . . . . 0.0 111.13 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -80.61 -22.53 40.53 Favored 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -178.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.68 40.07 6.07 Favored Glycine 0 N--CA 1.434 -1.483 0 C-N-CA 120.012 -1.089 . . . . 0.0 110.949 -177.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -126.21 166.27 17.39 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 178.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 72.0 m -119.54 153.31 35.58 Favored 'General case' 0 C--N 1.309 -1.169 0 O-C-N 122.188 -0.32 . . . . 0.0 110.66 178.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.423 ' HE2' ' SG ' ' A' ' 48' ' ' CYS . 14.3 mmt -61.52 -25.67 67.43 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.149 0.499 . . . . 0.0 112.08 179.492 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.2 -13.46 49.9 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.563 0.697 . . . . 0.0 110.409 176.698 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -94.3 -28.27 15.67 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.648 -0.706 . . . . 0.0 112.188 -177.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.454 HG23 ' NE2' ' A' ' 88' ' ' GLN . 13.0 pt -133.35 175.29 11.69 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 CA-C-O 121.206 0.527 . . . . 0.0 111.149 -177.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.421 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 14.9 mmt180 -149.95 144.32 25.79 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.803 178.319 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -102.37 141.54 35.04 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.009 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.439 ' HG2' ' O ' ' A' ' 65' ' ' GLN . 8.3 tmm_? -142.92 141.63 31.53 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.362 0.601 . . . . 0.0 111.381 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.41 ' HB2' HD13 ' A' ' 67' ' ' ILE . 85.9 t80 -144.56 147.49 33.25 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.492 178.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.5 t70 58.06 24.45 11.19 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-O 121.728 0.775 . . . . 0.0 110.34 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.42 ' HA2' ' HD3' ' A' ' 61' ' ' ARG . . . 76.55 6.66 84.78 Favored Glycine 0 N--CA 1.433 -1.514 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.93 -179.525 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.439 ' O ' ' HG2' ' A' ' 61' ' ' ARG . 12.8 pt20 -122.01 147.05 47.93 Favored Pre-proline 0 CA--C 1.536 0.425 0 O-C-N 122.224 -0.574 . . . . 0.0 110.48 179.128 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -66.69 138.44 49.26 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 122.492 2.128 . . . . 0.0 112.223 -178.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.41 HD13 ' HB2' ' A' ' 62' ' ' PHE . 45.2 mt -91.54 146.47 6.22 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-O 120.952 0.406 . . . . 0.0 110.099 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.562 HD21 ' HB2' ' A' ' 71' ' ' ASP . 0.2 OUTLIER -114.42 165.9 12.25 Favored 'General case' 0 CA--C 1.492 -1.282 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.634 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.441 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 0.4 OUTLIER -77.95 -19.81 53.89 Favored 'General case' 0 C--N 1.291 -1.97 0 CA-C-O 121.44 0.638 . . . . 0.0 109.693 178.659 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 36.2 p -92.38 4.04 54.22 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.893 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.562 ' HB2' HD21 ' A' ' 68' ' ' ASN . 20.8 t0 -98.96 159.82 14.69 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 121.899 -0.5 . . . . 0.0 110.568 -178.656 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -118.39 154.2 52.05 Favored Pre-proline 0 C--N 1.316 -0.864 0 O-C-N 122.24 -0.287 . . . . 0.0 111.664 177.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.41 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 19.5 Cg_endo -60.17 -30.96 92.49 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.94 2.427 . . . . 0.0 112.276 -179.483 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.17 -19.68 62.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.145 0.497 . . . . 0.0 111.129 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.424 ' NE2' ' HA ' ' A' ' 75' ' ' GLN . 4.0 tp60 -67.84 -37.57 82.05 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.645 0.736 . . . . 0.0 110.152 -179.149 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -93.54 5.19 52.43 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.945 -178.725 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 43.31 40.97 2.81 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.615 1.166 . . . . 0.0 111.94 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.41 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 4.3 ptm -74.27 161.89 29.46 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.723 -178.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -110.2 164.14 12.93 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 116.325 -0.398 . . . . 0.0 109.964 -177.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -55.42 138.07 46.82 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.591 0.71 . . . . 0.0 111.999 176.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 77.95 24.92 0.68 Allowed 'General case' 0 CA--C 1.512 -0.518 0 C-N-CA 124.895 1.278 . . . . 0.0 111.835 177.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.497 ' OD1' HD13 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -61.62 154.07 26.1 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.303 176.523 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 30.8 m -110.44 108.89 19.06 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-O 121.411 0.624 . . . . 0.0 112.05 176.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.411 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 25.1 mm -80.49 137.8 20.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.175 177.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -101.35 124.33 46.86 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.144 0.497 . . . . 0.0 110.423 178.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.421 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 91.0 t -114.19 131.58 65.75 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.08 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.716 178.152 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.4 p90 -133.85 152.06 51.74 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 116.248 -0.433 . . . . 0.0 109.93 -175.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.454 ' NE2' HG23 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -76.91 112.12 13.18 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-O 121.358 0.599 . . . . 0.0 112.369 -176.414 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 78.2 mm-40 . . . . . 0 C--N 1.317 -0.811 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.572 177.142 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 55.4 p-80 . . . . . 0 N--CA 1.436 -1.127 0 CA-C-O 121.459 0.647 . . . . 0.0 111.485 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 39.7 pt -127.12 167.65 21.57 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.206 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.33 -178.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.495 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 23.7 t-20 -100.62 137.86 38.44 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.381 178.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -127.85 135.9 50.68 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 176.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -119.65 145.02 46.84 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-O 121.301 0.572 . . . . 0.0 110.12 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.629 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 6.7 p -123.66 134.35 66.66 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.937 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.955 -178.435 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -117.93 117.99 30.77 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-O 121.241 0.543 . . . . 0.0 110.081 -178.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -84.12 155.14 31.11 Favored Glycine 0 N--CA 1.426 -2.012 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.092 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -15.31 9.31 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 178.014 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -93.48 -11.19 32.6 Favored 'General case' 0 C--N 1.319 -0.718 0 O-C-N 122.015 -0.428 . . . . 0.0 110.828 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.99 7.58 35.53 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.648 -0.786 . . . . 0.0 112.737 178.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 74.5 m -91.36 124.94 35.93 Favored 'General case' 0 C--N 1.313 -0.988 0 O-C-N 122.363 -0.493 . . . . 0.0 111.118 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.629 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.2 p -119.91 132.31 69.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 CA-C-O 121.292 0.568 . . . . 0.0 111.605 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.5 t -119.19 135.26 60.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.044 179.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -104.89 142.18 35.22 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.707 0.289 . . . . 0.0 110.696 179.111 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 . . . . . 0 N--CA 1.47 0.546 0 CA-C-O 121.179 0.514 . . . . 0.0 111.149 -178.615 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 24.7 pt . . . . . 0 CA--C 1.515 -0.391 0 CA-C-O 120.916 0.389 . . . . 0.0 110.347 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 44.6 mtpt -86.58 152.96 22.16 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-O 121.134 0.492 . . . . 0.0 110.887 179.728 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 28.1 ptt180 -64.49 -24.06 67.49 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.172 -0.467 . . . . 0.0 112.0 -178.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 55.7 t60 -104.22 -2.26 25.94 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 122.086 0.946 . . . . 0.0 108.817 -176.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.466 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.5 m -87.15 137.87 32.76 Favored Pre-proline 0 N--CA 1.427 -1.587 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.355 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -58.92 122.7 12.05 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.672 2.248 . . . . 0.0 112.469 -178.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.45 HD11 ' N ' ' A' ' 41' ' ' SER . 1.2 pp -68.0 -16.47 64.06 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.427 179.225 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.468 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 10.1 p -52.14 -30.31 25.95 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.247 0.619 . . . . 0.0 111.899 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -64.24 -42.66 96.42 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.675 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.468 HD13 ' C ' ' A' ' 43' ' ' LEU . 1.0 OUTLIER -70.83 -35.91 72.67 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.05 0.453 . . . . 0.0 110.233 178.519 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 44.0 mtm -63.32 -49.28 74.59 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.015 0.436 . . . . 0.0 110.765 -178.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.4 mmmm -66.55 -37.71 85.56 Favored 'General case' 0 N--CA 1.441 -0.878 0 O-C-N 122.267 -0.271 . . . . 0.0 110.48 177.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.34 -43.41 88.26 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.378 0.608 . . . . 0.0 110.04 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -56.38 -55.08 37.96 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.619 177.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.663 ' SG ' HD11 ' A' ' 58' ' ' ILE . 33.2 m -63.08 -42.71 99.69 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.926 0.393 . . . . 0.0 111.174 -177.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.45 -35.95 81.56 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -177.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -84.98 -34.2 22.43 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.92 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -83.17 -13.57 55.21 Favored 'General case' 0 C--N 1.334 -0.096 0 N-CA-C 113.083 0.772 . . . . 0.0 113.083 -178.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.42 6.49 73.95 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.152 -1.023 . . . . 0.0 113.203 178.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -92.18 169.94 10.21 Favored 'General case' 0 C--N 1.32 -0.675 0 O-C-N 121.975 -0.721 . . . . 0.0 110.925 178.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 71.6 m -120.77 154.38 35.75 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.319 179.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 12.5 mmt -62.01 -28.19 69.4 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-O 121.375 0.607 . . . . 0.0 111.592 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.47 ' HD2' ' H ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.08 -14.85 45.91 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.438 0.637 . . . . 0.0 110.818 178.397 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -90.18 -31.64 16.97 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.586 -179.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.663 HD11 ' SG ' ' A' ' 48' ' ' CYS . 12.0 pt -128.84 175.95 9.16 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.151 0 CA-C-O 121.296 0.569 . . . . 0.0 111.678 -177.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.454 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 25.0 mmt180 -148.51 138.77 22.53 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.341 179.378 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 41.8 m-85 -96.71 139.6 32.54 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.308 179.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.449 ' NE ' ' HA2' ' A' ' 64' ' ' GLY . 0.2 OUTLIER -141.62 137.71 32.05 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-O 121.04 0.448 . . . . 0.0 111.063 -176.755 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.446 ' HB2' HD11 ' A' ' 67' ' ' ILE . 67.2 t80 -143.33 145.15 32.45 Favored 'General case' 0 C--O 1.214 -0.801 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 177.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 23.7 t70 54.02 23.75 4.24 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 121.895 0.855 . . . . 0.0 110.871 -177.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.449 ' HA2' ' NE ' ' A' ' 61' ' ' ARG . . . 85.08 -18.03 29.49 Favored Glycine 0 N--CA 1.434 -1.469 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.997 -178.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -96.11 149.94 36.59 Favored Pre-proline 0 C--N 1.318 -0.765 0 O-C-N 122.532 -0.393 . . . . 0.0 111.071 -179.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.92 141.98 37.97 Favored 'Trans proline' 0 C--O 1.235 0.344 0 C-N-CA 122.53 2.153 . . . . 0.0 111.751 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.446 HD11 ' HB2' ' A' ' 62' ' ' PHE . 23.9 mt -94.53 148.15 5.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 120.979 0.419 . . . . 0.0 110.19 -179.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -129.24 166.72 18.86 Favored 'General case' 0 CA--C 1.498 -1.042 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.729 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.468 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 12.6 pt-20 -75.16 -12.48 60.31 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 121.341 0.591 . . . . 0.0 110.479 178.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.8 t -91.71 -1.33 57.45 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 121.221 0.534 . . . . 0.0 111.171 -178.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -103.93 147.12 27.72 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 120.9 0.381 . . . . 0.0 111.022 177.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.56 153.72 42.73 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.46 179.533 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -60.7 -31.27 91.81 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.701 2.268 . . . . 0.0 112.551 -177.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.83 -20.78 62.52 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.79 -179.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -67.21 -37.22 83.27 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.153 0.502 . . . . 0.0 111.127 -178.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -94.51 11.24 31.54 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.564 -178.023 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 43.73 36.97 1.41 Allowed 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 124.147 0.979 . . . . 0.0 112.202 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.8 ptm -73.53 158.47 34.8 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.901 -178.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -109.33 165.43 11.63 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 120.916 0.389 . . . . 0.0 110.534 -178.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.495 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 10.3 p-10 -61.55 142.73 56.9 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.339 0.59 . . . . 0.0 111.196 175.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 72.83 17.33 4.36 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 124.42 1.088 . . . . 0.0 111.721 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -75.48 161.54 29.11 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 176.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 6.7 m -109.95 131.86 54.68 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -174.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 45.9 mm -97.62 134.01 37.33 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 175.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 43.3 m-20 -97.39 124.65 41.64 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-O 121.07 0.462 . . . . 0.0 110.967 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.454 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 87.3 t -115.61 139.09 43.78 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 CA-C-O 120.99 0.424 . . . . 0.0 110.329 177.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 9.7 p90 -134.9 155.87 49.94 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -88.63 116.38 26.84 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.541 0.686 . . . . 0.0 111.48 -175.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 75.0 mm-40 . . . . . 0 C--N 1.315 -0.896 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.524 178.082 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.56 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 5.9 p-80 . . . . . 0 N--CA 1.453 -0.283 0 CA-C-O 121.403 0.62 . . . . 0.0 111.409 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 29.2 pt -128.96 171.12 17.36 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.128 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.028 178.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -107.27 133.91 51.13 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 178.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -124.35 135.35 53.26 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 177.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.435 ' HG2' ' HG3' ' A' ' 31' ' ' GLN . 49.8 mtmt -121.95 144.42 48.88 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 121.155 0.503 . . . . 0.0 110.099 -179.279 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.613 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 2.5 p -121.62 127.45 75.58 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.527 -177.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -117.44 126.69 53.05 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.294 0.568 . . . . 0.0 110.09 -178.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -104.13 152.95 17.71 Favored Glycine 0 N--CA 1.429 -1.812 0 C-N-CA 120.439 -0.886 . . . . 0.0 111.548 -179.303 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.05 -16.2 1.03 Allowed 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 177.465 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -70.26 -22.8 62.84 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.507 0.67 . . . . 0.0 110.51 177.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 102.56 9.66 40.29 Favored Glycine 0 N--CA 1.448 -0.501 0 N-CA-C 111.338 -0.705 . . . . 0.0 111.338 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 39.9 t -101.89 157.15 17.06 Favored 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 122.492 0.317 . . . . 0.0 110.224 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.613 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 3.7 p -149.51 140.59 16.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.0 0.428 . . . . 0.0 110.616 -179.197 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.9 t -125.18 139.71 50.37 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.435 ' HG3' ' HG2' ' A' ' 21' ' ' LYS . 0.4 OUTLIER -108.63 144.55 36.22 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.951 0.405 . . . . 0.0 111.049 -179.46 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 . . . . . 0 N--CA 1.469 0.496 0 CA-C-O 121.171 0.51 . . . . 0.0 111.142 -178.528 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 37.8 pt . . . . . 0 CA--C 1.517 -0.313 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.56 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 3.9 mppt? -77.99 151.88 33.38 Favored 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.187 177.381 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.1 ptt180 -68.06 -14.37 62.92 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 121.378 0.609 . . . . 0.0 110.9 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 76.4 t60 -107.34 -1.62 21.44 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 122.289 1.042 . . . . 0.0 108.645 -178.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.521 ' OG1' ' HE2' ' A' ' 35' ' ' LYS . 1.3 m -86.63 139.34 33.41 Favored Pre-proline 0 N--CA 1.432 -1.362 0 CA-C-N 114.548 -1.205 . . . . 0.0 109.73 178.702 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -59.99 119.31 6.44 Favored 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 122.356 2.038 . . . . 0.0 112.397 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.525 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.7 pt? -67.82 -16.74 64.25 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.515 0.674 . . . . 0.0 110.58 179.296 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 14.4 p -52.25 -28.83 20.22 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.223 177.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.2 mtpt -62.25 -46.96 86.47 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 121.101 0.477 . . . . 0.0 109.739 178.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.8 pp -72.88 -37.52 67.28 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 120.881 0.372 . . . . 0.0 110.265 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 62.7 mtm -61.49 -43.78 98.25 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 120.922 0.391 . . . . 0.0 111.363 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.53 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 43.3 mttp -69.53 -37.63 77.2 Favored 'General case' 0 CA--C 1.514 -0.422 0 O-C-N 122.071 -0.393 . . . . 0.0 110.751 177.607 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.93 -35.49 80.85 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.146 0.498 . . . . 0.0 109.824 -179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -61.73 -54.74 38.48 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.602 178.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.629 ' SG ' HD11 ' A' ' 58' ' ' ILE . 19.5 m -58.77 -39.18 80.26 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.054 0.454 . . . . 0.0 110.447 -179.115 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.53 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 67.2 mt-10 -62.09 -49.33 76.38 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.115 0.483 . . . . 0.0 111.729 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -74.89 -36.63 62.24 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.087 0.402 . . . . 0.0 112.087 -176.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -78.09 -21.19 50.86 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -178.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.46 41.65 6.83 Favored Glycine 0 N--CA 1.431 -1.686 0 C-N-CA 119.905 -1.14 . . . . 0.0 111.271 -178.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -127.64 170.38 12.74 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.453 ' HB2' ' OE1' ' A' ' 57' ' ' GLN . 50.0 m -124.71 157.56 35.36 Favored 'General case' 0 C--N 1.311 -1.088 0 O-C-N 122.303 -0.248 . . . . 0.0 110.491 177.766 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 12.1 mmt -60.73 -28.91 69.04 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-O 121.327 0.584 . . . . 0.0 111.784 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.464 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.36 -16.07 41.12 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.401 0.62 . . . . 0.0 110.634 178.694 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.453 ' OE1' ' HB2' ' A' ' 54' ' ' SER . 1.3 mp0 -90.82 -25.13 20.07 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.782 -177.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.629 HD11 ' SG ' ' A' ' 48' ' ' CYS . 12.7 pt -135.27 177.94 6.02 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.069 0 CA-C-O 120.933 0.397 . . . . 0.0 110.761 -178.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.416 ' CG ' ' HG3' ' A' ' 89' ' ' GLN . 15.0 mmt180 -150.54 139.61 21.08 Favored 'General case' 0 CA--C 1.501 -0.924 0 CA-C-O 121.341 0.591 . . . . 0.0 111.081 178.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -97.91 141.23 31.14 Favored 'General case' 0 N--CA 1.438 -1.033 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.685 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.46 ' HG2' ' N ' ' A' ' 62' ' ' PHE . 8.4 tmm_? -143.48 145.58 32.71 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 121.247 0.546 . . . . 0.0 110.94 -179.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.46 ' N ' ' HG2' ' A' ' 61' ' ' ARG . 86.1 t80 -151.13 148.74 28.65 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.657 179.029 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 19.5 t70 58.4 22.08 9.09 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.753 0.787 . . . . 0.0 110.123 -178.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.0 4.44 88.73 Favored Glycine 0 N--CA 1.43 -1.765 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.662 -178.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.416 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 12.0 pt20 -121.39 143.58 37.98 Favored Pre-proline 0 N--CA 1.444 -0.738 0 O-C-N 122.071 -0.664 . . . . 0.0 110.11 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 65' ' ' GLN . 23.3 Cg_exo -61.71 141.1 89.56 Favored 'Trans proline' 0 C--N 1.329 -0.457 0 C-N-CA 122.848 2.366 . . . . 0.0 112.091 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.452 HD13 ' HB2' ' A' ' 62' ' ' PHE . 41.2 mt -96.78 146.84 6.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 120.859 0.362 . . . . 0.0 110.146 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -114.5 163.01 15.96 Favored 'General case' 0 CA--C 1.5 -0.959 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 176.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -79.04 -11.22 59.99 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 120.106 -0.638 . . . . 0.0 110.597 179.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 35.0 p -84.76 -11.99 54.64 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.72 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.56 165.74 16.82 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -178.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -121.54 153.37 59.25 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.217 173.433 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.427 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 12.2 Cg_endo -57.38 -30.2 87.03 Favored 'Trans proline' 0 C--O 1.236 0.424 0 C-N-CA 122.779 2.319 . . . . 0.0 112.137 -179.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.27 -20.73 62.19 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.163 0.506 . . . . 0.0 111.64 -179.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -69.16 -39.1 78.99 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.318 0.58 . . . . 0.0 110.863 179.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.1 mp -86.92 2.86 47.89 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.143 -178.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 57.02 31.08 19.28 Favored 'General case' 0 C--N 1.349 0.567 0 CA-C-O 121.51 0.671 . . . . 0.0 111.193 178.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.427 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.8 ptm -79.06 164.73 24.09 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.769 -178.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -121.89 172.69 8.0 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.578 -176.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -63.06 145.31 55.73 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-O 121.528 0.68 . . . . 0.0 111.835 177.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 71.16 16.33 6.3 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 114.57 -1.196 . . . . 0.0 111.492 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.4 ' OD1' ' CE1' ' A' ' 62' ' ' PHE . 11.2 t70 -70.79 153.95 42.29 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.156 175.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 19.7 m -112.99 134.99 54.25 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-O 121.454 0.645 . . . . 0.0 112.367 -177.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.404 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 39.2 mm -98.48 145.28 10.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 123.372 0.669 . . . . 0.0 110.089 -179.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -100.27 117.04 33.65 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 122.316 0.246 . . . . 0.0 110.852 179.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 86.4 t -115.37 136.02 53.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-O 121.298 0.57 . . . . 0.0 111.285 177.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -134.05 153.18 51.97 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.061 -178.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -79.47 115.33 19.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.312 0.577 . . . . 0.0 111.623 -178.273 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.416 ' HG3' ' CG ' ' A' ' 59' ' ' ARG . 51.8 mm-40 . . . . . 0 C--N 1.314 -0.967 0 CA-C-O 121.485 0.659 . . . . 0.0 110.716 177.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 33.2 p-80 . . . . . 0 N--CA 1.444 -0.726 0 CA-C-O 121.13 0.491 . . . . 0.0 111.54 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 31.0 pt -130.29 170.85 18.54 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.908 -177.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -105.21 136.23 45.09 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -128.21 136.6 51.31 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 121.01 0.433 . . . . 0.0 109.879 178.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 83' ' ' THR . 52.2 mtmt -120.29 146.46 46.07 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.016 0.436 . . . . 0.0 109.911 179.666 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.609 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 3.8 p -124.56 132.6 71.1 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.615 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.832 -178.28 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -119.26 127.67 53.46 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 121.234 0.54 . . . . 0.0 110.36 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -103.0 147.39 16.89 Favored Glycine 0 N--CA 1.433 -1.556 0 C-N-CA 121.019 -0.61 . . . . 0.0 111.943 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.477 ' HG3' ' HA ' ' A' ' 87' ' ' PHE . 0.0 OUTLIER -51.93 -24.49 6.49 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 177.89 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -75.04 -18.17 60.37 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.218 0.532 . . . . 0.0 110.734 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 106.01 27.4 5.67 Favored Glycine 0 CA--C 1.499 -0.965 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.088 175.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.406 ' HB3' ' OE1' ' A' ' 51' ' ' GLN . 71.0 m -111.29 147.63 34.67 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 120.656 0.265 . . . . 0.0 110.491 179.389 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.609 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.4 p -145.81 132.33 14.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.188 0.518 . . . . 0.0 111.667 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 t -124.15 139.66 49.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -108.03 142.4 38.26 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.816 0.341 . . . . 0.0 110.771 179.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 . . . . . 0 N--CA 1.468 0.449 0 CA-C-O 121.37 0.605 . . . . 0.0 111.797 -177.566 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 29.1 pt . . . . . 0 CA--C 1.517 -0.325 0 CA-C-O 121.014 0.435 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.431 ' HB2' ' HB ' ' A' ' 38' ' ' THR . 36.0 mtmm -74.72 147.15 41.64 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 178.766 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.9 ptt180 -71.24 -13.16 61.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.682 0.753 . . . . 0.0 110.243 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 -100.52 -5.64 26.64 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -178.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.431 ' HB ' ' HB2' ' A' ' 35' ' ' LYS . 1.0 OUTLIER -94.8 141.89 23.95 Favored Pre-proline 0 N--CA 1.445 -0.719 0 CA-C-N 114.763 -1.108 . . . . 0.0 109.73 179.758 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -63.09 128.92 24.14 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.257 1.971 . . . . 0.0 112.375 -179.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.521 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.1 pt? -69.26 -17.29 63.74 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.692 0.758 . . . . 0.0 110.446 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.414 ' N ' HD22 ' A' ' 40' ' ' LEU . 0.9 OUTLIER -51.73 -28.96 16.72 Favored 'General case' 0 C--N 1.31 -1.111 0 C-N-CA 124.43 1.092 . . . . 0.0 111.204 178.57 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 51.5 mtpt -63.38 -43.14 98.47 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.897 179.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.3 pp -73.04 -38.64 66.43 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 120.938 0.399 . . . . 0.0 109.985 178.629 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 59.7 mtm -60.74 -49.41 77.59 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 121.049 0.452 . . . . 0.0 111.108 -179.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.445 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 47.7 mtpt -68.67 -35.36 77.12 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.821 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.49 ' O ' ' HG2' ' A' ' 50' ' ' ARG . . . -63.86 -38.03 89.58 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.055 0.455 . . . . 0.0 110.004 178.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -57.02 -56.34 22.98 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.849 178.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.48 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 26.1 p -63.46 -37.62 87.99 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.869 0.366 . . . . 0.0 111.45 -177.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.445 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 44.8 mt-10 -67.61 -36.45 80.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.788 0.328 . . . . 0.0 111.732 -179.416 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.502 ' HG3' HE21 ' A' ' 51' ' ' GLN . 14.2 ptm180 -85.23 -37.39 20.14 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 121.96 -0.462 . . . . 0.0 111.695 -179.382 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.502 HE21 ' HG3' ' A' ' 50' ' ' ARG . 21.5 mm-40 -77.67 -21.88 51.44 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -176.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 92.45 37.14 5.96 Favored Glycine 0 N--CA 1.439 -1.165 0 C-N-CA 120.281 -0.962 . . . . 0.0 111.173 -178.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.48 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 4.0 mm? -122.25 162.99 20.42 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -179.641 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.449 ' HB2' ' HB2' ' A' ' 57' ' ' GLN . 16.6 m -116.72 152.83 33.49 Favored 'General case' 0 C--N 1.312 -1.036 0 O-C-N 122.017 -0.427 . . . . 0.0 110.556 178.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 11.9 mmt -63.73 -25.9 68.41 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.542 0.687 . . . . 0.0 111.283 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.573 ' HG2' ' NE2' ' A' ' 57' ' ' GLN . 0.0 OUTLIER -85.56 -16.79 38.25 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.325 0.583 . . . . 0.0 110.735 177.133 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.573 ' NE2' ' HG2' ' A' ' 56' ' ' ARG . 2.7 mp0 -93.31 -27.04 17.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.8 -179.357 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.6 pt -129.86 -179.12 2.92 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-O 121.062 0.458 . . . . 0.0 111.266 -179.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.461 ' HA ' ' HD3' ' A' ' 59' ' ' ARG . 8.3 mmt180 -158.17 143.29 16.57 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.851 177.609 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -100.74 145.55 28.35 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.621 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.2 ttt180 -142.48 148.08 37.11 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 120.884 0.373 . . . . 0.0 110.547 -178.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.44 ' HB2' HD13 ' A' ' 67' ' ' ILE . 73.8 t80 -152.72 143.69 23.01 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 178.292 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.0 t70 54.92 23.91 5.42 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.509 0.724 . . . . 0.0 111.244 -178.162 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.92 -23.34 20.91 Favored Glycine 0 N--CA 1.435 -1.427 0 C-N-CA 120.906 -0.664 . . . . 0.0 112.679 -178.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.43 HE21 HD21 ' A' ' 76' ' ' LEU . 9.7 pt20 -94.18 150.4 38.3 Favored Pre-proline 0 C--N 1.315 -0.912 0 O-C-N 122.516 -0.402 . . . . 0.0 110.954 -178.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -72.47 143.32 38.36 Favored 'Trans proline' 0 N--CA 1.462 -0.326 0 C-N-CA 122.434 2.089 . . . . 0.0 111.575 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.44 HD13 ' HB2' ' A' ' 62' ' ' PHE . 38.4 mt -93.31 143.08 12.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-O 120.977 0.417 . . . . 0.0 110.296 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -114.07 157.5 22.47 Favored 'General case' 0 CA--C 1.499 -0.985 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 178.037 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -74.11 -12.04 60.48 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-O 121.24 0.543 . . . . 0.0 110.445 178.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.6 p -95.11 6.28 49.5 Favored 'General case' 0 N--CA 1.438 -1.033 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 178.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -100.13 162.12 13.17 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.974 0.416 . . . . 0.0 111.238 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -116.18 155.34 48.31 Favored Pre-proline 0 C--N 1.318 -0.765 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.149 176.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -61.12 -34.6 89.27 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.715 2.277 . . . . 0.0 111.779 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.72 -10.94 60.0 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.288 -179.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -77.05 -40.74 45.19 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 121.351 0.596 . . . . 0.0 109.758 179.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.43 HD21 HE21 ' A' ' 65' ' ' GLN . 0.3 OUTLIER -85.47 12.22 8.9 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.197 -179.604 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 43.61 43.69 4.86 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.293 1.037 . . . . 0.0 112.134 178.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.2 ptm -86.81 164.89 16.4 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.461 -178.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -117.68 167.82 11.0 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.86 0.362 . . . . 0.0 110.399 -178.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -60.96 142.74 56.23 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.639 0.733 . . . . 0.0 112.171 177.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 73.82 16.51 3.74 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 124.856 1.263 . . . . 0.0 111.506 178.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -77.47 162.09 27.44 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 177.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' THR . . . . . 0.446 ' HA ' ' O ' ' A' ' 21' ' ' LYS . 37.1 m -116.34 139.01 50.86 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 121.661 0.743 . . . . 0.0 112.953 -175.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 44.6 mm -98.48 143.02 13.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.538 178.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -102.39 122.08 43.58 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.847 0.356 . . . . 0.0 110.702 178.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.461 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 76.7 t -115.0 137.86 47.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.717 0 CA-C-O 121.17 0.51 . . . . 0.0 110.932 178.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . 0.477 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 5.3 p90 -136.26 153.04 51.31 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.458 -179.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -80.98 113.56 19.27 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.354 0.597 . . . . 0.0 111.479 -177.189 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 75.9 mm-40 . . . . . 0 C--N 1.314 -0.973 0 CA-C-O 121.359 0.599 . . . . 0.0 110.083 176.974 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 15.9 p-80 . . . . . 0 N--CA 1.454 -0.24 0 CA-C-O 120.96 0.409 . . . . 0.0 110.922 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 44.3 pt -129.54 166.95 25.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 121.435 0.636 . . . . 0.0 111.656 -175.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.496 ' HA ' ' O ' ' A' ' 32' ' ' PHE . 16.5 t-20 -97.29 139.94 32.51 Favored 'General case' 0 CA--C 1.506 -0.712 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.872 178.601 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.408 HD13 ' O ' ' A' ' 19' ' ' ASN . 3.0 mm? -130.93 139.98 50.13 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 176.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 47.3 mtmt -125.38 145.28 50.12 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-O 121.07 0.462 . . . . 0.0 110.515 -179.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.651 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 2.5 p -126.23 131.79 71.17 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.638 -178.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -112.57 131.71 55.48 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-O 121.195 0.522 . . . . 0.0 110.884 -178.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -96.94 176.44 31.97 Favored Glycine 0 N--CA 1.438 -1.178 0 CA-C-N 116.24 -0.437 . . . . 0.0 112.483 -179.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.565 ' NE2' ' H ' ' A' ' 25' ' ' GLN . 0.3 OUTLIER -69.39 -24.58 63.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.738 0.78 . . . . 0.0 110.739 -177.894 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -83.93 -4.76 58.95 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.86 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.53 3.57 64.61 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.515 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.5 t -77.58 156.02 31.14 Favored 'General case' 0 C--N 1.322 -0.63 0 O-C-N 122.357 -0.496 . . . . 0.0 109.692 178.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.651 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.5 p -149.3 136.61 13.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-O 121.01 0.433 . . . . 0.0 110.587 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.5 t -119.89 136.57 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.72 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -108.32 143.42 37.22 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.016 0.436 . . . . 0.0 110.785 -179.399 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.496 ' O ' ' HA ' ' A' ' 19' ' ' ASN . 11.4 m-85 . . . . . 0 N--CA 1.467 0.424 0 CA-C-O 121.085 0.469 . . . . 0.0 110.952 -178.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 31.9 pt . . . . . 0 CA--C 1.518 -0.254 0 CA-C-O 120.853 0.359 . . . . 0.0 110.468 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 32.0 mtmm -75.27 146.85 40.73 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 120.833 0.349 . . . . 0.0 110.604 178.221 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 5.7 ppt_? -71.39 -11.1 60.72 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.435 0.636 . . . . 0.0 110.891 179.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -101.94 -4.07 26.76 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.428 ' HB ' ' O ' ' A' ' 35' ' ' LYS . 1.3 m -92.36 137.33 24.72 Favored Pre-proline 0 N--CA 1.44 -0.94 0 CA-C-N 114.441 -1.254 . . . . 0.0 109.918 178.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -60.45 130.61 34.44 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.599 2.2 . . . . 0.0 112.443 -179.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.464 HD11 ' N ' ' A' ' 41' ' ' SER . 1.2 pp -70.18 -17.34 63.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.154 -0.475 . . . . 0.0 112.011 -179.215 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.464 ' N ' HD11 ' A' ' 40' ' ' LEU . 3.8 p -53.49 -28.58 31.64 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.94 -179.645 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 29.5 mtpp -59.6 -47.38 85.79 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.281 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.8 pp -73.75 -36.28 65.11 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.797 -179.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 39.8 mtm -63.03 -49.41 74.7 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 121.068 0.461 . . . . 0.0 111.02 -178.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.454 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 42.9 mtpt -69.53 -33.32 72.62 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.919 0.39 . . . . 0.0 110.604 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.0 -36.53 84.29 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.302 0.572 . . . . 0.0 109.659 177.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -59.23 -54.31 48.34 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.762 177.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.492 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 24.2 p -65.18 -35.2 80.34 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 122.15 -0.344 . . . . 0.0 111.211 -177.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.454 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 45.0 mt-10 -65.49 -42.1 92.54 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 120.762 0.315 . . . . 0.0 111.359 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -80.08 -33.28 38.99 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 120.969 0.414 . . . . 0.0 111.723 -178.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.9 mm-40 -81.84 -22.13 37.19 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -177.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.411 ' C ' HD22 ' A' ' 53' ' ' LEU . . . 88.42 39.57 6.73 Favored Glycine 0 N--CA 1.437 -1.239 0 C-N-CA 119.858 -1.163 . . . . 0.0 111.113 -177.339 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.492 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 4.0 mm? -125.73 168.05 14.31 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.04 0.448 . . . . 0.0 110.104 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.5 m -125.26 158.65 33.6 Favored 'General case' 0 C--N 1.312 -1.025 0 O-C-N 122.142 -0.349 . . . . 0.0 110.72 177.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 18.2 mmt -64.99 -25.29 67.8 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-O 121.367 0.603 . . . . 0.0 111.69 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.97 -14.74 43.71 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.525 0.679 . . . . 0.0 110.819 176.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -94.33 -26.62 16.49 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.087 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.7 pt -132.46 179.02 4.79 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-O 121.071 0.462 . . . . 0.0 110.942 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.41 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 3.8 mmt85 -153.81 140.54 19.02 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.602 178.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -99.59 139.85 34.64 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.333 -179.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.11 136.08 24.73 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.249 0.547 . . . . 0.0 110.607 -177.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.479 ' HB2' HD13 ' A' ' 67' ' ' ILE . 85.7 t80 -141.29 146.86 37.31 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.001 -179.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 52.0 25.79 3.36 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.576 0.75 . . . . 0.0 111.82 -179.077 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.8 -11.67 68.1 Favored Glycine 0 N--CA 1.44 -1.098 0 C-N-CA 120.836 -0.697 . . . . 0.0 113.542 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.418 HE21 HD22 ' A' ' 76' ' ' LEU . 10.8 pt20 -109.01 150.37 40.85 Favored Pre-proline 0 C--N 1.319 -0.733 0 O-C-N 122.118 -0.636 . . . . 0.0 111.075 -179.358 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -71.98 139.81 33.68 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 122.613 2.208 . . . . 0.0 111.724 179.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.479 HD13 ' HB2' ' A' ' 62' ' ' PHE . 21.0 mt -94.75 146.92 6.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-O 120.94 0.4 . . . . 0.0 110.325 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -117.36 162.34 18.08 Favored 'General case' 0 CA--C 1.497 -1.072 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 176.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.412 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 10.0 pt-20 -70.7 -16.16 62.77 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-O 121.473 0.654 . . . . 0.0 110.489 178.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 17.3 p -86.6 -13.93 44.29 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -177.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.06 160.42 19.3 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 121.508 0.67 . . . . 0.0 112.518 -177.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -113.16 154.99 45.03 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.644 178.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.37 -29.57 90.52 Favored 'Trans proline' 0 CA--C 1.531 0.359 0 C-N-CA 123.005 2.47 . . . . 0.0 111.785 178.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -75.78 -19.04 59.29 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.202 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -68.6 -42.64 77.88 Favored 'General case' 0 CA--C 1.51 -0.588 0 CA-C-O 121.726 0.774 . . . . 0.0 109.831 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.418 HD22 HE21 ' A' ' 65' ' ' GLN . 0.4 OUTLIER -85.31 6.84 24.55 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.594 -179.792 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 43.39 43.22 4.2 Favored 'General case' 0 C--N 1.359 1.018 0 C-N-CA 124.381 1.073 . . . . 0.0 111.995 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.4 ptm -83.38 169.64 15.38 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.677 -178.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.437 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 12.5 pt-20 -117.2 168.3 10.43 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 110.097 -0.335 . . . . 0.0 110.097 -179.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -58.95 142.86 49.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.52 0.676 . . . . 0.0 111.842 175.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 73.62 16.02 3.97 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 124.674 1.189 . . . . 0.0 111.902 179.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.437 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 1.5 t0 -73.63 155.5 38.97 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.211 -0.596 . . . . 0.0 109.631 178.434 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 34.7 m -111.58 136.87 50.18 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.636 0.732 . . . . 0.0 112.746 -174.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 43.1 mm -99.52 138.61 23.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.765 178.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -98.22 120.44 38.63 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.817 0.342 . . . . 0.0 110.324 178.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.41 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 96.7 t -113.04 138.73 41.46 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.081 0 CA-C-O 121.064 0.459 . . . . 0.0 109.899 177.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 14.8 p90 -137.28 153.27 50.36 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.016 -179.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -80.03 116.6 20.25 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.364 0.602 . . . . 0.0 112.039 -176.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 71.1 mm-40 . . . . . 0 C--N 1.323 -0.558 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.63 176.675 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.479 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 56.6 p-80 . . . . . 0 N--CA 1.445 -0.723 0 CA-C-O 120.966 0.413 . . . . 0.0 110.635 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 40.3 pt -131.19 169.39 21.79 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.078 0 CA-C-O 121.364 0.602 . . . . 0.0 110.885 -178.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -103.49 139.73 38.45 Favored 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 177.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -126.75 136.97 53.13 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 177.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.458 ' HG2' ' HG3' ' A' ' 31' ' ' GLN . 52.1 mtmt -124.12 139.08 54.28 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.269 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.544 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 61.0 t -124.65 130.58 73.4 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.387 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -175.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -115.56 135.82 53.7 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 -178.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -121.46 162.0 15.35 Favored Glycine 0 N--CA 1.445 -0.763 0 C-N-CA 120.449 -0.881 . . . . 0.0 112.871 -178.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.526 ' HG2' ' HA ' ' A' ' 87' ' ' PHE . 22.8 mm-40 -66.17 -11.73 51.3 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.503 0.668 . . . . 0.0 110.397 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -78.23 6.82 7.35 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.431 179.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 72.82 36.36 57.83 Favored Glycine 0 C--N 1.338 0.658 0 C-N-CA 120.696 -0.764 . . . . 0.0 113.405 178.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.4 t -143.24 160.92 39.57 Favored 'General case' 0 C--N 1.314 -0.948 0 O-C-N 122.14 -0.623 . . . . 0.0 111.35 -179.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.544 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.8 p -149.32 139.12 16.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.39 -179.027 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.9 t -124.31 142.46 41.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 O-C-N 122.119 -0.363 . . . . 0.0 110.43 -179.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.458 ' HG3' ' HG2' ' A' ' 21' ' ' LYS . 0.7 OUTLIER -107.98 141.15 40.07 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 120.916 0.389 . . . . 0.0 110.997 179.092 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 . . . . . 0 N--CA 1.47 0.556 0 CA-C-O 120.921 0.391 . . . . 0.0 111.111 -178.283 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 30.2 pt . . . . . 0 CA--C 1.514 -0.425 0 CA-C-O 121.086 0.469 . . . . 0.0 110.263 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.479 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 36.9 mtmm -75.73 139.57 41.95 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 177.237 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 8.1 ppt_? -69.32 -11.99 61.29 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.448 0.642 . . . . 0.0 110.608 179.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 15.2 t-160 -99.23 2.53 45.75 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 122.181 0.991 . . . . 0.0 108.503 179.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.45 ' HB ' ' HB2' ' A' ' 35' ' ' LYS . 0.9 OUTLIER -103.4 143.29 26.32 Favored Pre-proline 0 N--CA 1.447 -0.599 0 CA-C-N 114.805 -1.089 . . . . 0.0 109.831 178.635 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -60.83 130.08 31.59 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 122.691 2.26 . . . . 0.0 112.493 -179.159 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.543 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.3 pp -70.34 -16.25 62.96 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.09 -0.504 . . . . 0.0 112.014 -179.41 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.448 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 0.1 OUTLIER -51.45 -29.6 16.79 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 122.955 0.502 . . . . 0.0 111.847 179.994 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -61.09 -47.85 84.41 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.222 0.534 . . . . 0.0 110.317 179.028 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.4 pp -73.5 -32.31 64.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.821 -178.724 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 46.7 mtm -62.76 -50.28 71.67 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.006 0.432 . . . . 0.0 111.018 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.442 ' HA ' ' SG ' ' A' ' 48' ' ' CYS . 81.0 mttt -66.97 -33.95 76.7 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.104 178.484 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.72 -35.88 82.47 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.169 0.509 . . . . 0.0 109.936 179.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -62.61 -56.63 16.07 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.544 178.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.502 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 26.3 p -62.1 -36.25 81.16 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.728 0.299 . . . . 0.0 111.649 -177.326 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -64.23 -44.32 92.22 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 120.905 0.383 . . . . 0.0 111.605 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 14.0 ptm180 -80.57 -32.01 36.68 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.047 0.451 . . . . 0.0 111.464 -177.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -80.91 -23.32 39.03 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.114 0.483 . . . . 0.0 112.006 -178.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.59 36.07 8.18 Favored Glycine 0 C--N 1.306 -1.084 0 C-N-CA 120.321 -0.943 . . . . 0.0 111.483 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.502 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 3.8 mm? -119.86 160.52 22.49 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 178.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.405 ' HB2' ' OE1' ' A' ' 57' ' ' GLN . 67.3 m -114.33 157.69 22.46 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 122.162 -0.336 . . . . 0.0 110.227 179.138 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.458 ' HE2' ' SG ' ' A' ' 48' ' ' CYS . 16.7 mmt -64.66 -27.57 69.01 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.264 0.554 . . . . 0.0 111.208 -179.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.406 ' HD2' ' H ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -86.24 -7.59 58.42 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.427 0.632 . . . . 0.0 110.29 177.021 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.405 ' OE1' ' HB2' ' A' ' 54' ' ' SER . 0.9 OUTLIER -97.84 -19.83 17.9 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.59 -178.989 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.479 HG22 HE21 ' A' ' 88' ' ' GLN . 14.8 pt -144.88 -177.39 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 CA-C-O 121.102 0.477 . . . . 0.0 111.241 -177.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 16.8 mmt180 -155.58 141.45 18.12 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.56 177.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -96.63 139.82 32.14 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 178.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -140.4 139.83 35.37 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.245 0.545 . . . . 0.0 110.905 -178.153 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.45 ' HB2' HD12 ' A' ' 67' ' ' ILE . 64.3 t80 -144.88 147.01 32.29 Favored 'General case' 0 C--O 1.21 -1.017 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.956 178.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.8 t70 57.0 23.45 8.36 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 121.633 0.73 . . . . 0.0 110.805 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.6 -2.69 86.95 Favored Glycine 0 N--CA 1.429 -1.791 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.816 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -115.14 148.74 41.3 Favored Pre-proline 0 C--N 1.323 -0.549 0 O-C-N 122.293 -0.534 . . . . 0.0 110.645 -179.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -69.33 142.94 51.29 Favored 'Trans proline' 0 C--O 1.236 0.392 0 C-N-CA 122.323 2.015 . . . . 0.0 111.836 179.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.45 HD12 ' HB2' ' A' ' 62' ' ' PHE . 32.4 mt -96.4 146.24 7.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.972 0.415 . . . . 0.0 110.53 -179.422 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -126.21 170.32 11.95 Favored 'General case' 0 CA--C 1.504 -0.81 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 178.399 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.448 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 11.2 pt-20 -70.32 -19.04 63.1 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-O 120.982 0.42 . . . . 0.0 111.657 -179.663 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.3 t -90.93 3.67 54.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.193 0.521 . . . . 0.0 111.288 -178.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.7 142.09 28.41 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-O 121.423 0.63 . . . . 0.0 111.412 178.172 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.689 ' HB ' ' OE1' ' A' ' 75' ' ' GLN . 1.1 m -112.48 140.69 24.07 Favored Pre-proline 0 C--N 1.317 -0.82 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.464 ' HD2' ' CG2' ' A' ' 72' ' ' THR . 15.7 Cg_endo -54.23 -33.75 76.55 Favored 'Trans proline' 0 N--CA 1.481 0.76 0 C-N-CA 123.478 2.785 . . . . 0.0 113.244 -176.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.45 -27.12 64.97 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.0 0.429 . . . . 0.0 111.574 -178.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.689 ' OE1' ' HB ' ' A' ' 72' ' ' THR . 5.9 mp0 -68.29 -32.61 72.88 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.053 0.454 . . . . 0.0 111.564 -178.855 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -92.58 10.07 31.94 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.005 0.431 . . . . 0.0 110.045 179.9 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 43.62 41.16 3.32 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.598 1.159 . . . . 0.0 112.264 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.41 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 5.9 ptm -80.3 163.62 23.8 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.5 -178.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -107.48 165.96 11.02 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.129 -177.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -59.48 143.23 50.58 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 121.448 0.642 . . . . 0.0 110.802 171.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 69.55 19.15 7.55 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.032 -0.985 . . . . 0.0 111.67 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -62.49 149.27 43.28 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.186 176.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.0 m -102.05 122.09 43.44 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 121.597 0.713 . . . . 0.0 112.052 -177.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.528 HG13 HG23 ' A' ' 22' ' ' VAL . 14.0 mm -93.22 139.15 18.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.658 179.033 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -97.57 118.79 34.87 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 120.989 0.423 . . . . 0.0 110.687 179.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 43.5 t -114.06 133.11 61.1 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 CA-C-O 121.406 0.622 . . . . 0.0 110.114 176.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . 0.526 ' HA ' ' HG2' ' A' ' 25' ' ' GLN . 24.2 p90 -134.39 153.37 51.94 Favored 'General case' 0 C--N 1.3 -1.587 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.431 -178.355 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.479 HE21 HG22 ' A' ' 58' ' ' ILE . 0.6 OUTLIER -62.27 157.9 18.5 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-O 121.12 0.486 . . . . 0.0 110.747 179.711 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.446 ' HG2' ' O ' ' A' ' 88' ' ' GLN . 35.0 mm-40 . . . . . 0 C--N 1.321 -0.646 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.696 -177.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 11.5 p-80 . . . . . 0 N--CA 1.447 -0.612 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 43.5 pt -128.01 167.47 23.01 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.072 0 CA-C-O 121.105 0.478 . . . . 0.0 111.036 -176.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.49 ' HA ' ' O ' ' A' ' 32' ' ' PHE . 45.1 t-20 -107.18 128.03 54.05 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.719 -0.475 . . . . 0.0 109.719 179.412 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -118.64 134.06 55.39 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 178.156 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.4 mtmp? -115.37 149.18 38.35 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-O 120.999 0.428 . . . . 0.0 109.979 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.691 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 2.7 p -125.15 129.01 73.3 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.011 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.693 -177.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -110.64 120.84 43.72 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.058 0.456 . . . . 0.0 109.836 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.479 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -92.88 156.07 22.81 Favored Glycine 0 N--CA 1.427 -1.946 0 C-N-CA 120.575 -0.822 . . . . 0.0 112.837 -178.673 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.56 -13.42 1.56 Allowed 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 178.562 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -90.3 -13.3 35.54 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.131 0.491 . . . . 0.0 110.728 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 104.94 6.56 39.82 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 121.01 -0.614 . . . . 0.0 112.225 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 40.1 t -89.83 155.53 19.1 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 120.821 0.343 . . . . 0.0 110.421 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.691 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.7 p -147.95 134.59 13.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 CA-C-O 121.096 0.474 . . . . 0.0 110.714 178.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.5 t -122.22 139.23 49.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -107.74 142.79 37.2 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 120.741 0.305 . . . . 0.0 110.907 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.49 ' O ' ' HA ' ' A' ' 19' ' ' ASN . 10.1 m-85 . . . . . 0 N--CA 1.476 0.86 0 CA-C-O 121.318 0.58 . . . . 0.0 111.587 -178.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 39.9 pt . . . . . 0 CA--C 1.515 -0.381 0 CA-C-O 120.965 0.412 . . . . 0.0 110.594 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.9 mtmm -87.66 150.14 23.83 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 120.923 0.392 . . . . 0.0 110.421 178.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.411 ' O ' ' HG2' ' A' ' 73' ' ' PRO . 23.8 ptt180 -62.68 -24.33 67.58 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.488 0.661 . . . . 0.0 111.099 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 14.6 t60 -103.11 1.72 33.67 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.883 0.849 . . . . 0.0 109.594 -177.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.1 m -92.56 139.35 23.7 Favored Pre-proline 0 C--N 1.31 -1.123 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.878 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.76 128.64 19.32 Favored 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 121.934 1.756 . . . . 0.0 112.185 -177.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.517 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.0 OUTLIER -66.83 -16.86 64.57 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.01 -179.445 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.526 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 1.0 OUTLIER -52.14 -29.87 24.01 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.921 0.391 . . . . 0.0 111.882 179.607 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 35.3 mtpt -62.83 -44.58 95.75 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-O 120.996 0.427 . . . . 0.0 110.417 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.9 pp -73.47 -33.9 65.09 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 120.896 0.379 . . . . 0.0 110.29 178.71 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 47.8 mtm -62.12 -49.31 76.4 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 121.32 0.581 . . . . 0.0 110.411 -179.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -68.65 -35.3 77.07 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.073 178.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.13 -33.13 75.06 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.309 0.576 . . . . 0.0 109.826 178.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 62.3 t80 -63.72 -55.19 25.2 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.797 178.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.419 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 25.3 p -63.13 -35.82 81.56 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.803 0.335 . . . . 0.0 110.922 -178.082 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -61.75 -48.63 79.83 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 121.035 0.445 . . . . 0.0 111.422 178.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -76.72 -31.08 56.92 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.967 0.413 . . . . 0.0 111.383 -177.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -82.77 -21.96 34.47 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 -178.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 93.75 8.13 60.95 Favored Glycine 0 CA--C 1.523 0.561 0 C-N-CA 120.268 -0.968 . . . . 0.0 113.319 179.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.419 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 3.2 mm? -97.98 173.74 6.91 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 122.205 -0.585 . . . . 0.0 111.01 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 71.7 m -122.27 157.8 30.91 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 120.719 0.295 . . . . 0.0 111.154 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.7 mmt -63.7 -27.28 69.1 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.118 0.485 . . . . 0.0 112.247 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.73 -12.61 53.42 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.636 0.731 . . . . 0.0 109.944 177.531 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -93.66 -30.97 14.65 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.699 -177.721 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 9.6 pt -132.56 177.34 7.26 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-O 121.132 0.492 . . . . 0.0 111.5 -177.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.404 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 12.9 mmt180 -150.1 143.77 25.3 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.164 179.407 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -100.9 141.44 33.78 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.705 179.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -142.99 139.34 30.59 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-O 121.19 0.519 . . . . 0.0 111.118 -177.002 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.444 ' HB2' HD13 ' A' ' 67' ' ' ILE . 72.5 t80 -144.61 145.92 32.03 Favored 'General case' 0 C--O 1.214 -0.767 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 16.7 t70 57.43 23.44 9.04 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 121.885 0.85 . . . . 0.0 109.962 -178.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.77 -25.88 8.05 Favored Glycine 0 N--CA 1.426 -1.977 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.548 -178.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -90.25 149.26 40.95 Favored Pre-proline 0 C--N 1.323 -0.561 0 O-C-N 122.582 -0.363 . . . . 0.0 111.301 -177.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -71.7 141.58 37.98 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 122.206 1.938 . . . . 0.0 111.391 178.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.444 HD13 ' HB2' ' A' ' 62' ' ' PHE . 39.0 mt -91.9 149.27 4.18 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-O 120.964 0.411 . . . . 0.0 110.905 -177.657 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -115.53 175.57 5.46 Favored 'General case' 0 CA--C 1.502 -0.903 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 177.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.526 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 0.2 OUTLIER -77.5 -20.67 53.96 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-O 121.503 0.668 . . . . 0.0 110.223 179.423 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.8 t -95.22 8.59 42.6 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.843 0.83 . . . . 0.0 110.529 -178.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -78.49 134.97 37.26 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.0 178.006 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.27 137.42 21.52 Favored Pre-proline 0 C--N 1.311 -1.074 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.035 176.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.612 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 10.9 Cg_endo -55.81 -34.13 90.31 Favored 'Trans proline' 0 C--O 1.236 0.375 0 C-N-CA 123.027 2.485 . . . . 0.0 112.477 -177.622 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.25 -17.39 61.34 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.795 -179.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.6 -33.66 53.7 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.916 0.388 . . . . 0.0 110.98 -179.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -89.86 -2.85 58.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.24 0.543 . . . . 0.0 109.974 178.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 57.01 36.75 28.18 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.862 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.612 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.9 ptm -76.27 160.83 29.28 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.635 -178.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.473 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 12.3 pt-20 -112.51 166.11 11.62 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-O 120.854 0.359 . . . . 0.0 110.469 -177.285 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -62.76 148.27 47.26 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 121.343 0.592 . . . . 0.0 110.975 174.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 73.07 13.52 4.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.424 -179.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.473 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 2.2 t0 -74.66 158.66 33.23 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.798 -0.361 . . . . 0.0 110.154 178.494 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 39.6 m -116.01 136.59 52.89 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.783 0.801 . . . . 0.0 112.982 -176.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.41 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 44.5 mm -97.26 140.94 16.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.371 178.668 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -99.11 117.38 33.46 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.707 0.289 . . . . 0.0 110.28 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.479 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 73.0 t -113.52 136.11 50.95 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 CA-C-O 121.432 0.634 . . . . 0.0 110.671 178.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -137.34 155.26 49.63 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.075 -178.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -80.83 111.91 17.72 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.187 0.517 . . . . 0.0 110.999 -176.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 64.4 mm-40 . . . . . 0 C--N 1.317 -0.831 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.744 179.241 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 43.9 p-80 . . . . . 0 N--CA 1.447 -0.612 0 CA-C-O 121.182 0.515 . . . . 0.0 111.753 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 31.5 pt -133.5 170.97 18.85 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.835 178.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -107.46 134.03 51.09 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -125.05 139.14 54.06 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 177.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 52.3 mtmt -121.8 143.43 49.4 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.518 HG22 HG13 ' A' ' 84' ' ' ILE . 65.8 t -121.68 128.87 75.86 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -179.238 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -108.51 134.97 50.55 Favored 'General case' 0 C--O 1.245 0.835 0 CA-C-O 121.377 0.608 . . . . 0.0 111.092 -177.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -96.18 170.68 27.58 Favored Glycine 0 N--CA 1.428 -1.847 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.899 179.136 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.594 ' NE2' ' H ' ' A' ' 25' ' ' GLN . 0.0 OUTLIER -69.78 -25.46 63.81 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.207 0.527 . . . . 0.0 110.498 -176.568 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -84.66 -2.85 58.08 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.161 -178.049 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 94.9 7.61 59.75 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 120.197 -1.002 . . . . 0.0 113.515 179.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 37.0 t -85.45 155.25 21.33 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 177.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.487 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 5.3 p -150.82 143.05 16.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-O 121.164 0.507 . . . . 0.0 111.021 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.468 HG11 ' HD3' ' A' ' 50' ' ' ARG . 16.4 t -123.63 140.48 47.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 178.614 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -106.2 138.66 42.0 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 120.999 0.428 . . . . 0.0 110.356 179.104 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 . . . . . 0 C--N 1.324 -0.508 0 CA-C-O 121.047 0.451 . . . . 0.0 110.895 -177.671 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 20.9 pt . . . . . 0 CA--C 1.512 -0.498 0 CA-C-O 121.17 0.51 . . . . 0.0 110.777 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.524 ' HB2' ' OG1' ' A' ' 38' ' ' THR . 46.6 mtpt -81.83 148.25 28.94 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.267 179.108 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.9 ppt_? -69.01 -16.84 63.82 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.829 0.347 . . . . 0.0 111.397 -179.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 11.4 t-80 -100.95 -3.5 29.41 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 122.291 1.043 . . . . 0.0 108.52 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.524 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 2.4 m -90.81 137.28 26.96 Favored Pre-proline 0 N--CA 1.432 -1.334 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.429 -179.184 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_endo -61.6 129.15 26.83 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.39 2.06 . . . . 0.0 112.04 -179.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.736 HD13 ' SD ' ' A' ' 44' ' ' MET . 0.4 OUTLIER -69.36 -17.95 63.74 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.02 -0.537 . . . . 0.0 112.317 -178.868 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.525 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 7.8 p -50.93 -32.46 20.86 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 122.995 0.518 . . . . 0.0 111.658 179.01 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt -59.8 -48.34 82.08 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.446 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.6 pp -71.42 -33.78 69.72 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.234 0.54 . . . . 0.0 110.075 179.106 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.736 ' SD ' HD13 ' A' ' 40' ' ' LEU . 38.5 mtp -60.6 -49.28 78.18 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.183 0.516 . . . . 0.0 111.053 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 27.6 mmtp -67.23 -35.89 80.52 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.77 177.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.45 ' O ' ' HG2' ' A' ' 50' ' ' ARG . . . -63.68 -39.26 93.89 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 121.23 0.538 . . . . 0.0 110.186 179.326 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -57.81 -55.37 35.75 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.231 177.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.592 ' SG ' HD12 ' A' ' 58' ' ' ILE . 32.5 m -59.92 -41.26 91.37 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.104 -178.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -65.68 -39.91 91.79 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.468 ' HD3' HG11 ' A' ' 30' ' ' VAL . 14.6 ptm180 -82.08 -35.7 28.38 Favored 'General case' 0 C--N 1.329 -0.313 0 O-C-N 121.912 -0.492 . . . . 0.0 111.578 -178.822 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.9 mm-40 -77.67 -22.37 50.67 Favored 'General case' 0 CA--C 1.502 -0.896 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -179.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 84.48 42.8 7.21 Favored Glycine 0 N--CA 1.427 -1.957 0 C-N-CA 119.773 -1.203 . . . . 0.0 111.168 -177.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -122.8 164.17 18.86 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 178.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.8 m -113.58 150.25 33.31 Favored 'General case' 0 N--CA 1.44 -0.968 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 178.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 10.6 mmt -59.32 -29.16 67.44 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-O 121.3 0.571 . . . . 0.0 111.651 178.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -84.87 -13.58 50.5 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.511 0.672 . . . . 0.0 110.651 178.241 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -91.45 -19.07 23.24 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.77 -178.428 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.592 HD12 ' SG ' ' A' ' 48' ' ' CYS . 16.3 pt -139.41 -176.46 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.118 0.485 . . . . 0.0 111.026 -178.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.419 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 7.2 mmt180 -157.14 131.68 8.62 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.678 177.228 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -89.38 145.5 25.3 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.514 178.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.582 ' HD3' ' CA ' ' A' ' 64' ' ' GLY . 7.2 tmm_? -150.65 145.52 25.9 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-O 121.137 0.494 . . . . 0.0 110.596 -176.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -146.88 147.13 30.5 Favored 'General case' 0 C--O 1.216 -0.709 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 18.8 t70 55.83 23.75 6.75 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-O 121.753 0.787 . . . . 0.0 110.517 -177.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.582 ' CA ' ' HD3' ' A' ' 61' ' ' ARG . . . 83.9 -16.38 32.48 Favored Glycine 0 N--CA 1.428 -1.863 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.698 -179.182 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.572 ' O ' ' HG2' ' A' ' 61' ' ' ARG . 12.2 pt20 -97.1 148.0 33.76 Favored Pre-proline 0 CA--C 1.537 0.474 0 O-C-N 122.619 -0.342 . . . . 0.0 110.603 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -68.58 141.19 49.59 Favored 'Trans proline' 0 CA--C 1.53 0.325 0 C-N-CA 122.572 2.181 . . . . 0.0 112.337 -179.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 50.3 mt -90.25 146.78 5.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 179.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.592 HD21 ' HB2' ' A' ' 71' ' ' ASP . 0.2 OUTLIER -116.45 164.67 14.21 Favored 'General case' 0 CA--C 1.498 -1.054 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.463 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.525 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 9.5 pt-20 -75.84 -18.0 59.61 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.679 0.752 . . . . 0.0 109.859 177.649 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 23.5 p -93.0 1.65 57.2 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.735 -176.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.592 ' HB2' HD21 ' A' ' 68' ' ' ASN . 14.4 t70 -101.56 159.64 15.13 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 121.817 -0.552 . . . . 0.0 111.103 -177.585 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -114.79 151.31 45.29 Favored Pre-proline 0 C--O 1.219 -0.509 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 178.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.86 -29.86 91.31 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.978 2.452 . . . . 0.0 112.116 -179.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.45 -17.84 61.74 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.214 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -68.25 -41.51 81.04 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-O 121.64 0.733 . . . . 0.0 110.382 -178.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -86.75 2.93 47.05 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.862 -174.634 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 56.55 33.21 22.26 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-O 121.399 0.619 . . . . 0.0 111.044 178.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.9 ptm -77.96 156.77 30.03 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.097 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.575 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 12.3 pt-20 -107.08 162.61 13.71 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.274 -177.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -58.72 138.49 57.04 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.146 0.498 . . . . 0.0 111.127 174.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 77.21 19.54 1.3 Allowed 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 124.665 1.186 . . . . 0.0 110.613 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.575 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 0.7 OUTLIER -70.54 152.1 44.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.145 177.985 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 31.5 m -106.85 121.49 44.51 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.527 0.679 . . . . 0.0 112.694 -176.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.518 HG13 HG22 ' A' ' 22' ' ' VAL . 18.3 mm -85.3 140.53 15.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.232 176.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -102.23 116.18 32.12 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 120.837 0.351 . . . . 0.0 110.926 -179.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.419 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 72.3 t -109.69 138.43 37.26 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.938 0 CA-C-O 120.963 0.411 . . . . 0.0 110.471 177.378 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.6 p90 -133.99 149.01 51.2 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 116.092 -0.503 . . . . 0.0 109.817 178.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . 0.407 ' NE2' HG23 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -75.5 131.72 40.28 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.789 0.804 . . . . 0.0 112.168 -176.607 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 . . . . . 0 C--N 1.314 -0.942 0 CA-C-N 115.162 -0.926 . . . . 0.0 111.772 178.269 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.457 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 24.8 p-80 . . . . . 0 C--O 1.234 0.271 0 CA-C-O 120.982 0.42 . . . . 0.0 110.813 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 42.1 pt -129.65 171.21 17.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.277 0.56 . . . . 0.0 110.416 178.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.517 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 23.4 t-20 -110.5 135.72 50.73 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.099 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -124.65 143.57 50.66 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.42 ' HG2' ' HG3' ' A' ' 31' ' ' GLN . 54.6 mtmt -126.48 140.74 52.23 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-O 121.22 0.533 . . . . 0.0 109.826 179.262 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.533 HG21 HG13 ' A' ' 84' ' ' ILE . 60.1 t -122.99 131.96 72.31 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 -178.488 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.06 129.25 55.45 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 -178.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.41 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -105.66 156.95 16.41 Favored Glycine 0 N--CA 1.428 -1.872 0 C-N-CA 120.193 -1.003 . . . . 0.0 111.962 -179.388 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.24 -9.48 0.43 Allowed 'General case' 0 CA--C 1.55 0.96 0 N-CA-C 113.552 0.945 . . . . 0.0 113.552 178.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -82.48 -21.22 35.63 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.3 0.571 . . . . 0.0 110.208 178.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.51 3.52 40.6 Favored Glycine 0 CA--C 1.508 -0.394 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.7 t -91.03 152.66 20.57 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.505 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 3.2 p -148.35 137.02 15.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.161 0.505 . . . . 0.0 110.145 -178.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.401 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 3.8 t -125.99 141.72 44.82 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 O-C-N 122.108 -0.37 . . . . 0.0 110.516 -177.777 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.42 ' HG3' ' HG2' ' A' ' 21' ' ' LYS . 0.8 OUTLIER -106.07 141.71 36.98 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.195 179.166 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.436 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 20.1 m-85 . . . . . 0 C--N 1.323 -0.585 0 CA-C-O 121.172 0.51 . . . . 0.0 110.99 -177.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 33.7 pt . . . . . 0 CA--C 1.518 -0.272 0 CA-C-O 120.908 0.385 . . . . 0.0 110.177 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.512 ' HB2' ' OG1' ' A' ' 38' ' ' THR . 22.5 mtpp -85.89 151.23 23.94 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-O 121.131 0.491 . . . . 0.0 110.417 177.803 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -64.32 -25.1 67.89 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.072 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 19.5 t-160 -102.39 1.07 34.96 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.998 0.904 . . . . 0.0 109.25 -176.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.512 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.6 m -91.8 136.04 26.82 Favored Pre-proline 0 C--N 1.3 -1.575 0 CA-C-N 114.828 -1.078 . . . . 0.0 109.965 -179.26 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -58.23 125.85 19.74 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.597 2.198 . . . . 0.0 112.341 -179.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.572 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.3 pp -68.4 -16.8 64.05 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.039 -179.059 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.436 ' N ' HD13 ' A' ' 40' ' ' LEU . 26.2 t -51.19 -31.95 21.89 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 121.006 0.431 . . . . 0.0 111.125 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.3 mtpp -56.52 -50.49 71.68 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.305 0.574 . . . . 0.0 110.802 178.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.6 pp -71.5 -32.74 68.57 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.991 -179.082 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 49.5 mtm -64.0 -42.99 96.99 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.224 0.535 . . . . 0.0 110.731 -179.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.608 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 1.4 mmpt? -68.04 -38.94 83.09 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.54 177.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.19 -35.5 80.51 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-O 121.174 0.511 . . . . 0.0 110.068 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.507 ' CE2' ' HG3' ' A' ' 51' ' ' GLN . 64.4 t80 -61.79 -54.9 35.98 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.081 177.434 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.602 ' SG ' HD13 ' A' ' 58' ' ' ILE . 30.4 m -58.89 -39.04 80.27 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.127 0.489 . . . . 0.0 110.993 -179.146 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.608 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 73.6 mm-40 -59.84 -52.79 63.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.006 0.431 . . . . 0.0 111.399 178.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.419 ' HG2' ' O ' ' A' ' 47' ' ' TYR . 9.6 ptp180 -71.17 -36.05 71.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.993 0.425 . . . . 0.0 111.965 -177.046 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.507 ' HG3' ' CE2' ' A' ' 47' ' ' TYR . 24.3 mm-40 -72.68 -16.95 61.68 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -179.157 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 74.9 38.04 42.56 Favored Glycine 0 N--CA 1.435 -1.381 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -174.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.459 HD23 HG22 ' A' ' 58' ' ' ILE . 3.7 mp -123.41 165.66 16.67 Favored 'General case' 0 N--CA 1.433 -1.292 0 C-N-CA 123.631 0.772 . . . . 0.0 109.376 -175.431 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.409 ' HB2' ' OE1' ' A' ' 57' ' ' GLN . 61.8 m -124.88 158.09 34.34 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-O 120.67 0.272 . . . . 0.0 111.082 178.362 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.8 mmt -61.56 -30.2 70.5 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-O 121.069 0.461 . . . . 0.0 111.998 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.57 -13.36 51.97 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.615 0.721 . . . . 0.0 110.491 177.724 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.409 ' OE1' ' HB2' ' A' ' 54' ' ' SER . 1.2 mp0 -89.95 -20.71 23.0 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.723 -178.61 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.602 HD13 ' SG ' ' A' ' 48' ' ' CYS . 13.5 pt -142.91 -177.2 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.306 0.574 . . . . 0.0 111.871 -177.701 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.7 mmt180 -157.26 140.83 15.78 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.861 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -97.36 145.58 26.01 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.886 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.439 ' NE ' ' HA2' ' A' ' 64' ' ' GLY . 1.2 tmt_? -143.32 138.84 29.79 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-O 121.068 0.461 . . . . 0.0 110.664 -177.857 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.566 ' HE1' ' OD1' ' A' ' 82' ' ' ASP . 80.6 t80 -143.36 147.42 34.65 Favored 'General case' 0 C--O 1.208 -1.089 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.994 179.46 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.0 t70 57.55 22.84 8.55 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 121.73 0.776 . . . . 0.0 110.665 179.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.439 ' HA2' ' NE ' ' A' ' 61' ' ' ARG . . . 80.27 2.74 89.47 Favored Glycine 0 N--CA 1.427 -1.95 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.706 -178.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -119.43 149.96 48.73 Favored Pre-proline 0 N--CA 1.442 -0.864 0 O-C-N 122.313 -0.522 . . . . 0.0 109.741 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -65.06 141.26 69.26 Favored 'Trans proline' 0 C--N 1.327 -0.56 0 C-N-CA 122.245 1.963 . . . . 0.0 111.654 178.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.421 HD12 ' HB2' ' A' ' 62' ' ' PHE . 44.2 mt -92.74 146.21 6.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 178.147 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -112.85 170.46 8.18 Favored 'General case' 0 CA--C 1.502 -0.87 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -75.92 -15.72 60.14 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.515 0.674 . . . . 0.0 109.772 176.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 18.9 p -93.86 3.92 54.68 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.313 179.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.474 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 22.4 m-20 -82.09 142.05 32.62 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.477 0.656 . . . . 0.0 111.951 -179.359 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -116.41 139.31 25.19 Favored Pre-proline 0 C--N 1.317 -0.843 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.408 174.391 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.447 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 13.5 Cg_endo -56.76 -33.3 93.86 Favored 'Trans proline' 0 C--O 1.237 0.439 0 C-N-CA 123.036 2.491 . . . . 0.0 113.131 -175.783 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.83 -27.93 66.28 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.688 -179.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -65.05 -37.9 89.06 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.926 0.393 . . . . 0.0 111.296 -179.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -93.09 7.14 45.4 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 -179.855 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 43.35 40.21 2.5 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.636 1.174 . . . . 0.0 112.479 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.447 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 5.5 ptm -74.16 157.09 36.58 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.827 -178.409 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -103.39 159.85 15.21 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.013 -176.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.517 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 10.5 p-10 -57.69 141.92 46.84 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.245 0.545 . . . . 0.0 111.057 174.423 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.417 ' HB2' ' O ' ' A' ' 80' ' ' ASP . 8.3 mt-10 74.77 19.1 2.58 Favored 'General case' 0 CA--C 1.506 -0.727 0 C-N-CA 124.337 1.055 . . . . 0.0 111.48 -179.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.566 ' OD1' ' HE1' ' A' ' 62' ' ' PHE . 16.4 t70 -64.16 150.05 46.51 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.685 177.146 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 23.2 m -104.07 113.9 27.76 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.413 0.625 . . . . 0.0 112.044 -179.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.533 HG13 HG21 ' A' ' 22' ' ' VAL . 17.3 mm -83.59 145.08 8.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.532 178.278 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -102.83 116.86 33.38 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.124 -179.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.41 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 71.3 t -113.06 134.85 54.4 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-O 121.321 0.582 . . . . 0.0 111.175 176.496 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 13.0 p90 -132.9 155.5 48.94 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.749 -179.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -75.55 132.1 40.47 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.49 0.662 . . . . 0.0 112.051 -176.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 . . . . . 0 C--N 1.323 -0.555 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.2 178.238 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 . . . . . 0 N--CA 1.446 -0.644 0 CA-C-O 121.044 0.449 . . . . 0.0 110.429 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 31.9 pt -130.95 170.72 19.13 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.066 0 CA-C-O 121.379 0.609 . . . . 0.0 110.994 -178.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -104.85 136.23 44.74 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.563 178.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -127.93 135.93 50.64 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 177.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -121.81 146.82 46.7 Favored 'General case' 0 C--N 1.308 -1.215 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 179.018 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.659 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 3.4 p -124.62 131.44 72.7 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.797 -176.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -112.06 132.03 55.07 Favored 'General case' 0 C--O 1.244 0.79 0 CA-C-O 121.151 0.5 . . . . 0.0 110.762 -178.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -102.92 174.12 23.09 Favored Glycine 0 N--CA 1.435 -1.391 0 C-N-CA 121.292 -0.48 . . . . 0.0 112.725 -179.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.611 ' NE2' ' H ' ' A' ' 25' ' ' GLN . 0.1 OUTLIER -66.92 -31.41 71.98 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.531 0.681 . . . . 0.0 110.782 -177.529 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -77.31 -10.65 59.57 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.984 -178.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 98.82 7.37 55.51 Favored Glycine 0 N--CA 1.443 -0.894 0 C-N-CA 120.448 -0.882 . . . . 0.0 112.578 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 18.7 t -83.46 154.24 24.03 Favored 'General case' 0 N--CA 1.444 -0.765 0 O-C-N 122.416 -0.461 . . . . 0.0 109.976 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.659 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.2 p -146.68 132.69 13.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.269 0.557 . . . . 0.0 111.074 179.564 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.0 t -117.12 135.16 58.4 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -105.35 142.75 34.56 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.754 0.311 . . . . 0.0 110.92 -179.568 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 . . . . . 0 N--CA 1.468 0.447 0 CA-C-O 121.109 0.48 . . . . 0.0 110.96 -179.568 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 35.5 pt . . . . . 0 CA--C 1.52 -0.178 0 CA-C-O 121.149 0.499 . . . . 0.0 111.32 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.471 ' HB2' ' OG1' ' A' ' 38' ' ' THR . 15.6 mtpp -75.48 153.79 37.35 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.042 178.335 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.9 ptt180 -67.14 -22.38 65.78 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.507 0.67 . . . . 0.0 110.492 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -103.76 2.31 32.78 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 122.205 1.002 . . . . 0.0 109.357 -176.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.471 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.2 m -89.97 134.47 31.76 Favored Pre-proline 0 C--N 1.302 -1.476 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.808 178.551 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -61.34 125.51 17.07 Favored 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 122.33 2.02 . . . . 0.0 112.27 -178.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.515 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.0 OUTLIER -65.92 -17.42 64.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.112 0.482 . . . . 0.0 111.899 -179.57 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.446 ' N ' HD13 ' A' ' 40' ' ' LEU . 5.9 p -55.68 -28.25 54.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.416 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -60.91 -45.55 94.21 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 116.25 -0.432 . . . . 0.0 109.946 179.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.515 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.5 pp -72.91 -36.73 67.33 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.014 0.435 . . . . 0.0 110.231 178.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 45.1 mtm -63.58 -49.59 72.78 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 120.996 0.426 . . . . 0.0 110.855 -178.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.471 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 92.5 mttt -66.25 -36.1 82.13 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-O 120.688 0.28 . . . . 0.0 110.866 178.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.54 -37.42 87.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.114 0.483 . . . . 0.0 109.981 178.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -58.73 -55.43 35.16 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.793 178.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.502 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 24.4 p -64.8 -35.47 81.19 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 122.141 -0.349 . . . . 0.0 111.325 -177.061 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.471 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 60.7 mt-10 -67.04 -40.75 87.22 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.795 0.331 . . . . 0.0 111.507 179.653 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -81.82 -32.26 31.32 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 120.935 0.398 . . . . 0.0 111.472 -178.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.7 mm-40 -82.04 -22.69 36.28 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -177.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 90.2 37.7 6.6 Favored Glycine 0 N--CA 1.437 -1.262 0 C-N-CA 120.114 -1.041 . . . . 0.0 111.174 -178.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.502 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 3.9 mm? -123.62 165.35 17.33 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 179.297 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.1 m -119.49 155.48 32.02 Favored 'General case' 0 C--N 1.312 -1.031 0 O-C-N 121.922 -0.486 . . . . 0.0 110.971 178.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 12.9 mmt -63.15 -26.04 68.63 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.448 0.642 . . . . 0.0 111.453 178.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.462 ' HD2' ' H ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.84 -12.65 50.24 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.553 0.692 . . . . 0.0 110.52 177.219 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -96.94 -27.23 14.74 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.748 -0.66 . . . . 0.0 112.178 -178.112 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.8 pt -132.59 176.12 9.8 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.041 0 CA-C-O 121.076 0.465 . . . . 0.0 110.485 -178.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 16.1 mmt180 -149.72 141.67 23.83 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.729 178.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -100.08 139.41 35.78 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.977 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.621 ' HG2' ' N ' ' A' ' 62' ' ' PHE . 1.5 ttm180 -137.83 150.63 47.33 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-O 121.179 0.514 . . . . 0.0 110.865 -178.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.621 ' N ' ' HG2' ' A' ' 61' ' ' ARG . 74.4 t80 -155.23 146.1 22.44 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.841 176.511 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.2 t70 57.45 24.6 10.4 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 121.637 0.732 . . . . 0.0 110.403 -178.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.95 0.18 84.62 Favored Glycine 0 N--CA 1.435 -1.417 0 C-N-CA 121.011 -0.614 . . . . 0.0 113.292 -179.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -115.87 146.52 37.12 Favored Pre-proline 0 C--N 1.319 -0.728 0 O-C-N 122.13 -0.629 . . . . 0.0 110.067 179.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.55 139.74 45.58 Favored 'Trans proline' 0 C--O 1.238 0.495 0 C-N-CA 122.053 1.836 . . . . 0.0 111.806 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.445 HD12 ' HB2' ' A' ' 62' ' ' PHE . 42.8 mt -91.72 146.43 6.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 120.929 0.395 . . . . 0.0 110.242 -178.631 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.435 HD21 ' HB2' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -109.53 157.74 18.7 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 177.222 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.446 ' OE2' HG23 ' A' ' 70' ' ' THR . 0.1 OUTLIER -68.65 -19.53 64.41 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-O 121.649 0.738 . . . . 0.0 110.579 178.061 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.446 HG23 ' OE2' ' A' ' 69' ' ' GLU . 1.0 OUTLIER -96.32 14.81 23.03 Favored 'General case' 0 N--CA 1.421 -1.905 0 CA-C-N 116.011 -0.54 . . . . 0.0 112.107 179.693 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.435 ' HB2' HD21 ' A' ' 68' ' ' ASN . 3.3 t70 -96.4 150.84 20.14 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 120.881 0.372 . . . . 0.0 110.31 -179.576 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.725 ' HB ' ' OE1' ' A' ' 75' ' ' GLN . 0.9 OUTLIER -117.61 141.39 28.85 Favored Pre-proline 0 CA--C 1.545 0.754 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 179.179 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.498 ' HD2' ' CG2' ' A' ' 72' ' ' THR . 12.2 Cg_endo -53.66 -34.26 73.03 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 123.545 2.83 . . . . 0.0 113.122 -177.246 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.81 -26.25 65.98 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.76 -178.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.725 ' OE1' ' HB ' ' A' ' 72' ' ' THR . 6.3 mp0 -67.29 -38.83 85.65 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.936 0.398 . . . . 0.0 111.444 -179.332 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.1 mp -81.51 -10.48 59.47 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.513 -179.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 55.01 46.74 23.64 Favored 'General case' 0 C--N 1.347 0.474 0 CA-C-O 121.971 0.891 . . . . 0.0 109.785 -179.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 5.6 ptm -76.04 -141.22 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 114.703 -1.135 . . . . 0.0 112.048 -176.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.547 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 11.9 pt-20 -160.74 152.07 19.19 Favored 'General case' 0 CA--C 1.508 -0.641 0 O-C-N 121.673 -0.642 . . . . 0.0 109.367 -176.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -59.01 142.97 49.75 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.285 0.564 . . . . 0.0 111.163 173.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 71.56 15.63 6.03 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 124.14 0.976 . . . . 0.0 111.175 179.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.547 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 3.6 t0 -70.98 158.92 35.68 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.811 0.339 . . . . 0.0 110.131 179.261 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 27.3 m -108.31 126.51 52.92 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.616 0.722 . . . . 0.0 112.562 -176.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 44.7 mm -89.75 133.85 30.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.118 176.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -93.85 114.44 26.68 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 120.769 0.318 . . . . 0.0 110.605 -178.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 92.5 t -112.55 137.19 46.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-O 121.096 0.474 . . . . 0.0 110.533 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.7 p90 -139.64 154.1 47.46 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.109 -179.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -80.35 111.51 16.81 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.465 0.65 . . . . 0.0 111.691 -176.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 77.1 mm-40 . . . . . 0 C--N 1.313 -0.992 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.029 177.618 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.513 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 50.2 p-80 . . . . . 0 N--CA 1.447 -0.576 0 CA-C-O 121.369 0.605 . . . . 0.0 112.027 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 38.9 pt -132.2 170.53 19.71 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.653 178.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.425 HD22 ' HB3' ' A' ' 31' ' ' GLN . 16.6 t-20 -104.57 129.64 52.63 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 121.02 0.438 . . . . 0.0 110.797 -179.819 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -123.1 135.18 54.27 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 176.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.401 ' HG2' ' HG3' ' A' ' 31' ' ' GLN . 51.5 mtmt -119.86 141.69 49.34 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 -179.625 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.565 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 62.9 t -121.58 131.51 72.91 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 -177.785 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.25 125.71 50.67 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.152 0.501 . . . . 0.0 110.07 -178.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -103.23 156.29 17.97 Favored Glycine 0 N--CA 1.432 -1.576 0 C-N-CA 120.332 -0.937 . . . . 0.0 112.139 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.08 -10.9 0.21 Allowed 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 178.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -78.31 -21.64 49.35 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.612 0.72 . . . . 0.0 109.854 178.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 98.72 24.23 11.08 Favored Glycine 0 N--CA 1.443 -0.84 0 N-CA-C 110.196 -1.161 . . . . 0.0 110.196 -177.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.5 t -117.54 131.44 56.7 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.084 -0.558 . . . . 0.0 110.186 -177.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.565 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 3.1 p -124.55 142.61 40.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-O 121.317 0.58 . . . . 0.0 110.912 179.26 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.8 t -125.19 140.91 46.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.425 ' HB3' HD22 ' A' ' 19' ' ' ASN . 0.7 OUTLIER -106.28 140.26 39.5 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 120.844 0.354 . . . . 0.0 110.944 -179.675 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 12.5 m-85 . . . . . 0 C--N 1.328 -0.358 0 CA-C-O 120.851 0.358 . . . . 0.0 110.439 -179.043 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.414 HD12 HD22 ' A' ' 43' ' ' LEU . 24.9 pt . . . . . 0 N--CA 1.464 0.26 0 CA-C-O 120.984 0.421 . . . . 0.0 111.314 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.513 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 10.6 mptt -80.82 153.73 27.54 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.023 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.5 ptt180 -71.46 -13.95 61.98 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.217 0.532 . . . . 0.0 111.21 -178.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -105.75 -5.41 19.92 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 122.16 0.981 . . . . 0.0 108.479 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.502 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.8 m -85.77 130.3 51.29 Favored Pre-proline 0 N--CA 1.427 -1.613 0 CA-C-N 114.594 -1.185 . . . . 0.0 109.776 -179.649 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -61.88 123.01 11.82 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.367 2.045 . . . . 0.0 112.198 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.612 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.3 pp -61.42 -16.56 47.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.707 179.221 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.455 ' N ' HD11 ' A' ' 40' ' ' LEU . 47.9 t -50.15 -35.29 25.42 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 123.34 0.656 . . . . 0.0 111.569 179.309 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -66.59 -42.77 86.43 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 120.985 -0.286 . . . . 0.0 110.902 -178.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.612 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.0 pp -69.98 -33.27 71.84 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.988 0.423 . . . . 0.0 109.991 178.396 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 48.1 mtm -65.75 -48.27 72.44 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.24 0.543 . . . . 0.0 110.731 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 10.8 mmmm -64.31 -38.12 89.9 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 121.002 0.43 . . . . 0.0 110.158 177.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.62 -40.59 97.47 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.196 178.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -58.26 -54.56 45.65 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.615 178.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.608 ' SG ' HD11 ' A' ' 58' ' ' ILE . 31.4 m -58.92 -44.16 91.25 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.881 0.372 . . . . 0.0 110.976 -178.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -62.01 -42.42 99.14 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.014 0.375 . . . . 0.0 112.014 -179.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -78.8 -36.9 42.07 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.177 0.513 . . . . 0.0 111.732 -177.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.427 ' CB ' HD21 ' A' ' 53' ' ' LEU . 24.9 mm-40 -79.09 -20.38 48.91 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 112.403 0.52 . . . . 0.0 112.403 -177.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.51 42.29 6.98 Favored Glycine 0 N--CA 1.429 -1.792 0 C-N-CA 119.926 -1.13 . . . . 0.0 110.856 -177.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.427 HD21 ' CB ' ' A' ' 51' ' ' GLN . 4.0 mm? -124.01 163.66 20.94 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.405 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.418 ' HB2' ' HB2' ' A' ' 57' ' ' GLN . 48.6 m -116.59 151.37 36.35 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 178.516 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.433 ' HE1' ' SG ' ' A' ' 48' ' ' CYS . 10.0 mmt -60.39 -28.01 67.89 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.321 0.581 . . . . 0.0 111.382 179.306 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.428 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -84.81 -17.33 38.48 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.529 0.681 . . . . 0.0 110.503 177.923 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.418 ' HB2' ' HB2' ' A' ' 54' ' ' SER . 1.0 OUTLIER -90.43 -22.96 21.17 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.215 -178.277 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.608 HD11 ' SG ' ' A' ' 48' ' ' CYS . 16.1 pt -136.49 177.84 5.73 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 CA-C-O 121.513 0.673 . . . . 0.0 111.944 -178.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.449 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 17.0 mmt-85 -151.82 140.01 20.3 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.344 178.126 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -96.18 142.7 28.04 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.249 179.035 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -142.42 144.99 33.34 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-O 121.112 0.482 . . . . 0.0 110.888 -176.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.427 ' HB2' HD11 ' A' ' 67' ' ' ILE . 73.1 t80 -150.72 146.1 26.22 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 178.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 22.7 t70 56.71 23.42 7.86 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 121.772 0.796 . . . . 0.0 110.836 -178.163 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.01 -19.81 28.41 Favored Glycine 0 N--CA 1.428 -1.84 0 C-N-CA 121.055 -0.593 . . . . 0.0 112.312 -178.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -97.21 149.5 35.78 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-O 120.833 0.349 . . . . 0.0 111.199 -178.189 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.56 142.68 36.81 Favored 'Trans proline' 0 C--O 1.237 0.474 0 C-N-CA 122.651 2.234 . . . . 0.0 112.285 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.427 HD11 ' HB2' ' A' ' 62' ' ' PHE . 23.7 mt -95.69 149.68 4.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.104 0.478 . . . . 0.0 110.16 -179.442 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -127.03 173.01 10.0 Favored 'General case' 0 CA--C 1.5 -0.947 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 178.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -75.31 -9.68 58.77 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.399 0.619 . . . . 0.0 110.041 177.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 22.1 p -92.22 -4.76 53.66 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.585 -179.084 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -95.76 143.57 26.88 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-O 121.608 0.718 . . . . 0.0 112.229 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.95 152.13 43.43 Favored Pre-proline 0 C--N 1.312 -1.055 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.377 177.354 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.475 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 18.8 Cg_endo -58.64 -29.62 89.79 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.538 2.159 . . . . 0.0 112.251 -177.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -77.27 -13.37 59.95 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.952 -178.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -76.39 -37.54 57.02 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.374 0.607 . . . . 0.0 110.545 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -91.15 9.68 30.07 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.99 -179.688 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 44.16 36.87 1.64 Allowed 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.253 1.021 . . . . 0.0 111.857 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.475 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 7.0 ptm -76.36 159.71 30.26 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.554 -178.485 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.549 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 7.4 pt-20 -115.03 167.92 10.38 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.446 -176.705 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.437 ' O ' ' HB2' ' A' ' 81' ' ' GLU . 6.8 p-10 -59.49 144.97 45.66 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-O 121.017 0.436 . . . . 0.0 111.202 175.221 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' A' ' 80' ' ' ASP . 56.3 mm-40 74.39 14.74 3.6 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.181 0.992 . . . . 0.0 111.7 -179.58 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.549 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 0.6 OUTLIER -74.52 154.23 38.74 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.293 178.627 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 18.1 m -112.33 131.67 55.4 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.597 0.713 . . . . 0.0 112.919 -175.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.53 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 22.8 mm -94.92 142.78 12.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.838 178.208 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -101.84 116.14 32.06 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.935 0.398 . . . . 0.0 110.547 179.017 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.449 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 44.7 t -111.19 135.98 48.69 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.085 0 CA-C-O 121.302 0.572 . . . . 0.0 110.91 178.279 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.2 p90 -135.5 160.09 39.55 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.781 -179.103 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -88.47 120.87 30.25 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.411 0.624 . . . . 0.0 111.698 -176.13 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 . . . . . 0 C--N 1.319 -0.747 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.333 177.581 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.477 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 42.5 p-80 . . . . . 0 N--CA 1.436 -1.133 0 CA-C-O 121.363 0.602 . . . . 0.0 110.474 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 35.3 pt -123.33 168.46 15.82 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.563 0 CA-C-O 121.466 0.65 . . . . 0.0 111.211 -176.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -105.65 135.86 46.3 Favored 'General case' 0 C--N 1.307 -1.278 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 179.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -125.96 134.03 51.64 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.075 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -120.21 141.63 49.74 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.555 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 61.5 t -124.27 134.77 65.75 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.388 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 -176.663 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.72 130.13 55.65 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.035 0.445 . . . . 0.0 110.574 -177.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -102.6 174.1 23.41 Favored Glycine 0 N--CA 1.436 -1.341 0 N-CA-C 111.446 -0.662 . . . . 0.0 111.446 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -72.57 -18.73 61.59 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.353 0.597 . . . . 0.0 111.185 -177.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -71.11 -16.91 62.59 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.868 177.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 96.46 16.37 37.39 Favored Glycine 0 CA--C 1.496 -1.124 0 N-CA-C 110.836 -0.906 . . . . 0.0 110.836 179.11 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.1 m -106.68 132.11 53.05 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 115.257 -0.471 . . . . 0.0 111.032 -177.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.555 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.2 p -122.48 139.03 50.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 121.199 0.523 . . . . 0.0 111.292 178.492 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.2 t -118.99 137.48 52.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -104.79 140.49 38.02 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.904 0.383 . . . . 0.0 111.022 -179.063 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.434 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 15.1 m-85 . . . . . 0 N--CA 1.465 0.303 0 CA-C-O 121.01 0.433 . . . . 0.0 110.974 -178.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 36.8 pt . . . . . 0 N--CA 1.466 0.372 0 CA-C-O 120.762 0.315 . . . . 0.0 110.514 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.477 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 30.8 mtmm -78.26 154.14 31.24 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.808 0.337 . . . . 0.0 110.69 178.148 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -69.03 -18.13 63.99 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.084 0.468 . . . . 0.0 111.024 -179.26 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 -102.51 1.78 35.5 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.833 0.825 . . . . 0.0 109.045 -179.087 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 m -96.24 133.48 24.95 Favored Pre-proline 0 N--CA 1.437 -1.119 0 CA-C-N 114.959 -1.018 . . . . 0.0 109.569 179.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -65.97 134.88 38.76 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.517 2.145 . . . . 0.0 112.63 -177.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.596 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -68.55 -16.04 63.74 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -178.863 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.463 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 3.8 p -50.99 -31.31 17.61 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.8 mtpt -61.39 -47.88 83.82 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.241 0.543 . . . . 0.0 110.084 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.6 pp -73.93 -32.32 63.46 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.78 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 46.0 mtm -64.55 -45.47 86.97 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 121.19 0.519 . . . . 0.0 110.743 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.507 ' HZ1' ' HB3' ' A' ' 45' ' ' LYS . 7.0 mtpm? -69.86 -34.94 74.27 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.401 178.276 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.06 -37.38 87.22 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.308 0.575 . . . . 0.0 109.801 179.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -59.92 -55.55 32.71 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.907 177.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.676 ' SG ' HD11 ' A' ' 58' ' ' ILE . 33.1 m -60.46 -44.32 96.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.403 -178.098 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -66.4 -31.51 72.32 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -177.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 11.6 ptm180 -87.02 -36.68 18.07 Favored 'General case' 0 C--N 1.328 -0.352 0 O-C-N 121.853 -0.529 . . . . 0.0 111.095 178.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -77.79 -22.46 50.1 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-O 121.148 0.499 . . . . 0.0 112.041 -177.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.18 38.76 6.64 Favored Glycine 0 N--CA 1.434 -1.479 0 C-N-CA 120.386 -0.911 . . . . 0.0 111.523 -179.088 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -121.09 159.63 25.35 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.124 0.487 . . . . 0.0 110.32 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.473 ' HB2' ' HB2' ' A' ' 57' ' ' GLN . 51.1 m -108.8 148.21 30.89 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 178.201 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.9 mmt -58.35 -30.18 66.54 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-O 121.16 0.505 . . . . 0.0 111.626 179.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.68 -10.56 55.51 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.136 0.493 . . . . 0.0 111.662 178.35 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.473 ' HB2' ' HB2' ' A' ' 54' ' ' SER . 2.3 mp0 -98.24 -17.19 19.09 Favored 'General case' 0 CA--C 1.504 -0.809 0 CA-C-O 120.96 0.41 . . . . 0.0 111.497 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.676 HD11 ' SG ' ' A' ' 48' ' ' CYS . 17.0 pt -139.68 179.18 2.98 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 CA-C-O 120.937 0.398 . . . . 0.0 110.506 179.235 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.498 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 19.6 mmt-85 -154.43 144.74 22.07 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.097 0.475 . . . . 0.0 111.03 177.473 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -100.22 141.81 32.55 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.262 178.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -142.22 138.9 31.79 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-O 121.155 0.502 . . . . 0.0 110.701 -177.084 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.419 ' HB2' HD11 ' A' ' 67' ' ' ILE . 71.5 t80 -146.16 147.45 31.51 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 179.717 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 54.93 24.48 5.89 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.172 0.589 . . . . 0.0 111.524 -179.174 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.84 3.3 90.63 Favored Glycine 0 N--CA 1.442 -0.961 0 C-N-CA 120.652 -0.785 . . . . 0.0 113.177 179.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -121.88 151.49 57.91 Favored Pre-proline 0 C--N 1.317 -0.84 0 O-C-N 121.846 -0.797 . . . . 0.0 110.798 178.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.56 141.24 54.68 Favored 'Trans proline' 0 N--CA 1.459 -0.542 0 C-N-CA 122.259 1.973 . . . . 0.0 111.121 177.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.419 HD11 ' HB2' ' A' ' 62' ' ' PHE . 45.7 mt -90.63 145.01 7.94 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.94 0 CA-C-O 120.816 0.341 . . . . 0.0 110.102 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.493 HD21 ' HB2' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -111.92 157.53 20.55 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 178.034 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.463 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 16.9 pt-20 -71.01 -19.56 62.5 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 121.644 0.735 . . . . 0.0 110.019 179.257 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.2 p -91.27 5.97 47.08 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.878 -178.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . 0.493 ' HB2' HD21 ' A' ' 68' ' ' ASN . 2.9 t70 -93.35 151.53 19.71 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-O 121.001 0.429 . . . . 0.0 110.365 -178.448 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.509 ' HB ' ' OE1' ' A' ' 75' ' ' GLN . 1.7 m -118.62 140.16 27.99 Favored Pre-proline 0 C--N 1.316 -0.867 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.555 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 12.4 Cg_endo -52.55 -32.28 52.87 Favored 'Trans proline' 0 C--N 1.355 0.872 0 C-N-CA 123.657 2.905 . . . . 0.0 113.146 -176.294 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.43 -20.82 64.67 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.098 -177.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.509 ' OE1' ' HB ' ' A' ' 72' ' ' THR . 1.6 mp0 -73.4 -37.35 65.99 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.919 0.39 . . . . 0.0 111.096 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -88.43 -2.91 58.86 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.92 0.39 . . . . 0.0 110.541 -178.146 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 58.5 34.14 23.68 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.343 0.592 . . . . 0.0 110.884 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.555 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.7 ptm -75.35 160.07 30.71 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.74 -178.573 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -116.4 168.26 10.31 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.582 -175.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -60.95 141.16 57.5 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.774 0.797 . . . . 0.0 111.636 177.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 70.12 17.98 7.13 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.412 -1.267 . . . . 0.0 112.609 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -70.03 156.83 38.59 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 176.332 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 10.5 m -107.83 132.33 53.53 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -174.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.522 HG13 HG21 ' A' ' 22' ' ' VAL . 20.8 mm -97.08 142.67 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.555 178.465 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -100.42 117.96 35.67 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 120.637 0.256 . . . . 0.0 110.406 178.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.498 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 47.9 t -112.92 132.92 60.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 CA-C-O 121.124 0.487 . . . . 0.0 110.346 176.069 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 16.6 p90 -131.65 149.04 52.63 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.938 -178.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -73.92 111.34 8.98 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.242 0.544 . . . . 0.0 111.344 -178.559 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.434 ' H ' ' HA ' ' A' ' 58' ' ' ILE . 8.9 mm-40 . . . . . 0 C--N 1.314 -0.963 0 CA-C-O 121.357 0.599 . . . . 0.0 110.444 176.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 52.5 p-80 . . . . . 0 N--CA 1.445 -0.705 0 CA-C-O 121.39 0.614 . . . . 0.0 111.757 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 32.1 pt -130.87 170.75 19.03 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.297 -179.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.419 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 26.3 t-20 -107.12 125.09 50.62 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 116.272 -0.422 . . . . 0.0 109.862 179.181 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.422 HD12 ' OD2' ' A' ' 82' ' ' ASP . 2.7 mm? -114.72 141.66 47.53 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.824 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -128.37 142.24 51.18 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 -178.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.533 ' HA ' ' HB ' ' A' ' 84' ' ' ILE . 57.7 t -122.79 132.75 70.7 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.364 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 -178.049 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.47 124.58 47.96 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 -179.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.472 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -102.66 169.13 19.0 Favored Glycine 0 N--CA 1.431 -1.643 0 C-N-CA 120.086 -1.054 . . . . 0.0 112.737 -178.306 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -61.43 -5.6 1.82 Allowed 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.205 0.602 . . . . 0.0 112.514 178.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -86.36 -21.66 27.09 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.62 0.724 . . . . 0.0 109.683 178.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 104.73 -16.46 47.46 Favored Glycine 0 CA--C 1.491 -1.409 0 N-CA-C 109.957 -1.257 . . . . 0.0 109.957 -178.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.9 m -76.72 131.91 39.02 Favored 'General case' 0 N--CA 1.429 -1.516 0 CA-C-N 114.639 -0.781 . . . . 0.0 111.233 -178.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.491 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.1 p -122.17 140.81 44.92 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.896 178.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.9 t -121.99 138.46 52.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 -179.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -107.18 140.11 40.56 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.041 0.448 . . . . 0.0 111.139 -179.888 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.483 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 15.5 m-85 . . . . . 0 C--N 1.328 -0.344 0 CA-C-O 121.128 0.49 . . . . 0.0 110.727 -177.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.411 HG12 HD22 ' A' ' 20' ' ' LEU . 24.5 pt . . . . . 0 N--CA 1.465 0.309 0 CA-C-O 121.052 0.453 . . . . 0.0 110.933 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 7.1 mtmp? -80.92 144.87 31.6 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 120.81 0.338 . . . . 0.0 110.693 178.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -68.73 -14.12 62.82 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.186 0.517 . . . . 0.0 111.475 -177.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 -101.76 -3.27 28.4 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-O 122.247 1.022 . . . . 0.0 108.367 -178.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.451 ' HB ' ' O ' ' A' ' 35' ' ' LYS . 1.5 m -93.96 140.33 22.91 Favored Pre-proline 0 N--CA 1.437 -1.082 0 CA-C-N 114.244 -1.343 . . . . 0.0 110.796 -178.715 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.502 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 35.5 Cg_endo -59.71 126.11 19.64 Favored 'Trans proline' 0 C--O 1.238 0.478 0 C-N-CA 122.98 2.453 . . . . 0.0 112.29 -179.346 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.644 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.9 OUTLIER -69.92 -16.55 63.24 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.378 0.609 . . . . 0.0 111.346 179.579 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.456 ' N ' HD13 ' A' ' 40' ' ' LEU . 0.7 OUTLIER -50.53 -31.79 16.57 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 123.919 0.887 . . . . 0.0 111.742 -179.597 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.502 ' HE3' ' HG2' ' A' ' 39' ' ' PRO . 90.6 mttt -59.08 -50.63 73.34 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.431 0.634 . . . . 0.0 109.982 179.293 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.644 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.7 pp -70.17 -32.25 70.12 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.049 -178.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 45.2 mtm -64.71 -50.63 66.18 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 120.786 0.327 . . . . 0.0 111.305 -178.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.472 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 24.4 mmmt -65.61 -33.81 76.76 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 120.911 0.386 . . . . 0.0 110.469 178.104 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.77 -37.5 87.82 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.136 0.493 . . . . 0.0 109.979 178.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -60.08 -56.41 21.96 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.464 177.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.462 ' SG ' ' HA ' ' A' ' 45' ' ' LYS . 24.5 p -61.88 -35.63 78.89 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 111.814 0.301 . . . . 0.0 111.814 -178.167 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.472 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 48.3 mt-10 -66.72 -43.52 84.06 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 122.214 -0.303 . . . . 0.0 111.525 179.59 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 14.0 ptm180 -76.66 -37.28 56.52 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.117 0.484 . . . . 0.0 111.483 -178.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.45 ' HB3' HD23 ' A' ' 53' ' ' LEU . 21.1 mm-40 -74.29 -21.92 59.52 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 120.967 0.413 . . . . 0.0 111.914 -178.561 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.96 42.14 7.78 Favored Glycine 0 N--CA 1.428 -1.882 0 C-N-CA 119.767 -1.206 . . . . 0.0 110.995 -177.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.45 HD23 ' HB3' ' A' ' 51' ' ' GLN . 4.0 mm? -125.05 167.0 15.37 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 51.1 m -116.88 151.67 36.11 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 178.076 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.3 mmt -59.62 -28.12 66.93 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-O 121.197 0.522 . . . . 0.0 111.779 178.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.416 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -84.67 -13.87 50.2 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.58 0.705 . . . . 0.0 110.587 177.646 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -93.48 -17.2 23.7 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.026 -178.618 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 14.3 pt -141.49 179.66 2.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 121.176 0.512 . . . . 0.0 111.426 -179.163 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.476 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 6.1 mmt180 -155.23 140.23 17.35 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.689 177.725 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -97.83 143.02 28.87 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.732 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? -141.8 135.98 30.2 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.556 0.693 . . . . 0.0 111.402 -178.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 78.6 t80 -142.87 146.93 34.57 Favored 'General case' 0 N--CA 1.433 -1.302 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 177.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.444 ' C ' ' H ' ' A' ' 65' ' ' GLN . 13.0 t70 50.45 40.69 23.69 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 121.254 0.549 . . . . 0.0 109.906 -176.639 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 66.2 -20.9 0.17 Allowed Glycine 0 CA--C 1.532 1.152 0 N-CA-C 115.462 0.945 . . . . 0.0 115.462 -176.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.444 ' H ' ' C ' ' A' ' 63' ' ' ASP . 12.6 pt20 -92.81 147.11 33.43 Favored Pre-proline 0 C--N 1.316 -0.867 0 CA-C-N 117.516 0.658 . . . . 0.0 110.944 -177.597 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -69.68 142.51 48.46 Favored 'Trans proline' 0 N--CA 1.452 -0.919 0 C-N-CA 122.146 1.898 . . . . 0.0 110.912 179.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 34.4 mt -91.52 144.12 9.86 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.184 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 -178.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -121.42 162.7 19.97 Favored 'General case' 0 CA--C 1.499 -0.986 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -178.834 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -72.73 -13.75 61.4 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 121.244 0.545 . . . . 0.0 110.49 178.339 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 22.0 p -95.07 4.7 53.43 Favored 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 179.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -105.45 154.61 20.1 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.4 0.619 . . . . 0.0 112.01 178.719 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.403 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.6 OUTLIER -116.46 155.49 48.52 Favored Pre-proline 0 C--N 1.319 -0.738 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.978 177.724 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.625 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 13.2 Cg_endo -57.28 -30.92 89.29 Favored 'Trans proline' 0 C--O 1.236 0.381 0 C-N-CA 122.835 2.357 . . . . 0.0 112.253 -179.329 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.95 -16.57 60.64 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.75 -178.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.403 ' HB2' ' O ' ' A' ' 72' ' ' THR . 20.2 mm-40 -73.2 -39.64 65.4 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.375 0.607 . . . . 0.0 110.314 178.621 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.407 HD12 ' SD ' ' A' ' 78' ' ' MET . 1.1 mp -86.05 -2.57 58.44 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.682 179.047 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 59.33 30.84 20.62 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.261 179.077 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.625 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 5.7 ptm -76.55 168.21 20.48 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.031 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -136.59 -178.62 5.25 Favored 'General case' 0 C--N 1.313 -1.004 0 O-C-N 122.167 -0.333 . . . . 0.0 110.65 -177.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.438 ' O ' ' HB2' ' A' ' 81' ' ' GLU . 8.0 p-10 -61.56 141.08 57.99 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.553 0.692 . . . . 0.0 112.121 179.174 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.438 ' HB2' ' O ' ' A' ' 80' ' ' ASP . 4.6 mm-40 80.31 15.93 0.73 Allowed 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.278 1.431 . . . . 0.0 111.531 178.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.422 ' OD2' HD12 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -62.24 146.11 51.76 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.857 176.897 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 17.6 m -114.17 111.73 22.04 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-O 121.822 0.82 . . . . 0.0 112.332 175.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.533 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 14.3 mm -80.82 144.39 10.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 114.955 -1.021 . . . . 0.0 109.741 179.283 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -107.43 123.48 48.46 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 120.962 0.411 . . . . 0.0 110.982 178.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.476 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 86.7 t -113.46 139.04 40.95 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-O 121.205 0.526 . . . . 0.0 110.998 177.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.6 p90 -133.61 150.12 51.6 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.052 179.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.55 127.53 33.31 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.741 0.782 . . . . 0.0 112.102 -177.35 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 . . . . . 0 C--N 1.315 -0.933 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.563 176.365 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 6.0 t-160 . . . . . 0 CA--C 1.493 -1.247 0 CA-C-O 122.139 0.971 . . . . 0.0 108.853 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 45.2 pt -121.52 170.55 11.48 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.215 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.952 -173.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -105.5 135.43 46.91 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.37 178.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -127.25 134.42 50.07 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 177.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -118.51 146.54 44.46 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-O 121.23 0.538 . . . . 0.0 110.14 179.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.561 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 4.8 p -125.09 128.93 73.32 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.897 0 CA-C-N 116.108 -0.497 . . . . 0.0 109.992 -179.705 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -119.52 131.34 55.54 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.223 0.535 . . . . 0.0 109.906 -178.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -107.08 158.02 15.3 Favored Glycine 0 N--CA 1.432 -1.615 0 C-N-CA 120.41 -0.9 . . . . 0.0 111.355 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.19 -18.71 6.3 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 177.84 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -69.26 -21.88 63.87 Favored 'General case' 0 C--O 1.224 -0.288 0 O-C-N 121.961 -0.462 . . . . 0.0 110.574 177.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 103.79 2.77 46.25 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.043 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.0 t -93.7 159.39 15.23 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 179.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.561 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.6 p -148.97 136.91 14.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.05 0.452 . . . . 0.0 110.662 -179.445 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.8 t -118.93 135.54 59.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -106.72 143.14 35.25 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.824 0.345 . . . . 0.0 110.733 -179.384 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 . . . . . 0 N--CA 1.467 0.392 0 CA-C-O 121.167 0.508 . . . . 0.0 110.83 -178.666 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 19.4 pt . . . . . 0 N--CA 1.457 -0.111 0 CA-C-O 121.1 0.476 . . . . 0.0 110.826 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 32.7 mtmm -83.51 150.33 26.06 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 176.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -71.73 -11.07 60.64 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.269 0.556 . . . . 0.0 111.082 -178.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 18.8 t60 -99.16 -2.01 37.93 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.535 0.683 . . . . 0.0 109.636 -178.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -99.33 148.17 34.29 Favored Pre-proline 0 N--CA 1.442 -0.864 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.006 -178.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -65.12 131.53 28.91 Favored 'Trans proline' 0 C--O 1.239 0.553 0 C-N-CA 122.582 2.188 . . . . 0.0 112.509 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.471 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.2 pp -70.28 -16.93 63.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.131 0.491 . . . . 0.0 111.628 179.444 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.456 ' N ' HD12 ' A' ' 40' ' ' LEU . 9.0 p -53.16 -28.25 25.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.076 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.0 mtmt -66.1 -42.98 88.55 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 120.861 0.362 . . . . 0.0 110.907 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.7 pp -71.89 -34.3 69.05 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 121.17 0.509 . . . . 0.0 109.794 178.382 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 47.9 mtm -65.07 -46.62 80.39 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 120.997 0.427 . . . . 0.0 110.722 -179.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.483 ' HA ' ' SG ' ' A' ' 48' ' ' CYS . 80.8 mttt -66.76 -36.15 81.77 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 120.855 0.36 . . . . 0.0 110.796 177.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.474 ' O ' ' HG2' ' A' ' 50' ' ' ARG . . . -63.34 -37.88 88.98 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.232 0.539 . . . . 0.0 109.666 178.732 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -61.14 -56.4 21.28 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.945 178.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.483 ' SG ' ' HA ' ' A' ' 45' ' ' LYS . 24.3 p -62.52 -38.65 90.8 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.727 0.298 . . . . 0.0 111.436 -177.435 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -65.95 -37.4 85.93 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 -179.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . 0.474 ' HG2' ' O ' ' A' ' 46' ' ' ALA . 14.7 ptm180 -83.26 -33.25 26.07 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 121.87 -0.519 . . . . 0.0 111.438 -179.656 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -78.61 -21.85 47.89 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-O 120.998 0.428 . . . . 0.0 112.053 -178.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.71 39.83 7.46 Favored Glycine 0 N--CA 1.433 -1.531 0 C-N-CA 120.167 -1.016 . . . . 0.0 111.24 -178.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -126.37 168.2 14.48 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.013 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.6 m -120.61 157.22 30.01 Favored 'General case' 0 C--N 1.312 -1.041 0 O-C-N 122.264 -0.273 . . . . 0.0 110.647 179.038 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 15.5 mmt -63.13 -26.76 68.97 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.422 0.63 . . . . 0.0 111.457 179.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.413 ' HD2' ' H ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.53 -12.99 50.34 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 121.548 0.689 . . . . 0.0 110.437 177.74 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -96.48 -26.03 15.44 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.911 -178.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.3 pt -135.29 176.37 8.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 120.819 0.342 . . . . 0.0 110.714 -179.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 17.4 mmt180 -152.88 146.57 25.12 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.209 0.528 . . . . 0.0 111.07 179.018 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -104.6 143.25 33.32 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.439 -177.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.435 ' HG2' ' O ' ' A' ' 65' ' ' GLN . 7.7 tmm_? -143.03 141.31 31.29 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-O 121.172 0.511 . . . . 0.0 110.859 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.454 ' HB2' HD13 ' A' ' 67' ' ' ILE . 69.5 t80 -146.8 147.42 30.87 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 178.45 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 24.8 t70 58.59 23.19 10.62 Favored 'General case' 0 N--CA 1.483 1.182 0 CA-C-O 121.869 0.842 . . . . 0.0 110.728 -178.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.415 ' HA2' ' HD3' ' A' ' 61' ' ' ARG . . . 79.2 1.32 85.48 Favored Glycine 0 N--CA 1.428 -1.835 0 C-N-CA 120.939 -0.648 . . . . 0.0 112.849 -179.213 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.435 ' O ' ' HG2' ' A' ' 61' ' ' ARG . 12.0 pt20 -116.72 147.44 39.9 Favored Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 122.148 -0.619 . . . . 0.0 110.599 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -67.62 141.05 53.71 Favored 'Trans proline' 0 C--O 1.237 0.431 0 C-N-CA 122.602 2.202 . . . . 0.0 111.824 -179.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.454 HD13 ' HB2' ' A' ' 62' ' ' PHE . 24.1 mt -98.79 141.24 16.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-O 121.049 0.452 . . . . 0.0 110.088 -179.183 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -112.39 170.61 8.05 Favored 'General case' 0 CA--C 1.497 -1.08 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 177.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.439 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 8.9 pt-20 -73.76 -17.01 61.15 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.564 0.697 . . . . 0.0 110.119 177.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 17.6 p -82.96 -21.62 33.97 Favored 'General case' 0 N--CA 1.434 -1.225 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.707 -177.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.64 154.08 32.55 Favored 'General case' 0 N--CA 1.437 -1.11 0 N-CA-C 112.999 0.741 . . . . 0.0 112.999 -178.079 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -115.31 154.22 47.5 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.892 175.5 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_endo -57.88 -29.3 85.85 Favored 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.981 2.454 . . . . 0.0 111.915 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.83 -20.24 60.51 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.673 -178.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -69.52 -37.06 76.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.363 0.602 . . . . 0.0 111.146 179.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.1 mp -88.76 -2.15 58.45 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.204 -178.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 53.87 38.14 28.04 Favored 'General case' 0 C--N 1.345 0.388 0 CA-C-O 121.772 0.796 . . . . 0.0 110.985 179.351 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.1 ptm -77.79 169.49 18.2 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.631 -178.543 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -117.68 169.15 9.81 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -177.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -62.58 142.63 57.92 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 121.64 0.733 . . . . 0.0 111.439 176.481 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 74.71 16.77 3.03 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 124.847 1.259 . . . . 0.0 111.953 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.69 155.4 40.58 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.769 0.318 . . . . 0.0 110.276 176.365 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 84.3 m -111.0 132.15 54.45 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.696 0.76 . . . . 0.0 112.708 -175.543 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 41.5 mm -96.7 141.93 14.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.341 -0.845 . . . . 0.0 108.906 177.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -103.51 124.12 48.17 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 120.957 0.408 . . . . 0.0 110.919 179.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 99.0 t -115.28 136.16 52.94 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-O 121.264 0.555 . . . . 0.0 111.113 178.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.4 p90 -135.98 152.95 51.47 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.916 -179.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -80.04 113.91 18.57 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.339 0.59 . . . . 0.0 112.504 -176.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 26.3 mm-40 . . . . . 0 C--N 1.318 -0.787 0 CA-C-O 121.359 0.599 . . . . 0.0 111.303 176.517 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . 0.459 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 55.8 p-80 . . . . . 0 N--CA 1.438 -1.065 0 CA-C-O 121.069 0.461 . . . . 0.0 111.042 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 36.5 pt -131.66 164.02 35.69 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-O 121.376 0.608 . . . . 0.0 111.037 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -96.11 136.92 35.93 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.377 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.451 HD22 HG12 ' A' ' 34' ' ' ILE . 3.0 mm? -129.75 139.66 51.25 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 176.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -125.03 144.98 50.12 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-O 121.213 0.53 . . . . 0.0 110.305 -179.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.598 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 5.2 p -122.72 132.06 72.02 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.532 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.551 -178.496 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.1 119.07 33.64 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.376 0.608 . . . . 0.0 110.151 -179.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -96.33 146.5 18.29 Favored Glycine 0 N--CA 1.428 -1.854 0 C-N-CA 120.836 -0.697 . . . . 0.0 111.493 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.48 ' HG3' ' O ' ' A' ' 86' ' ' VAL . 0.0 OUTLIER -53.29 -16.36 1.28 Allowed 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 178.866 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -71.91 -21.37 61.64 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.206 0.527 . . . . 0.0 110.394 177.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 103.71 27.22 6.45 Favored Glycine 0 N--CA 1.443 -0.855 0 N-CA-C 110.651 -0.98 . . . . 0.0 110.651 -178.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.1 p -122.01 131.84 54.21 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-O 120.977 0.418 . . . . 0.0 111.475 -178.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.598 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.4 p -124.08 137.1 58.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 121.161 0.505 . . . . 0.0 111.525 178.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.1 t -120.79 137.16 55.45 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 179.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -107.15 144.16 34.28 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.934 0.397 . . . . 0.0 111.265 -179.394 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 . . . . . 0 N--CA 1.466 0.358 0 CA-C-O 121.282 0.563 . . . . 0.0 110.982 -178.72 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.451 HG12 HD22 ' A' ' 20' ' ' LEU . 33.7 pt . . . . . 0 CA--C 1.516 -0.337 0 CA-C-O 120.829 0.347 . . . . 0.0 110.44 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.503 ' HB2' ' OG1' ' A' ' 38' ' ' THR . 0.0 OUTLIER -79.39 151.74 30.77 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.184 0.516 . . . . 0.0 110.919 179.584 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 5.9 ptt180 -67.05 -18.0 65.15 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.384 0.611 . . . . 0.0 110.723 179.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 59.8 t60 -102.93 -3.5 26.06 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 122.186 0.993 . . . . 0.0 108.897 -177.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.503 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 2.3 m -90.16 136.01 29.26 Favored Pre-proline 0 C--N 1.306 -1.311 0 CA-C-N 114.502 -1.227 . . . . 0.0 110.473 -178.711 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.45 125.26 15.26 Favored 'Trans proline' 0 C--O 1.24 0.578 0 C-N-CA 122.447 2.098 . . . . 0.0 111.979 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.48 HD11 ' N ' ' A' ' 41' ' ' SER . 1.2 pp -62.61 -17.34 60.04 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.445 0.64 . . . . 0.0 111.303 179.247 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.48 ' N ' HD11 ' A' ' 40' ' ' LEU . 0.7 OUTLIER -51.42 -29.49 16.1 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 124.11 0.964 . . . . 0.0 111.37 179.312 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -62.85 -49.1 76.2 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.618 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.8 pp -68.83 -34.78 76.07 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 120.968 0.413 . . . . 0.0 110.058 179.57 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 48.1 mtm -61.36 -45.92 92.39 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 121.059 0.457 . . . . 0.0 110.447 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.67 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 7.9 mtpm? -69.28 -40.44 77.75 Favored 'General case' 0 C--O 1.212 -0.897 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.642 177.802 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.64 -40.17 82.66 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-O 121.444 0.64 . . . . 0.0 109.83 -179.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 58.8 t80 -56.89 -55.67 31.56 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.224 176.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.673 ' SG ' HD11 ' A' ' 58' ' ' ILE . 21.7 m -61.16 -39.94 91.98 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.87 0.367 . . . . 0.0 110.698 -179.231 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.67 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 69.2 mm-40 -58.75 -49.91 75.89 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 121.274 0.559 . . . . 0.0 111.098 178.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 -77.71 -36.83 50.61 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.805 -176.187 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.427 ' CB ' HD23 ' A' ' 53' ' ' LEU . 23.0 mm-40 -76.25 -22.14 55.51 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -177.506 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.22 42.52 7.0 Favored Glycine 0 N--CA 1.431 -1.659 0 C-N-CA 119.523 -1.323 . . . . 0.0 110.782 -176.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.427 HD23 ' CB ' ' A' ' 51' ' ' GLN . 4.1 mm? -125.16 164.15 20.89 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-O 121.149 0.5 . . . . 0.0 110.157 -179.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.8 m -117.0 154.15 31.41 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.0 mmt -63.88 -25.59 68.23 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-O 121.336 0.589 . . . . 0.0 111.093 179.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.85 -17.89 36.58 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.42 0.628 . . . . 0.0 110.772 177.554 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -88.78 -25.74 22.1 Favored 'General case' 0 CA--C 1.507 -0.697 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.352 -178.012 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.673 HD11 ' SG ' ' A' ' 48' ' ' CYS . 15.1 pt -136.08 -178.02 2.21 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.088 0 CA-C-O 121.022 0.439 . . . . 0.0 111.344 -179.204 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.415 ' CG ' ' HG3' ' A' ' 89' ' ' GLN . 19.3 mmt180 -157.89 146.9 19.46 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.505 177.222 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -102.77 146.34 28.39 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.151 -178.437 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 8.0 tmm_? -143.58 142.32 31.03 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.545 0.688 . . . . 0.0 111.326 -179.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.459 ' HB2' HD13 ' A' ' 67' ' ' ILE . 65.7 t80 -148.59 148.11 29.78 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 18.5 t70 57.59 22.7 8.47 Favored 'General case' 0 N--CA 1.484 1.273 0 CA-C-O 121.667 0.746 . . . . 0.0 110.978 -177.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.05 11.61 84.66 Favored Glycine 0 N--CA 1.43 -1.744 0 C-N-CA 120.477 -0.868 . . . . 0.0 112.627 -179.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -126.87 147.08 59.77 Favored Pre-proline 0 CA--C 1.534 0.338 0 O-C-N 122.222 -0.575 . . . . 0.0 109.891 178.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -66.21 143.34 70.65 Favored 'Trans proline' 0 CA--C 1.532 0.42 0 C-N-CA 122.314 2.01 . . . . 0.0 111.959 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.459 HD13 ' HB2' ' A' ' 62' ' ' PHE . 28.7 mt -97.7 148.84 5.43 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-O 120.95 0.405 . . . . 0.0 110.244 -178.484 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -125.79 169.96 12.08 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 178.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -77.19 -8.72 58.02 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-O 121.316 0.579 . . . . 0.0 110.311 177.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 41.0 p -91.12 -3.65 56.9 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.34 179.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -100.52 148.4 24.83 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.413 0.625 . . . . 0.0 112.173 -179.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -111.8 157.26 40.01 Favored Pre-proline 0 C--N 1.323 -0.559 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.766 178.137 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.587 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 18.0 Cg_endo -60.32 -31.24 92.59 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.733 2.289 . . . . 0.0 111.595 178.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -77.91 -11.02 59.86 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.555 -179.165 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.467 ' HA ' ' NE2' ' A' ' 75' ' ' GLN . 8.6 tp60 -71.44 -48.37 49.95 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 121.638 0.732 . . . . 0.0 110.118 -179.465 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.11 0.46 53.45 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.364 -178.169 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 51.98 44.17 29.71 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 121.731 0.777 . . . . 0.0 110.674 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.587 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.0 ptm -76.35 158.81 31.1 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.956 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -108.84 167.11 10.31 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-O 120.804 0.335 . . . . 0.0 110.577 -176.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -52.08 137.63 27.11 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.326 0.584 . . . . 0.0 111.443 174.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 67.65 23.76 8.66 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.083 -0.962 . . . . 0.0 112.482 178.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.98 150.41 47.72 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 175.307 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 28.8 m -106.31 126.75 52.62 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 121.558 0.694 . . . . 0.0 112.807 -174.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 42.0 mm -93.06 140.93 15.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 176.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -106.36 123.33 47.9 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-O 121.054 0.454 . . . . 0.0 110.916 179.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.48 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 85.9 t -111.38 137.08 45.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.029 0.442 . . . . 0.0 111.193 179.682 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.2 p90 -134.3 152.87 52.05 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.855 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -77.31 118.56 19.91 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.516 0.674 . . . . 0.0 111.507 -178.106 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.415 ' HG3' ' CG ' ' A' ' 59' ' ' ARG . 55.5 mm-40 . . . . . 0 C--N 1.313 -0.998 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.075 178.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.9 tpt . . . . . 0 N--CA 1.479 0.975 0 CA-C-O 120.697 0.284 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.525 ' HA ' ' O ' ' A' ' 5' ' ' LYS . . . -78.38 -8.58 58.61 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 121.701 -0.624 . . . . 0.0 111.637 -178.025 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -83.24 -2.2 55.0 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.714 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -136.27 -29.52 0.98 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.162 0.506 . . . . 0.0 111.366 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.525 ' O ' ' HA ' ' A' ' 2' ' ' ALA . 59.2 tttp -136.95 129.93 17.37 Favored Pre-proline 0 C--N 1.314 -0.937 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -64.94 171.77 8.23 Favored 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.42 2.08 . . . . 0.0 111.758 177.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.435 ' HD2' ' H ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -70.55 -3.91 20.39 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.109 178.424 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -66.44 162.96 19.39 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 121.142 0.496 . . . . 0.0 110.897 -178.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -90.81 -67.45 1.18 Allowed Glycine 0 N--CA 1.437 -1.294 0 C-N-CA 120.415 -0.898 . . . . 0.0 111.912 -177.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 38.3 t -98.75 108.12 21.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 120.952 0.406 . . . . 0.0 111.277 -178.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.413 ' HD3' ' HA ' ' A' ' 11' ' ' LYS . 24.0 mmtp -150.58 143.95 24.98 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 121.029 0.442 . . . . 0.0 109.959 176.443 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.6 t -154.35 158.9 40.79 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.153 -177.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -132.97 75.61 1.63 Allowed 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.128 0.49 . . . . 0.0 110.214 178.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -87.2 12.14 12.41 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-O 121.6 0.714 . . . . 0.0 109.794 178.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 -61.87 170.82 1.89 Allowed 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.275 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -84.37 90.75 7.64 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-O 121.801 0.81 . . . . 0.0 109.191 -178.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.511 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 43.7 p-80 -109.8 134.44 52.03 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.465 -179.268 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 40.5 pt -119.26 162.14 17.75 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.838 0 CA-C-O 121.634 0.73 . . . . 0.0 111.375 -176.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.498 ' HA ' ' O ' ' A' ' 32' ' ' PHE . 23.7 t-20 -100.11 132.88 45.21 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.27 178.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -122.6 134.56 54.51 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-O 121.102 0.477 . . . . 0.0 109.793 177.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 48.3 mtmt -117.39 144.41 44.99 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.627 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 90.5 t -124.86 134.98 65.48 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.705 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -177.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -117.08 130.11 56.43 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.171 0.51 . . . . 0.0 110.819 -178.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -101.69 178.32 27.32 Favored Glycine 0 N--CA 1.43 -1.71 0 C-N-CA 121.036 -0.602 . . . . 0.0 111.896 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.649 ' NE2' ' H ' ' A' ' 25' ' ' GLN . 0.5 OUTLIER -60.52 -31.74 70.8 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.76 0.791 . . . . 0.0 110.592 -179.002 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -71.33 -16.0 62.42 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.285 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.31 5.95 69.27 Favored Glycine 0 N--CA 1.446 -0.684 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 -175.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 9.2 t -80.84 126.45 31.36 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.627 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 28.3 t -120.42 138.84 49.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-O 121.272 0.558 . . . . 0.0 110.878 -178.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.8 t -122.12 136.85 57.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 177.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -104.74 143.82 32.58 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.742 0.306 . . . . 0.0 110.562 -179.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.498 ' O ' ' HA ' ' A' ' 19' ' ' ASN . 14.4 m-85 -137.32 151.52 48.72 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 120.808 0.337 . . . . 0.0 110.702 -179.138 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 36.6 pt -132.28 167.03 27.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 122.06 -0.4 . . . . 0.0 111.007 -178.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.511 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 0.0 OUTLIER -80.7 153.28 27.95 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 121.123 0.487 . . . . 0.0 110.641 178.456 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.5 ptt180 -63.43 -19.37 64.64 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.762 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 67.1 t60 -104.3 -3.55 24.07 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 122.161 0.981 . . . . 0.0 108.728 -176.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 m -86.68 132.32 42.81 Favored Pre-proline 0 N--CA 1.43 -1.441 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.96 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -59.91 122.07 10.83 Favored 'Trans proline' 0 C--O 1.239 0.565 0 C-N-CA 122.482 2.121 . . . . 0.0 112.413 -178.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.649 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.9 OUTLIER -63.37 -17.23 62.4 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.375 0.607 . . . . 0.0 111.102 179.075 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.474 ' N ' HD11 ' A' ' 40' ' ' LEU . 0.8 OUTLIER -50.69 -34.68 27.62 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 123.974 0.91 . . . . 0.0 111.211 179.193 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.551 ' HZ1' ' HB3' ' A' ' 42' ' ' LYS . 7.3 mtpm? -59.15 -51.42 70.11 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.361 179.428 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.649 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.3 pp -68.72 -34.54 75.81 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.738 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 48.2 mtm -63.01 -51.18 67.8 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-O 121.152 0.501 . . . . 0.0 110.863 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -66.58 -34.59 78.22 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-O 121.021 0.438 . . . . 0.0 110.932 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.23 -36.52 84.36 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.08 0.467 . . . . 0.0 110.022 177.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -59.92 -55.63 31.68 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.672 178.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.405 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 26.5 p -65.12 -34.98 79.69 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 122.097 -0.377 . . . . 0.0 111.557 -177.098 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -65.89 -38.64 89.3 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.93 0.395 . . . . 0.0 111.751 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -85.27 -30.18 24.0 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.009 0.433 . . . . 0.0 111.165 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -82.66 -21.65 34.91 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -177.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 87.9 40.45 6.66 Favored Glycine 0 N--CA 1.437 -1.272 0 C-N-CA 119.882 -1.152 . . . . 0.0 111.198 -177.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.405 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 4.0 mm? -123.34 161.88 23.82 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.879 0.371 . . . . 0.0 110.262 179.374 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.45 ' HB2' ' HB2' ' A' ' 57' ' ' GLN . 48.3 m -114.79 150.07 35.99 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 110.346 -0.242 . . . . 0.0 110.346 178.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.405 ' HE1' ' SG ' ' A' ' 48' ' ' CYS . 14.2 mmt -64.44 -23.95 67.46 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.216 0.532 . . . . 0.0 111.508 178.488 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.41 -17.48 39.15 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.306 0.574 . . . . 0.0 110.368 176.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.45 ' HB2' ' HB2' ' A' ' 54' ' ' SER . 2.4 mp0 -93.31 -30.13 15.29 Favored 'General case' 0 CA--C 1.507 -0.696 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.896 -178.286 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.7 pt -128.57 178.35 5.06 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.249 0 CA-C-O 121.39 0.614 . . . . 0.0 111.862 -178.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.413 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 15.5 mmt180 -156.55 142.54 18.0 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.394 177.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -97.36 148.3 23.3 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -147.65 134.75 20.39 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-O 121.245 0.545 . . . . 0.0 111.087 -176.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.42 ' HB2' HD13 ' A' ' 67' ' ' ILE . 69.2 t80 -141.41 147.86 38.66 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.44 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 17.3 t70 55.94 23.52 6.71 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-O 121.826 0.822 . . . . 0.0 110.32 -176.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.58 -21.63 21.09 Favored Glycine 0 N--CA 1.423 -2.21 0 CA-C-N 115.7 -0.682 . . . . 0.0 112.638 -179.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -95.31 149.07 35.64 Favored Pre-proline 0 C--N 1.324 -0.54 0 O-C-N 122.518 -0.401 . . . . 0.0 111.502 -177.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -70.96 142.95 43.84 Favored 'Trans proline' 0 C--O 1.235 0.351 0 C-N-CA 122.776 2.317 . . . . 0.0 112.138 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.42 HD13 ' HB2' ' A' ' 62' ' ' PHE . 15.9 mt -99.0 147.28 7.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-O 120.983 0.421 . . . . 0.0 110.825 -179.36 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -128.24 172.95 10.56 Favored 'General case' 0 CA--C 1.507 -0.673 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.356 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -75.01 -8.08 55.5 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.235 0.541 . . . . 0.0 110.984 177.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 26.2 p -93.45 -4.17 51.77 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.276 0.56 . . . . 0.0 111.141 178.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -94.68 144.51 25.56 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.487 0.661 . . . . 0.0 112.006 179.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -117.46 149.41 44.72 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.686 177.119 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.431 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 17.8 Cg_endo -59.71 -31.32 94.0 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.939 2.426 . . . . 0.0 113.469 -175.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.28 -23.05 63.78 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -178.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 6.1 mp0 -69.86 -37.35 76.09 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.098 0.475 . . . . 0.0 111.125 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.2 mp -86.48 -5.21 59.21 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 -178.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 55.96 44.48 25.57 Favored 'General case' 0 C--N 1.344 0.332 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.514 179.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.431 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 5.8 ptm -86.12 161.35 18.93 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.003 -177.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -112.18 164.94 12.61 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 -178.112 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.415 ' CB ' ' H ' ' A' ' 19' ' ' ASN . 6.2 p-10 -62.48 144.77 55.59 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.654 0.74 . . . . 0.0 112.137 176.565 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 73.82 17.9 3.47 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.282 -1.326 . . . . 0.0 112.109 179.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -78.19 164.42 24.95 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 120.303 -0.559 . . . . 0.0 109.731 176.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 21.0 m -114.21 138.15 50.84 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.611 0.72 . . . . 0.0 112.868 -175.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.515 HG13 HG23 ' A' ' 22' ' ' VAL . 19.7 mm -99.18 139.34 21.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.443 -0.798 . . . . 0.0 109.858 178.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -98.32 116.78 31.26 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.981 0.42 . . . . 0.0 110.76 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.413 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 73.4 t -111.03 137.87 41.68 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.12 0 CA-C-O 121.189 0.519 . . . . 0.0 110.133 177.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.8 p90 -136.52 156.7 48.22 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.858 -178.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.95 116.05 23.94 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.436 0.636 . . . . 0.0 111.443 -177.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -100.8 20.04 16.04 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.604 177.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -61.57 110.5 1.5 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.866 -178.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 85.7 m -151.49 112.76 4.33 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.004 0.431 . . . . 0.0 110.487 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 158.42 -130.08 2.45 Favored Glycine 0 N--CA 1.444 -0.827 0 C-N-CA 120.824 -0.703 . . . . 0.0 111.712 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.121 0 CA-C-O 118.461 -1.188 . . . . 0.0 111.396 179.083 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.7 ttt . . . . . 0 N--CA 1.48 1.026 0 CA-C-O 120.963 0.411 . . . . 0.0 111.814 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -133.05 90.36 2.74 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -97.81 -18.27 18.85 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -175.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.48 127.07 31.67 Favored 'General case' 0 C--N 1.318 -0.772 0 O-C-N 122.039 -0.413 . . . . 0.0 111.2 178.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt 70.31 101.61 0.04 OUTLIER Pre-proline 0 N--CA 1.467 0.378 0 C-N-CA 123.598 0.759 . . . . 0.0 111.729 178.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.445 ' HD2' ' HG3' ' A' ' 11' ' ' LYS . 56.6 Cg_endo -91.22 -158.81 0.07 OUTLIER 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 123.191 2.594 . . . . 0.0 111.155 178.218 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.417 ' HD2' ' N ' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -55.38 -18.25 6.36 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 176.185 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.417 ' N ' ' HD2' ' A' ' 7' ' ' LYS . 44.1 mt-10 -74.47 162.22 29.03 Favored 'General case' 0 C--O 1.234 0.279 0 O-C-N 122.065 -0.397 . . . . 0.0 110.339 177.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -84.4 -85.23 0.93 Allowed Glycine 0 N--CA 1.441 -0.984 0 C-N-CA 120.293 -0.956 . . . . 0.0 113.911 -174.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 46.9 t -81.57 97.47 3.69 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.012 0 CA-C-O 121.485 0.66 . . . . 0.0 111.794 -174.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.445 ' HG3' ' HD2' ' A' ' 6' ' ' PRO . 69.8 mmtt -120.35 98.66 6.16 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 121.391 0.615 . . . . 0.0 110.287 176.624 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 5.7 t -147.32 144.8 29.05 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.523 -178.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.06 14.26 20.44 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.49 0.662 . . . . 0.0 111.127 -177.48 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -74.67 -17.0 60.75 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.302 0.573 . . . . 0.0 109.937 179.486 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -92.21 4.35 53.42 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.683 0.754 . . . . 0.0 109.541 178.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.459 ' OD1' ' HG3' ' A' ' 36' ' ' ARG . 6.1 t70 -140.74 -165.06 1.86 Allowed 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 108.558 -0.905 . . . . 0.0 108.558 -179.293 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.516 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 0.3 OUTLIER 76.26 137.14 0.06 Allowed 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.261 1.424 . . . . 0.0 112.341 177.062 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.434 HG13 ' CD2' ' A' ' 20' ' ' LEU . 39.6 pt -131.95 171.03 18.71 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.212 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.159 -177.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.516 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 24.8 t-20 -102.52 126.96 49.76 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-O 120.881 0.372 . . . . 0.0 110.162 179.096 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.468 HD23 HG12 ' A' ' 34' ' ' ILE . 2.7 mm? -118.84 141.54 48.55 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 177.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.402 ' HE2' ' HA ' ' A' ' 81' ' ' GLU . 49.4 mtmt -128.78 141.25 51.37 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-O 121.725 0.774 . . . . 0.0 110.814 -178.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.617 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 3.6 p -120.8 127.61 75.96 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.943 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.262 -177.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -120.83 131.91 54.71 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-O 121.19 0.519 . . . . 0.0 110.052 -179.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -109.19 148.01 16.94 Favored Glycine 0 N--CA 1.426 -1.98 0 C-N-CA 120.519 -0.848 . . . . 0.0 111.241 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.503 ' HG3' ' O ' ' A' ' 86' ' ' VAL . 0.0 OUTLIER -53.56 -12.31 0.46 Allowed 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 179.261 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -73.55 -21.88 60.24 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.505 0.669 . . . . 0.0 110.219 176.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.86 30.15 4.66 Favored Glycine 0 CA--C 1.501 -0.812 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.398 176.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.0 p -124.25 157.93 33.69 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 120.857 0.36 . . . . 0.0 110.735 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.617 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.7 p -149.55 139.2 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-O 121.116 0.484 . . . . 0.0 111.266 -178.263 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.4 t -122.88 138.03 54.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -108.17 144.83 35.05 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.827 0.346 . . . . 0.0 110.553 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.441 ' O ' ' HA ' ' A' ' 19' ' ' ASN . 7.0 m-85 -139.54 152.11 46.65 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.898 0.38 . . . . 0.0 110.567 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.468 HG12 HD23 ' A' ' 20' ' ' LEU . 21.2 pt -126.52 166.3 23.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.837 0.351 . . . . 0.0 110.514 -176.502 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.54 ' HB2' ' OG1' ' A' ' 38' ' ' THR . 9.5 mptt -75.6 150.8 37.95 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.459 ' HG3' ' OD1' ' A' ' 16' ' ' ASP . 4.2 ppt_? -71.79 -12.91 61.53 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 121.194 0.521 . . . . 0.0 110.951 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -103.1 -4.44 24.5 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 122.115 0.96 . . . . 0.0 108.669 179.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.54 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.8 m -86.39 135.23 36.77 Favored Pre-proline 0 C--N 1.304 -1.386 0 CA-C-N 114.799 -1.092 . . . . 0.0 110.241 -178.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -59.48 124.21 15.01 Favored 'Trans proline' 0 C--O 1.236 0.399 0 C-N-CA 122.668 2.245 . . . . 0.0 112.326 -179.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.591 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.2 pp -66.13 -17.19 64.56 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.298 0.571 . . . . 0.0 111.688 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.47 ' N ' HD13 ' A' ' 40' ' ' LEU . 3.3 p -54.25 -29.34 46.4 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.895 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -64.24 -40.99 97.16 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.461 -179.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.0 pp -73.28 -33.66 65.36 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.055 0.455 . . . . 0.0 110.074 178.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 51.6 mtm -65.66 -49.81 67.25 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.941 -178.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.413 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 38.0 mttp -67.75 -35.4 78.66 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.624 178.714 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.22 -32.02 73.44 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.146 0.498 . . . . 0.0 109.988 178.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -64.11 -55.95 18.35 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.609 178.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.443 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 17.6 p -63.16 -36.11 82.54 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.841 0.353 . . . . 0.0 111.194 -177.451 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 43.9 mt-10 -67.12 -40.35 86.8 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.92 0.391 . . . . 0.0 111.711 -179.484 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 10.3 ptm180 -84.64 -31.28 24.3 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 122.02 -0.425 . . . . 0.0 111.84 -177.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.3 mm-40 -80.7 -22.53 40.27 Favored 'General case' 0 CA--C 1.508 -0.672 0 CA-C-O 121.006 0.431 . . . . 0.0 111.747 -178.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.32 40.98 6.3 Favored Glycine 0 N--CA 1.431 -1.691 0 C-N-CA 120.153 -1.022 . . . . 0.0 111.249 -178.124 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.443 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 3.9 mm? -125.09 166.38 16.51 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.878 -0.415 . . . . 0.0 109.878 179.404 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 57.4 m -117.03 152.95 33.57 Favored 'General case' 0 C--N 1.316 -0.856 0 O-C-N 122.218 -0.301 . . . . 0.0 110.285 178.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.404 ' HE1' ' HG2' ' A' ' 45' ' ' LYS . 12.9 mmt -61.28 -27.44 68.47 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.213 0.53 . . . . 0.0 111.566 178.352 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.76 -12.34 53.92 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.518 0.675 . . . . 0.0 110.49 176.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -96.82 -16.87 20.57 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.159 -178.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.6 pt -140.37 176.75 4.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-O 121.204 0.526 . . . . 0.0 111.32 -179.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.53 ' CG ' ' HG3' ' A' ' 89' ' ' GLN . 3.3 mmt85 -151.53 140.15 20.7 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.914 178.539 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -101.39 138.77 37.96 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.415 -178.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 4.9 ttt180 -140.11 146.96 39.55 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.055 -178.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.441 ' HB2' HD13 ' A' ' 67' ' ' ILE . 78.3 t80 -152.57 143.82 23.22 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 178.253 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 54.71 24.87 5.92 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.351 0.596 . . . . 0.0 111.355 -178.193 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.38 -21.96 32.44 Favored Glycine 0 N--CA 1.443 -0.896 0 CA-C-N 116.161 -0.472 . . . . 0.0 113.141 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 8.6 pt20 -98.84 151.59 37.47 Favored Pre-proline 0 C--N 1.321 -0.639 0 O-C-N 122.434 -0.45 . . . . 0.0 111.52 -177.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -71.27 139.61 35.47 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.499 2.132 . . . . 0.0 111.36 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.441 HD13 ' HB2' ' A' ' 62' ' ' PHE . 39.0 mt -89.58 147.22 5.35 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-O 120.839 0.352 . . . . 0.0 110.418 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.412 HD21 ' HB2' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -114.84 156.83 24.2 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 178.0 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.415 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 14.6 pt-20 -73.25 -12.08 60.73 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.547 0.689 . . . . 0.0 110.997 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 16.4 p -97.61 14.24 27.34 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.344 177.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.412 ' HB2' HD21 ' A' ' 68' ' ' ASN . 2.8 t70 -98.04 151.69 20.08 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.123 0.487 . . . . 0.0 110.817 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.461 ' CG2' ' HD2' ' A' ' 73' ' ' PRO . 1.6 m -113.57 141.02 25.26 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 178.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.491 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 16.2 Cg_endo -54.39 -34.03 79.33 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 123.01 2.474 . . . . 0.0 112.263 -178.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.69 -16.14 63.29 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.865 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' A' ' 72' ' ' THR . 24.8 mm-40 -74.62 -37.49 62.8 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.093 0.473 . . . . 0.0 111.079 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -86.86 -1.24 57.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.222 -178.24 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 60.0 mm-40 58.4 33.56 23.23 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.562 0.696 . . . . 0.0 110.887 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.491 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.1 ptm -78.83 161.28 26.89 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.967 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -125.17 174.4 8.1 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 -178.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.516 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 7.0 p-10 -57.11 144.01 36.38 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 121.438 0.637 . . . . 0.0 112.08 177.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.402 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 58.2 mm-40 77.44 19.64 1.22 Allowed 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 124.901 1.28 . . . . 0.0 111.526 178.091 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.27 150.57 38.83 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.109 177.404 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 16.5 m -112.61 114.21 26.72 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 121.271 0.557 . . . . 0.0 112.053 175.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.459 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 28.9 mm -81.54 142.16 14.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.322 177.223 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -100.07 116.23 31.61 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-O 120.615 0.245 . . . . 0.0 111.102 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.506 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 67.6 t -114.71 135.66 53.86 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-O 121.041 0.448 . . . . 0.0 110.762 177.225 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . 0.403 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 10.7 p90 -135.5 153.77 51.63 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.931 -179.248 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.35 120.92 23.04 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.456 0.646 . . . . 0.0 112.11 -175.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.53 ' HG3' ' CG ' ' A' ' 59' ' ' ARG . 30.3 mm-40 -110.43 19.14 19.09 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.686 177.329 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -51.09 -39.42 56.05 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.124 0.487 . . . . 0.0 110.8 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 86.4 m -87.36 112.26 21.93 Favored 'General case' 0 N--CA 1.437 -1.1 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 176.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 71.61 62.77 3.3 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 121.125 -0.56 . . . . 0.0 112.315 -177.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.177 0 CA-C-O 118.679 -1.067 . . . . 0.0 111.814 -179.186 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.6 ptt? . . . . . 0 N--CA 1.483 1.185 0 CA-C-O 120.871 0.367 . . . . 0.0 111.431 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -107.64 37.37 2.44 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.707 0.765 . . . . 0.0 109.658 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -68.42 -28.39 67.03 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.358 -177.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -64.92 -67.97 0.4 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.682 -178.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -160.2 154.11 19.46 Favored Pre-proline 0 C--N 1.311 -1.105 0 CA-C-N 116.651 -0.249 . . . . 0.0 110.879 -178.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -81.72 -166.02 0.37 Allowed 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.616 2.21 . . . . 0.0 112.073 176.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -123.5 20.19 9.56 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.48 0.657 . . . . 0.0 110.717 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -131.75 176.5 8.29 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.887 -177.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 86.9 -81.66 1.67 Allowed Glycine 0 N--CA 1.435 -1.377 0 N-CA-C 109.84 -1.304 . . . . 0.0 109.84 -178.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 58.1 t -136.29 122.46 30.21 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.58 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 177.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.496 ' C ' ' HD2' ' A' ' 11' ' ' LYS . 3.4 tmmm? -137.95 138.89 39.4 Favored 'General case' 0 N--CA 1.428 -1.542 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 -175.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.467 ' N ' ' HD2' ' A' ' 11' ' ' LYS . 0.5 OUTLIER -145.17 139.73 27.45 Favored 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 177.534 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -151.27 163.06 39.76 Favored 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 179.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -89.66 11.99 18.18 Favored 'General case' 0 C--N 1.317 -0.834 0 O-C-N 122.106 -0.371 . . . . 0.0 111.081 -174.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 12.8 m120 63.4 25.89 14.73 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 -174.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -74.78 103.66 5.12 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 113.635 -1.621 . . . . 0.0 109.008 -179.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.583 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 38.8 p-80 -123.37 161.38 24.83 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.609 -173.074 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 29.7 pt -132.86 170.13 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.244 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.64 178.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.489 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 27.5 t-20 -105.2 129.42 53.58 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 178.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.458 HD22 HG12 ' A' ' 34' ' ' ILE . 2.7 mm? -117.38 142.48 47.06 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -127.56 140.59 52.02 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-O 121.477 0.655 . . . . 0.0 110.155 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.61 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 2.7 p -120.89 126.12 74.85 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.035 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.808 -176.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -115.2 128.22 56.02 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.263 0.554 . . . . 0.0 110.154 -178.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.416 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -99.87 158.66 19.65 Favored Glycine 0 N--CA 1.43 -1.714 0 C-N-CA 120.335 -0.936 . . . . 0.0 111.312 179.421 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.67 -16.49 1.66 Allowed 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 177.668 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -77.38 -21.6 52.97 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.458 0.647 . . . . 0.0 110.844 178.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.01 -8.55 45.77 Favored Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.915 -0.659 . . . . 0.0 111.928 -178.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.9 t -78.85 153.99 30.17 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.61 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.7 p -149.75 140.57 16.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 120.875 0.369 . . . . 0.0 111.071 -177.404 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.4 HG13 ' HD3' ' A' ' 50' ' ' ARG . 4.7 t -123.2 139.59 49.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.483 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -108.82 142.34 39.54 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.842 0.353 . . . . 0.0 110.674 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.413 ' O ' ' HA ' ' A' ' 19' ' ' ASN . 16.7 m-85 -136.4 154.05 50.92 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.289 0.566 . . . . 0.0 111.293 -177.704 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.458 HG12 HD22 ' A' ' 20' ' ' LEU . 27.2 pt -134.0 162.37 39.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 120.844 0.354 . . . . 0.0 110.097 -178.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.583 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 0.0 OUTLIER -77.34 150.01 35.22 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.553 179.843 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 3.4 ppt_? -70.41 -8.35 50.15 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.673 0.749 . . . . 0.0 110.211 179.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 30.1 t-80 -104.48 -8.22 19.25 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 -179.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 m -87.16 137.9 32.72 Favored Pre-proline 0 N--CA 1.44 -0.956 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.108 179.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -60.7 126.48 19.9 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.374 2.05 . . . . 0.0 112.176 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.5 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.3 pp -67.21 -17.75 64.95 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -178.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.462 ' N ' HD12 ' A' ' 40' ' ' LEU . 2.8 p -55.89 -28.86 58.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.886 0.374 . . . . 0.0 111.831 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -60.29 -46.24 90.54 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 120.928 0.394 . . . . 0.0 110.375 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.8 pp -71.83 -35.65 69.95 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.043 0.449 . . . . 0.0 110.436 179.27 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 47.6 mtm -63.07 -46.01 89.46 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.18 0.514 . . . . 0.0 110.863 -178.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.533 ' HB3' ' HZ3' ' A' ' 45' ' ' LYS . 7.5 mtpm? -69.84 -37.05 76.05 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.44 178.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.424 ' O ' ' HG2' ' A' ' 50' ' ' ARG . . . -62.27 -37.76 86.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.157 0.503 . . . . 0.0 109.945 178.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -58.42 -55.64 32.44 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.184 177.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.617 ' SG ' HD11 ' A' ' 58' ' ' ILE . 22.5 m -60.24 -44.93 94.81 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.339 0.59 . . . . 0.0 110.741 -177.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -67.32 -30.85 70.8 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 112.824 0.676 . . . . 0.0 112.824 -176.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.424 ' HG2' ' O ' ' A' ' 46' ' ' ALA . 13.8 ptm180 -90.65 -34.06 15.58 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.823 -0.548 . . . . 0.0 111.551 179.141 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 21.4 mm-40 -78.52 -21.82 48.27 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 121.154 0.502 . . . . 0.0 111.924 -178.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.82 39.83 6.45 Favored Glycine 0 N--CA 1.432 -1.614 0 C-N-CA 119.947 -1.12 . . . . 0.0 110.933 -177.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -123.81 166.18 16.04 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.409 ' HB2' ' HB2' ' A' ' 57' ' ' GLN . 9.7 m -118.31 155.27 30.93 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 178.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.6 mmt -61.93 -28.16 69.34 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-O 121.451 0.644 . . . . 0.0 111.185 177.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.27 -17.89 38.19 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.44 0.638 . . . . 0.0 110.841 177.537 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.409 ' HB2' ' HB2' ' A' ' 54' ' ' SER . 2.8 mp0 -88.58 -25.8 22.28 Favored 'General case' 0 CA--C 1.504 -0.807 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.815 -177.512 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.617 HD11 ' SG ' ' A' ' 48' ' ' CYS . 12.0 pt -133.27 178.65 5.32 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.157 0 CA-C-O 121.497 0.665 . . . . 0.0 112.532 -178.273 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 6.7 mmt180 -148.4 139.4 23.13 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.303 177.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -99.69 141.68 32.17 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.886 179.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -142.33 143.79 32.91 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-O 121.006 0.431 . . . . 0.0 110.937 -176.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -149.28 146.21 27.45 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 17.9 t70 56.82 22.83 7.39 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-O 121.778 0.799 . . . . 0.0 110.481 -178.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.19 -21.05 26.44 Favored Glycine 0 N--CA 1.429 -1.817 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.562 -179.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -95.72 156.46 37.34 Favored Pre-proline 0 C--N 1.329 -0.313 0 O-C-N 122.575 -0.368 . . . . 0.0 111.131 -178.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -77.17 142.04 21.24 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 122.496 2.131 . . . . 0.0 111.589 178.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 38.8 mt -90.04 153.41 3.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 120.949 0.404 . . . . 0.0 110.589 -178.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.524 HD21 ' HB2' ' A' ' 71' ' ' ASP . 0.1 OUTLIER -116.38 162.82 16.95 Favored 'General case' 0 CA--C 1.498 -1.038 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 178.889 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.431 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 0.8 OUTLIER -75.27 -18.82 59.99 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-O 121.39 0.614 . . . . 0.0 110.349 178.984 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 8.3 t -98.96 11.97 37.33 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.375 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.524 ' HB2' HD21 ' A' ' 68' ' ' ASN . 0.9 OUTLIER -95.53 154.09 17.38 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-O 120.959 0.409 . . . . 0.0 110.596 -179.594 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -114.03 147.83 38.66 Favored Pre-proline 0 C--N 1.316 -0.891 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.249 178.575 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.559 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 18.6 Cg_endo -58.91 -28.65 88.1 Favored 'Trans proline' 0 C--O 1.238 0.514 0 C-N-CA 122.79 2.327 . . . . 0.0 112.018 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -77.91 -14.77 59.44 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.506 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.8 tp60 -68.32 -42.35 79.5 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.653 0.74 . . . . 0.0 109.56 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -91.05 -1.8 57.74 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.146 -179.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 56.94 34.75 25.37 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.277 179.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.559 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 4.7 ptm -68.92 159.8 31.99 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.012 0.434 . . . . 0.0 110.851 -178.357 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -115.98 166.53 11.89 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.173 -176.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.489 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 9.7 p-10 -61.1 141.37 57.47 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.39 0.614 . . . . 0.0 111.775 177.014 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 81.83 17.06 0.43 Allowed 'General case' 0 C--O 1.236 0.355 0 C-N-CA 125.419 1.487 . . . . 0.0 110.877 -179.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.423 ' OD1' HD11 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -61.52 148.73 41.12 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.523 178.496 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 29.4 m -111.07 110.52 21.1 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 121.419 0.628 . . . . 0.0 112.252 176.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.443 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 28.1 mm -79.45 139.37 18.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.523 177.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -98.12 113.86 25.88 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.915 0.388 . . . . 0.0 110.541 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.416 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 82.0 t -111.55 134.72 53.03 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 CA-C-O 121.292 0.568 . . . . 0.0 111.019 178.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -131.27 166.78 20.43 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.546 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.506 ' NE2' HG21 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -95.1 133.02 39.37 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.597 0.713 . . . . 0.0 111.93 -174.387 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 -110.14 14.07 22.98 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.717 177.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.406 ' HB2' ' OE1' ' A' ' 57' ' ' GLN . 4.9 tp-100 -110.19 115.51 29.86 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.115 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.9 t -159.01 144.86 16.5 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.701 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 150.88 121.39 1.0 Allowed Glycine 0 N--CA 1.443 -0.895 0 N-CA-C 111.253 -0.739 . . . . 0.0 111.253 179.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.332 0 CA-C-O 118.192 -1.338 . . . . 0.0 110.967 -178.236 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ptt? . . . . . 0 N--CA 1.485 1.276 0 CA-C-O 121.207 0.527 . . . . 0.0 110.857 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -128.35 12.54 6.51 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.473 0.654 . . . . 0.0 109.661 177.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -95.45 -12.02 26.6 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 121.703 0.763 . . . . 0.0 109.273 -178.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -85.11 47.81 1.47 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.78 -179.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 49.4 mtpt 57.28 102.57 0.03 OUTLIER Pre-proline 0 CA--C 1.534 0.36 0 C-N-CA 123.593 0.757 . . . . 0.0 112.862 -177.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -81.33 -177.95 3.98 Favored 'Trans proline' 0 N--CA 1.453 -0.904 0 C-N-CA 122.598 2.199 . . . . 0.0 111.138 177.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.421 ' HG2' ' HG2' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -48.91 -35.58 15.24 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.928 0.394 . . . . 0.0 110.872 175.918 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.421 ' HG2' ' HG2' ' A' ' 7' ' ' LYS . 12.8 pt-20 -172.77 167.85 5.19 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 122.887 0.475 . . . . 0.0 110.046 175.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -74.73 -42.18 32.47 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 121.232 -0.509 . . . . 0.0 113.654 -177.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.0 p -77.35 127.32 38.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.569 0.7 . . . . 0.0 111.25 -178.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.5 mtmm -100.95 141.83 33.28 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.365 179.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.9 t -148.92 139.38 22.51 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.14 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -92.72 -71.59 0.64 Allowed 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -176.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.8 m-80 59.42 19.78 8.11 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-O 121.185 0.517 . . . . 0.0 110.505 -176.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.8 p30 -132.61 176.27 8.59 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.055 0.455 . . . . 0.0 110.362 -177.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -111.84 106.18 14.84 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.838 0.828 . . . . 0.0 110.443 177.526 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 11.4 p-80 -120.54 154.25 35.59 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.682 -178.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 29.2 pt -127.53 170.91 16.62 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.122 0 CA-C-O 121.295 0.569 . . . . 0.0 110.725 -178.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.44 ' HA ' ' O ' ' A' ' 32' ' ' PHE . 25.3 t-20 -107.28 122.5 46.67 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.838 179.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.423 HD13 ' OD2' ' A' ' 82' ' ' ASP . 2.8 mm? -113.16 139.58 48.64 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 178.558 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -125.01 141.29 52.22 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 -178.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.565 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 85.6 t -120.7 130.31 74.69 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.697 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.121 -177.118 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -116.37 123.81 48.53 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-O 121.293 0.568 . . . . 0.0 110.295 -179.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.455 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -96.13 158.72 21.84 Favored Glycine 0 N--CA 1.426 -2.001 0 C-N-CA 120.238 -0.982 . . . . 0.0 110.98 178.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -52.57 -16.42 0.92 Allowed 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 178.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -76.14 -22.13 55.8 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.387 0.613 . . . . 0.0 110.854 178.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 99.33 9.93 49.54 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 -177.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.4 t -96.45 125.05 40.67 Favored 'General case' 0 N--CA 1.44 -0.94 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.565 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 16.3 t -118.08 141.16 38.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 121.062 0.458 . . . . 0.0 110.953 -179.008 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.426 HG13 ' HD3' ' A' ' 50' ' ' ARG . 16.2 t -124.56 138.7 53.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 178.163 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -107.89 142.41 38.01 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.748 0.308 . . . . 0.0 110.591 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.49 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 15.9 m-85 -134.83 151.63 51.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.99 0.424 . . . . 0.0 110.687 -178.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 22.3 pt -132.75 167.52 26.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 O-C-N 122.139 -0.35 . . . . 0.0 110.48 -178.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 86.3 mttt -77.28 150.36 35.3 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 178.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.4 ptt180 -69.37 -18.47 63.78 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.302 0.573 . . . . 0.0 111.092 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 49.3 t-80 -103.33 -1.14 29.2 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 122.329 1.061 . . . . 0.0 108.867 -176.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.441 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.7 m -91.17 138.21 25.94 Favored Pre-proline 0 C--N 1.304 -1.381 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.46 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -58.0 120.06 7.71 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.676 2.251 . . . . 0.0 112.085 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.587 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.3 pt? -66.93 -15.95 64.02 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.21 0.529 . . . . 0.0 111.364 -179.022 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.518 ' HB2' ' O ' ' A' ' 69' ' ' GLU . 44.4 t -49.71 -32.87 14.41 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.219 177.5 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 39.2 mtmt -60.57 -47.48 86.02 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 120.978 0.418 . . . . 0.0 110.305 179.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.2 pp -72.67 -35.75 67.77 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.468 -179.456 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 63.3 mtm -62.61 -48.0 81.29 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 120.997 0.427 . . . . 0.0 110.831 179.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.442 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 47.9 mttp -66.72 -35.57 80.42 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.144 0.497 . . . . 0.0 110.344 177.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.83 -35.31 80.19 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.297 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -63.5 -54.38 37.18 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.788 178.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 22.5 p -64.01 -36.4 83.86 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 120.726 0.298 . . . . 0.0 111.314 -176.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.442 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 44.3 mt-10 -66.6 -42.05 87.51 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.749 0.309 . . . . 0.0 111.673 -179.172 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.426 ' HD3' HG13 ' A' ' 30' ' ' VAL . 9.9 ptm180 -79.21 -27.03 42.52 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.251 0.548 . . . . 0.0 110.77 -178.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 23.4 mm-40 -84.03 -20.64 32.39 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 94.29 7.04 61.01 Favored Glycine 0 N--CA 1.444 -0.803 0 C-N-CA 120.339 -0.934 . . . . 0.0 112.817 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -98.13 174.27 6.61 Favored 'General case' 0 C--N 1.321 -0.672 0 O-C-N 122.071 -0.664 . . . . 0.0 111.199 -179.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 16.8 m -125.1 158.84 32.86 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.617 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.0 mmt -62.87 -27.21 69.19 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.134 0.492 . . . . 0.0 111.954 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.421 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.18 -14.38 47.08 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.482 0.658 . . . . 0.0 110.527 177.485 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -92.1 -25.87 18.55 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.779 -178.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.438 HG23 ' NE2' ' A' ' 88' ' ' GLN . 12.8 pt -136.42 178.93 4.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.181 0.515 . . . . 0.0 111.442 -178.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.448 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 7.8 mmt180 -154.74 140.9 18.49 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.708 177.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -97.91 142.35 29.76 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.639 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.01 137.98 28.06 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-O 121.119 0.485 . . . . 0.0 111.029 -176.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -143.64 147.48 34.39 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.9 t70 59.43 21.2 9.58 Favored 'General case' 0 N--CA 1.482 1.16 0 CA-C-O 122.181 0.991 . . . . 0.0 109.701 -178.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.15 -20.36 21.65 Favored Glycine 0 N--CA 1.42 -2.394 0 CA-C-N 115.532 -0.758 . . . . 0.0 112.299 -178.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -95.6 149.53 36.21 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-O 121.124 0.488 . . . . 0.0 111.336 -177.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_exo -66.57 138.08 48.58 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.787 2.325 . . . . 0.0 111.823 177.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 53.2 mt -89.04 150.57 3.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 110.17 -0.307 . . . . 0.0 110.17 179.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.572 HD21 ' HB2' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -120.2 152.99 36.91 Favored 'General case' 0 CA--C 1.502 -0.897 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 177.865 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.518 ' O ' ' HB2' ' A' ' 41' ' ' SER . 7.3 pt-20 -72.59 -18.07 61.64 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-O 121.296 0.57 . . . . 0.0 111.569 -177.655 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.9 t -92.98 7.7 42.96 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-O 120.934 0.397 . . . . 0.0 111.383 -178.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.572 ' HB2' HD21 ' A' ' 68' ' ' ASN . 0.9 OUTLIER -101.05 171.77 7.42 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.204 0.526 . . . . 0.0 111.335 -179.678 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.427 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.6 OUTLIER -124.29 149.8 62.08 Favored Pre-proline 0 C--N 1.319 -0.758 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.877 177.901 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.6 -31.39 92.17 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.056 2.504 . . . . 0.0 112.684 -178.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.63 -18.9 63.63 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.938 0.399 . . . . 0.0 111.346 -179.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.427 ' HB2' ' O ' ' A' ' 72' ' ' THR . 26.4 mm-40 -70.67 -37.85 73.69 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.212 0.529 . . . . 0.0 110.685 178.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.402 HD11 ' H ' ' A' ' 76' ' ' LEU . 0.9 OUTLIER -90.52 5.9 45.82 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 179.433 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 45.43 33.68 1.37 Allowed 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.004 1.322 . . . . 0.0 112.213 -179.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.1 ptm -69.6 160.89 30.71 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.366 -179.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -119.76 166.96 12.56 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.258 -176.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.459 ' O ' ' HB2' ' A' ' 81' ' ' GLU . 5.9 p-10 -59.84 145.61 44.96 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.119 0.485 . . . . 0.0 111.579 177.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.459 ' HB2' ' O ' ' A' ' 80' ' ' ASP . 3.4 mm-40 79.8 16.3 0.82 Allowed 'General case' 0 C--O 1.233 0.213 0 C-N-CA 124.862 1.265 . . . . 0.0 110.936 -178.845 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.423 ' OD2' HD13 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -63.84 147.97 50.52 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.161 177.956 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 11.7 m -110.87 110.33 20.88 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.43 0.633 . . . . 0.0 111.748 176.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.537 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 13.2 mm -80.02 139.67 17.89 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.216 178.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -96.79 113.07 24.59 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.887 0.375 . . . . 0.0 110.582 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.455 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 43.9 t -111.02 134.82 52.09 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 CA-C-O 121.55 0.69 . . . . 0.0 110.808 177.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.6 p90 -134.2 153.89 51.57 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.81 -178.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.438 ' NE2' HG23 ' A' ' 58' ' ' ILE . 4.9 tp60 -78.49 114.12 17.11 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.044 0.45 . . . . 0.0 110.824 -177.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 -106.36 18.93 21.28 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.479 0.657 . . . . 0.0 110.061 178.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -65.03 -25.36 67.8 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.591 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.9 t -108.09 129.88 55.13 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 121.062 0.458 . . . . 0.0 110.749 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -128.5 119.49 3.07 Favored Glycine 0 N--CA 1.444 -0.809 0 C-N-CA 120.824 -0.703 . . . . 0.0 111.36 178.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.136 0 CA-C-O 118.545 -1.142 . . . . 0.0 111.463 -179.328 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ttt . . . . . 0 N--CA 1.48 1.07 0 CA-C-O 120.993 0.425 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -95.3 66.63 2.9 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 176.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -84.44 -38.76 19.77 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.055 -175.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -89.92 105.85 18.08 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-O 120.981 0.419 . . . . 0.0 111.454 -176.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.0 ptpp? -65.72 148.63 98.09 Favored Pre-proline 0 C--N 1.326 -0.453 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 176.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_endo -60.11 -172.93 0.08 OUTLIER 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.522 2.148 . . . . 0.0 113.45 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.44 18.22 6.45 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.721 -178.725 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -97.73 81.11 2.86 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-O 121.058 0.456 . . . . 0.0 111.028 -178.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 175.16 84.13 0.06 OUTLIER Glycine 0 C--N 1.301 -1.372 0 C-N-CA 120.661 -0.78 . . . . 0.0 111.154 177.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 13.0 p -77.25 49.84 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 CA-C-O 123.135 1.445 . . . . 0.0 112.083 -178.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -128.37 107.59 9.88 Favored 'General case' 0 C--N 1.281 -2.393 0 N-CA-C 107.513 -1.291 . . . . 0.0 107.513 176.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 4.2 t -114.54 137.05 52.34 Favored 'General case' 0 N--CA 1.427 -1.605 0 O-C-N 121.608 -0.682 . . . . 0.0 109.987 -177.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -69.39 -8.81 49.89 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-O 121.246 0.545 . . . . 0.0 111.824 178.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -91.28 64.36 5.16 Favored 'General case' 0 C--N 1.316 -0.858 0 O-C-N 121.907 -0.496 . . . . 0.0 112.218 -177.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -160.24 138.46 10.09 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 122.127 -0.358 . . . . 0.0 110.937 177.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.448 ' O ' ' HA ' ' A' ' 35' ' ' LYS . 28.6 t70 61.06 35.23 18.86 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 121.537 0.684 . . . . 0.0 111.121 172.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.531 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 30.5 p-80 -122.2 151.4 41.06 Favored 'General case' 0 C--N 1.323 -0.586 0 O-C-N 121.327 -0.858 . . . . 0.0 112.613 -176.019 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 35.0 pt -133.19 170.74 19.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.94 179.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.48 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 11.2 m120 -97.29 138.57 34.55 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 178.091 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.451 HD21 HG12 ' A' ' 34' ' ' ILE . 3.2 mm? -130.14 138.26 50.56 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 174.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -126.25 142.4 51.54 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-O 121.175 0.512 . . . . 0.0 110.334 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.564 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 90.4 t -124.02 133.91 67.99 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.147 -177.388 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -111.46 129.13 56.13 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 121.211 0.529 . . . . 0.0 110.945 -177.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -100.47 167.28 20.05 Favored Glycine 0 N--CA 1.435 -1.397 0 C-N-CA 121.238 -0.505 . . . . 0.0 111.874 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.656 ' NE2' ' H ' ' A' ' 25' ' ' GLN . 0.2 OUTLIER -65.64 -30.19 70.86 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.44 0.638 . . . . 0.0 110.487 -177.075 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -73.67 -12.78 60.84 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.1 -178.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 102.3 0.61 50.69 Favored Glycine 0 C--O 1.227 -0.327 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.167 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.9 t -82.52 149.08 27.73 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 120.895 0.379 . . . . 0.0 110.202 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.564 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 47.5 t -142.7 135.28 26.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 -177.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.8 t -120.79 136.24 58.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -104.36 140.34 38.03 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.75 0.309 . . . . 0.0 110.266 178.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.412 ' O ' ' HA ' ' A' ' 19' ' ' ASN . 19.8 m-85 -130.3 157.29 42.94 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.016 0.436 . . . . 0.0 111.215 -178.406 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ALY . . . . . 0.415 ' HD3' ' ND2' ' A' ' 19' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.451 HG12 HD21 ' A' ' 20' ' ' LEU . 20.9 pt -134.43 165.46 31.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 120.945 0.402 . . . . 0.0 111.013 -176.827 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.531 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 23.8 mtpp -77.7 146.23 36.11 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.995 0.426 . . . . 0.0 110.632 178.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.4 ppt_? -71.8 -13.71 61.77 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.314 0.578 . . . . 0.0 111.025 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 32.0 t60 -98.91 -5.38 30.87 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.475 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.8 m -91.66 136.17 26.86 Favored Pre-proline 0 C--N 1.305 -1.341 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.321 -178.42 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.91 126.19 19.03 Favored 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 122.473 2.115 . . . . 0.0 111.83 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.556 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.2 pp -64.78 -16.55 63.19 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.777 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.497 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 4.0 p -51.8 -31.96 29.35 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 122.873 0.469 . . . . 0.0 111.679 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -61.67 -49.13 77.75 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.01 0.433 . . . . 0.0 110.342 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.556 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.6 pp -67.48 -35.08 78.46 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 121.053 0.454 . . . . 0.0 110.142 179.357 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 48.3 mtm -63.55 -49.3 73.98 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 121.087 0.47 . . . . 0.0 110.896 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.418 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 16.5 mtpp -67.54 -36.94 81.96 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.269 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.426 ' O ' ' HG2' ' A' ' 50' ' ' ARG . . . -62.03 -38.8 90.06 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.128 0.489 . . . . 0.0 109.851 178.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -58.74 -53.71 55.33 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.108 177.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 29.6 p -65.99 -36.51 83.48 Favored 'General case' 0 N--CA 1.453 -0.285 0 O-C-N 121.981 -0.449 . . . . 0.0 111.184 -177.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.418 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 45.2 mt-10 -66.11 -40.2 90.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.797 0.332 . . . . 0.0 111.547 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.426 ' HG2' ' O ' ' A' ' 46' ' ' ALA . 13.9 ptm180 -80.29 -30.5 38.26 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.052 0.453 . . . . 0.0 111.117 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -83.97 -16.13 45.23 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -178.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 92.61 6.77 63.76 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 119.955 -1.117 . . . . 0.0 112.954 179.065 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -98.94 175.22 6.01 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.444 0.64 . . . . 0.0 111.197 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.413 ' HB2' ' OE1' ' A' ' 57' ' ' GLN . 68.7 m -126.06 159.89 31.58 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.652 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.6 mmt -66.43 -25.16 66.62 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.3 0.572 . . . . 0.0 111.428 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.32 -18.34 34.14 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.677 0.751 . . . . 0.0 110.285 176.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.535 ' HA ' ' HG2' ' A' ' 90' ' ' GLN . 1.3 mp0 -89.2 -28.15 20.17 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.812 -179.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 11.2 pt -136.46 177.29 6.44 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 CA-C-O 121.354 0.597 . . . . 0.0 112.007 -177.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.462 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 15.9 mmt180 -151.9 143.43 23.5 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.65 178.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -99.01 144.73 27.82 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.71 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.604 ' HG2' ' N ' ' A' ' 62' ' ' PHE . 0.8 OUTLIER -142.14 151.0 41.84 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-O 121.224 0.535 . . . . 0.0 111.211 -177.521 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.604 ' N ' ' HG2' ' A' ' 61' ' ' ARG . 66.7 t80 -155.77 146.81 22.38 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 177.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 22.5 t70 56.72 23.88 8.39 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-O 121.795 0.807 . . . . 0.0 110.251 -177.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.38 -16.41 29.75 Favored Glycine 0 N--CA 1.431 -1.638 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.945 -178.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -97.99 147.41 33.03 Favored Pre-proline 0 C--N 1.326 -0.44 0 O-C-N 122.414 -0.462 . . . . 0.0 110.716 -179.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.97 138.77 34.65 Favored 'Trans proline' 0 CA--C 1.533 0.465 0 C-N-CA 122.544 2.163 . . . . 0.0 112.091 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 31.6 mt -88.14 151.96 3.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 120.889 0.376 . . . . 0.0 110.285 -178.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -128.79 172.08 11.62 Favored 'General case' 0 CA--C 1.499 -1.003 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.497 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 7.1 pt-20 -78.77 -8.43 58.75 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 121.508 0.671 . . . . 0.0 110.064 177.197 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 23.5 p -93.29 -1.77 55.68 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.158 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -104.0 144.03 32.08 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.299 0.571 . . . . 0.0 112.277 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.515 ' OG1' ' HG2' ' A' ' 75' ' ' GLN . 0.6 OUTLIER -111.65 157.95 37.87 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.981 176.612 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.547 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 17.9 Cg_endo -58.59 -28.62 86.52 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.755 2.303 . . . . 0.0 112.16 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -78.87 -10.74 59.9 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.907 -178.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.515 ' HG2' ' OG1' ' A' ' 72' ' ' THR . 23.5 mm-40 -79.26 -38.88 34.42 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.1 0.476 . . . . 0.0 111.683 -178.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.438 HD13 ' H ' ' A' ' 76' ' ' LEU . 0.0 OUTLIER -93.59 1.01 56.81 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 179.621 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 54.01 48.64 20.66 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.815 0.817 . . . . 0.0 110.705 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.547 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.4 ptm -82.42 152.96 25.93 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.283 -179.325 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.53 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 13.3 pt-20 -99.34 163.97 12.31 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.142 -177.274 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.48 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 7.3 p-10 -57.37 143.93 38.11 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 121.36 0.6 . . . . 0.0 110.737 173.481 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 68.07 20.98 8.9 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.821 -179.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.53 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 0.5 OUTLIER -69.56 155.39 40.56 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 120.414 -0.514 . . . . 0.0 109.976 179.218 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 24.4 m -102.1 119.93 39.61 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 -174.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.514 HG13 HG23 ' A' ' 22' ' ' VAL . 19.8 mm -90.5 136.53 23.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.292 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -100.67 118.59 37.11 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.064 0.459 . . . . 0.0 110.676 178.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.462 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 76.1 t -111.14 140.39 30.64 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.518 0 CA-C-O 121.051 0.453 . . . . 0.0 110.0 177.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.3 p90 -136.31 153.66 51.09 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -83.46 117.48 23.1 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 121.144 0.497 . . . . 0.0 110.714 -176.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.47 ' HA ' ' OE1' ' A' ' 89' ' ' GLN . 11.6 mm-40 -90.43 20.86 4.22 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.437 0.637 . . . . 0.0 111.293 178.763 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.535 ' HG2' ' HA ' ' A' ' 57' ' ' GLN . 5.9 mm100 -106.53 107.88 19.11 Favored 'General case' 0 C--N 1.314 -0.977 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 177.406 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 20.6 m -87.96 99.19 11.96 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-O 121.212 0.529 . . . . 0.0 110.716 -178.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -171.87 167.44 40.46 Favored Glycine 0 N--CA 1.442 -0.953 0 C-N-CA 121.005 -0.617 . . . . 0.0 111.859 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.913 0 CA-C-O 118.575 -1.125 . . . . 0.0 111.782 179.515 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 pmm? . . . . . 0 N--CA 1.477 0.916 0 CA-C-O 120.994 0.426 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -98.07 2.2 48.48 Favored 'General case' 0 C--N 1.33 -0.255 0 O-C-N 122.015 -0.428 . . . . 0.0 111.804 -177.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -97.15 12.73 31.73 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 122.047 0.927 . . . . 0.0 110.0 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -72.85 86.2 1.26 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.884 178.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.8 mmpt? 44.58 73.34 0.98 Allowed Pre-proline 0 N--CA 1.472 0.675 0 C-N-CA 123.894 0.877 . . . . 0.0 112.283 -179.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.461 ' HB2' ' OE2' ' A' ' 8' ' ' GLU . 58.5 Cg_endo -75.82 169.37 22.36 Favored 'Trans proline' 0 N--CA 1.458 -0.584 0 C-N-CA 122.199 1.933 . . . . 0.0 112.202 179.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.01 -3.81 8.12 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 179.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.461 ' OE2' ' HB2' ' A' ' 6' ' ' PRO . 1.4 mp0 -74.16 158.67 33.75 Favored 'General case' 0 C--N 1.321 -0.636 0 O-C-N 121.988 -0.445 . . . . 0.0 110.512 178.342 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 113.67 -13.14 22.78 Favored Glycine 0 N--CA 1.444 -0.796 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 -178.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 59.2 t -76.35 152.01 6.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 178.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.72 114.61 3.4 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.126 0.489 . . . . 0.0 110.415 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -130.12 103.99 7.06 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-O 121.058 0.456 . . . . 0.0 111.059 -179.163 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -137.27 153.68 50.28 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.798 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 69.51 25.86 5.26 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-O 122.044 0.926 . . . . 0.0 109.166 176.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.0 p-10 -113.58 15.39 18.94 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.173 -176.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.4 t70 71.99 57.68 0.16 Allowed 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 121.717 0.77 . . . . 0.0 111.501 176.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.481 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 22.0 p-80 -126.79 158.6 36.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.233 177.538 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 42.8 pt -136.87 170.65 17.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.443 -179.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 23.2 t-20 -105.51 134.2 49.01 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.179 179.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.497 HD13 ' OD1' ' A' ' 82' ' ' ASP . 2.7 mm? -126.41 145.07 50.62 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 177.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -129.86 144.24 51.21 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-O 121.297 0.57 . . . . 0.0 110.402 -178.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.635 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 4.7 p -125.01 132.25 71.54 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.874 -176.623 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -122.33 138.74 54.41 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.18 0.514 . . . . 0.0 110.662 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -112.98 160.4 13.14 Favored Glycine 0 N--CA 1.437 -1.275 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -62.71 -19.13 63.6 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.677 0.751 . . . . 0.0 110.02 -179.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -81.27 11.01 4.66 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.871 -177.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 71.45 39.52 61.25 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 119.893 -1.146 . . . . 0.0 113.186 179.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.5 t -132.06 147.37 52.44 Favored 'General case' 0 C--N 1.31 -1.114 0 O-C-N 122.038 -0.683 . . . . 0.0 110.287 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.635 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.5 p -146.72 137.16 17.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.124 0.488 . . . . 0.0 111.523 -178.327 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 t -123.85 138.05 54.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 178.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -107.8 140.73 40.45 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.819 0.342 . . . . 0.0 110.939 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -133.65 160.43 37.53 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.125 0.488 . . . . 0.0 111.31 -177.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.48 HG12 HD21 ' A' ' 20' ' ' LEU . 21.2 pt -127.53 179.14 3.89 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.646 0 O-C-N 122.147 -0.346 . . . . 0.0 110.309 -178.209 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.481 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 1.7 mtpm? -94.82 151.11 19.51 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-O 120.903 0.383 . . . . 0.0 110.269 -178.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.9 ptt180 -67.08 -23.95 65.91 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.043 0.449 . . . . 0.0 111.762 -177.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -103.13 3.15 35.54 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 122.341 1.067 . . . . 0.0 109.044 -176.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.473 ' OG1' ' HD3' ' A' ' 35' ' ' LYS . 1.8 m -95.87 138.26 21.73 Favored Pre-proline 0 N--CA 1.428 -1.57 0 CA-C-N 114.523 -1.217 . . . . 0.0 110.186 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -58.46 122.37 11.56 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.777 2.318 . . . . 0.0 112.149 -178.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.501 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.0 OUTLIER -70.37 -16.17 62.94 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.328 0.585 . . . . 0.0 111.242 -179.318 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.441 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 4.2 p -50.68 -29.75 11.95 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.554 178.286 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -60.49 -47.93 83.99 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.21 0.528 . . . . 0.0 110.016 177.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.0 OUTLIER -69.6 -37.74 77.01 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.019 179.089 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 57.4 mtm -61.95 -46.78 87.81 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 120.941 0.401 . . . . 0.0 111.287 -179.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.4 ' HE2' ' HB3' ' A' ' 45' ' ' LYS . 30.7 mtpt -67.3 -38.1 84.43 Favored 'General case' 0 CA--C 1.511 -0.529 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.578 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.39 -34.66 77.16 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.174 0.512 . . . . 0.0 109.947 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -62.5 -56.54 17.13 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.771 177.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.423 ' SG ' ' HE2' ' A' ' 55' ' ' MET . 25.8 p -65.42 -37.07 85.82 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 122.091 -0.38 . . . . 0.0 111.512 -176.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -70.72 -29.78 66.15 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -178.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 10.2 ptm85 -89.77 -30.88 17.7 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 121.961 -0.462 . . . . 0.0 111.13 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -80.61 -22.53 40.53 Favored 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -178.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.68 40.07 6.07 Favored Glycine 0 N--CA 1.434 -1.483 0 C-N-CA 120.012 -1.089 . . . . 0.0 110.949 -177.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -126.21 166.27 17.39 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 178.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 72.0 m -119.54 153.31 35.58 Favored 'General case' 0 C--N 1.309 -1.169 0 O-C-N 122.188 -0.32 . . . . 0.0 110.66 178.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.423 ' HE2' ' SG ' ' A' ' 48' ' ' CYS . 14.3 mmt -61.52 -25.67 67.43 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.149 0.499 . . . . 0.0 112.08 179.492 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.2 -13.46 49.9 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.563 0.697 . . . . 0.0 110.409 176.698 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -94.3 -28.27 15.67 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.648 -0.706 . . . . 0.0 112.188 -177.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.454 HG23 ' NE2' ' A' ' 88' ' ' GLN . 13.0 pt -133.35 175.29 11.69 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 CA-C-O 121.206 0.527 . . . . 0.0 111.149 -177.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.421 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 14.9 mmt180 -149.95 144.32 25.79 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.803 178.319 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -102.37 141.54 35.04 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.009 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.439 ' HG2' ' O ' ' A' ' 65' ' ' GLN . 8.3 tmm_? -142.92 141.63 31.53 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.362 0.601 . . . . 0.0 111.381 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.41 ' HB2' HD13 ' A' ' 67' ' ' ILE . 85.9 t80 -144.56 147.49 33.25 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.492 178.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.5 t70 58.06 24.45 11.19 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-O 121.728 0.775 . . . . 0.0 110.34 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.42 ' HA2' ' HD3' ' A' ' 61' ' ' ARG . . . 76.55 6.66 84.78 Favored Glycine 0 N--CA 1.433 -1.514 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.93 -179.525 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.439 ' O ' ' HG2' ' A' ' 61' ' ' ARG . 12.8 pt20 -122.01 147.05 47.93 Favored Pre-proline 0 CA--C 1.536 0.425 0 O-C-N 122.224 -0.574 . . . . 0.0 110.48 179.128 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -66.69 138.44 49.26 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 122.492 2.128 . . . . 0.0 112.223 -178.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.41 HD13 ' HB2' ' A' ' 62' ' ' PHE . 45.2 mt -91.54 146.47 6.22 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-O 120.952 0.406 . . . . 0.0 110.099 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.562 HD21 ' HB2' ' A' ' 71' ' ' ASP . 0.2 OUTLIER -114.42 165.9 12.25 Favored 'General case' 0 CA--C 1.492 -1.282 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.634 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.441 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 0.4 OUTLIER -77.95 -19.81 53.89 Favored 'General case' 0 C--N 1.291 -1.97 0 CA-C-O 121.44 0.638 . . . . 0.0 109.693 178.659 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 36.2 p -92.38 4.04 54.22 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.893 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.562 ' HB2' HD21 ' A' ' 68' ' ' ASN . 20.8 t0 -98.96 159.82 14.69 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 121.899 -0.5 . . . . 0.0 110.568 -178.656 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -118.39 154.2 52.05 Favored Pre-proline 0 C--N 1.316 -0.864 0 O-C-N 122.24 -0.287 . . . . 0.0 111.664 177.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.41 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 19.5 Cg_endo -60.17 -30.96 92.49 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.94 2.427 . . . . 0.0 112.276 -179.483 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.17 -19.68 62.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.145 0.497 . . . . 0.0 111.129 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.424 ' NE2' ' HA ' ' A' ' 75' ' ' GLN . 4.0 tp60 -67.84 -37.57 82.05 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.645 0.736 . . . . 0.0 110.152 -179.149 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -93.54 5.19 52.43 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.945 -178.725 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 43.31 40.97 2.81 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.615 1.166 . . . . 0.0 111.94 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.41 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 4.3 ptm -74.27 161.89 29.46 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.723 -178.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -110.2 164.14 12.93 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 116.325 -0.398 . . . . 0.0 109.964 -177.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -55.42 138.07 46.82 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.591 0.71 . . . . 0.0 111.999 176.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 77.95 24.92 0.68 Allowed 'General case' 0 CA--C 1.512 -0.518 0 C-N-CA 124.895 1.278 . . . . 0.0 111.835 177.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.497 ' OD1' HD13 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -61.62 154.07 26.1 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.303 176.523 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 30.8 m -110.44 108.89 19.06 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-O 121.411 0.624 . . . . 0.0 112.05 176.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.411 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 25.1 mm -80.49 137.8 20.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.175 177.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -101.35 124.33 46.86 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.144 0.497 . . . . 0.0 110.423 178.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.421 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 91.0 t -114.19 131.58 65.75 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.08 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.716 178.152 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.4 p90 -133.85 152.06 51.74 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 116.248 -0.433 . . . . 0.0 109.93 -175.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.454 ' NE2' HG23 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -76.91 112.12 13.18 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-O 121.358 0.599 . . . . 0.0 112.369 -176.414 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 78.2 mm-40 -111.27 24.77 12.45 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.572 177.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 20.9 tm0? -60.77 -47.66 85.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.991 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.3 m -99.18 140.65 33.04 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.802 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 177.57 -41.52 0.09 OUTLIER Glycine 0 N--CA 1.443 -0.879 0 C-N-CA 120.4 -0.905 . . . . 0.0 112.212 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.129 0 CA-C-O 118.965 -0.908 . . . . 0.0 111.256 -179.412 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.1 ptt? . . . . . 0 N--CA 1.477 0.885 0 CA-C-O 120.623 0.249 . . . . 0.0 111.131 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -86.39 13.31 8.43 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.442 0.639 . . . . 0.0 110.74 179.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -76.29 -9.05 58.34 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.621 0.724 . . . . 0.0 110.017 178.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -117.47 118.11 31.29 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.499 176.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -57.59 124.87 70.23 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-O 121.096 0.474 . . . . 0.0 111.708 -177.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -73.84 -149.37 0.03 OUTLIER 'Trans proline' 0 CA--C 1.539 0.766 0 C-N-CA 123.552 2.835 . . . . 0.0 112.392 -179.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.45 18.08 19.94 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 122.023 0.916 . . . . 0.0 109.796 179.424 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -141.09 173.76 11.17 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 114.962 -1.017 . . . . 0.0 108.884 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -137.11 -49.81 0.07 OUTLIER Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 119.585 -1.293 . . . . 0.0 113.884 -176.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 40.3 t -87.88 82.3 2.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.511 0.672 . . . . 0.0 111.498 -177.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.3 tttp -145.17 133.23 21.42 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.882 176.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 13.6 t -76.95 169.37 18.45 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.077 0.465 . . . . 0.0 110.709 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.52 ' C ' ' H ' ' A' ' 15' ' ' ASN . 30.0 mt-10 -108.68 125.91 52.41 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.094 0.473 . . . . 0.0 111.569 -177.492 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -67.78 32.99 0.03 OUTLIER 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.39 0.614 . . . . 0.0 111.854 172.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.52 ' H ' ' C ' ' A' ' 13' ' ' GLU . 50.9 m-20 -89.91 103.62 16.27 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-O 121.181 0.515 . . . . 0.0 110.204 179.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -75.77 99.38 4.4 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.461 0.648 . . . . 0.0 109.979 -178.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 55.4 p-80 -121.64 146.13 47.3 Favored 'General case' 0 N--CA 1.436 -1.127 0 CA-C-O 121.459 0.647 . . . . 0.0 111.485 -178.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 39.7 pt -127.12 167.65 21.57 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.206 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.33 -178.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.495 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 23.7 t-20 -100.62 137.86 38.44 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.381 178.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -127.85 135.9 50.68 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 176.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -119.65 145.02 46.84 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-O 121.301 0.572 . . . . 0.0 110.12 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.629 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 6.7 p -123.66 134.35 66.66 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.937 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.955 -178.435 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -117.93 117.99 30.77 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-O 121.241 0.543 . . . . 0.0 110.081 -178.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -84.12 155.14 31.11 Favored Glycine 0 N--CA 1.426 -2.012 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.092 -179.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -15.31 9.31 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 178.014 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -93.48 -11.19 32.6 Favored 'General case' 0 C--N 1.319 -0.718 0 O-C-N 122.015 -0.428 . . . . 0.0 110.828 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.99 7.58 35.53 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.648 -0.786 . . . . 0.0 112.737 178.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 74.5 m -91.36 124.94 35.93 Favored 'General case' 0 C--N 1.313 -0.988 0 O-C-N 122.363 -0.493 . . . . 0.0 111.118 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.629 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.2 p -119.91 132.31 69.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 CA-C-O 121.292 0.568 . . . . 0.0 111.605 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.5 t -119.19 135.26 60.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.044 179.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -104.89 142.18 35.22 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.707 0.289 . . . . 0.0 110.696 179.111 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -134.93 162.55 32.1 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.179 0.514 . . . . 0.0 111.149 -178.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 24.7 pt -132.95 169.41 22.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-O 120.916 0.389 . . . . 0.0 110.347 -177.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.539 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 44.6 mtpt -86.58 152.96 22.16 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-O 121.134 0.492 . . . . 0.0 110.887 179.728 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 28.1 ptt180 -64.49 -24.06 67.49 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.172 -0.467 . . . . 0.0 112.0 -178.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 55.7 t60 -104.22 -2.26 25.94 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 122.086 0.946 . . . . 0.0 108.817 -176.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.466 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.5 m -87.15 137.87 32.76 Favored Pre-proline 0 N--CA 1.427 -1.587 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.355 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -58.92 122.7 12.05 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.672 2.248 . . . . 0.0 112.469 -178.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.45 HD11 ' N ' ' A' ' 41' ' ' SER . 1.2 pp -68.0 -16.47 64.06 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.427 179.225 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.468 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 10.1 p -52.14 -30.31 25.95 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.247 0.619 . . . . 0.0 111.899 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -64.24 -42.66 96.42 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.675 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.468 HD13 ' C ' ' A' ' 43' ' ' LEU . 1.0 OUTLIER -70.83 -35.91 72.67 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.05 0.453 . . . . 0.0 110.233 178.519 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 44.0 mtm -63.32 -49.28 74.59 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.015 0.436 . . . . 0.0 110.765 -178.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.4 mmmm -66.55 -37.71 85.56 Favored 'General case' 0 N--CA 1.441 -0.878 0 O-C-N 122.267 -0.271 . . . . 0.0 110.48 177.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.34 -43.41 88.26 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.378 0.608 . . . . 0.0 110.04 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 63.1 t80 -56.38 -55.08 37.96 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.619 177.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.663 ' SG ' HD11 ' A' ' 58' ' ' ILE . 33.2 m -63.08 -42.71 99.69 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.926 0.393 . . . . 0.0 111.174 -177.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.45 -35.95 81.56 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -177.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -84.98 -34.2 22.43 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.92 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -83.17 -13.57 55.21 Favored 'General case' 0 C--N 1.334 -0.096 0 N-CA-C 113.083 0.772 . . . . 0.0 113.083 -178.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.42 6.49 73.95 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.152 -1.023 . . . . 0.0 113.203 178.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -92.18 169.94 10.21 Favored 'General case' 0 C--N 1.32 -0.675 0 O-C-N 121.975 -0.721 . . . . 0.0 110.925 178.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 71.6 m -120.77 154.38 35.75 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.319 179.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 12.5 mmt -62.01 -28.19 69.4 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-O 121.375 0.607 . . . . 0.0 111.592 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.47 ' HD2' ' H ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.08 -14.85 45.91 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.438 0.637 . . . . 0.0 110.818 178.397 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -90.18 -31.64 16.97 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.586 -179.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.663 HD11 ' SG ' ' A' ' 48' ' ' CYS . 12.0 pt -128.84 175.95 9.16 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.151 0 CA-C-O 121.296 0.569 . . . . 0.0 111.678 -177.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.454 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 25.0 mmt180 -148.51 138.77 22.53 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.341 179.378 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 41.8 m-85 -96.71 139.6 32.54 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.308 179.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.449 ' NE ' ' HA2' ' A' ' 64' ' ' GLY . 0.2 OUTLIER -141.62 137.71 32.05 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-O 121.04 0.448 . . . . 0.0 111.063 -176.755 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.446 ' HB2' HD11 ' A' ' 67' ' ' ILE . 67.2 t80 -143.33 145.15 32.45 Favored 'General case' 0 C--O 1.214 -0.801 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 177.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 23.7 t70 54.02 23.75 4.24 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 121.895 0.855 . . . . 0.0 110.871 -177.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.449 ' HA2' ' NE ' ' A' ' 61' ' ' ARG . . . 85.08 -18.03 29.49 Favored Glycine 0 N--CA 1.434 -1.469 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.997 -178.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -96.11 149.94 36.59 Favored Pre-proline 0 C--N 1.318 -0.765 0 O-C-N 122.532 -0.393 . . . . 0.0 111.071 -179.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.92 141.98 37.97 Favored 'Trans proline' 0 C--O 1.235 0.344 0 C-N-CA 122.53 2.153 . . . . 0.0 111.751 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.446 HD11 ' HB2' ' A' ' 62' ' ' PHE . 23.9 mt -94.53 148.15 5.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 120.979 0.419 . . . . 0.0 110.19 -179.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -129.24 166.72 18.86 Favored 'General case' 0 CA--C 1.498 -1.042 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.729 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.468 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 12.6 pt-20 -75.16 -12.48 60.31 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 121.341 0.591 . . . . 0.0 110.479 178.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.8 t -91.71 -1.33 57.45 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 121.221 0.534 . . . . 0.0 111.171 -178.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -103.93 147.12 27.72 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 120.9 0.381 . . . . 0.0 111.022 177.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.56 153.72 42.73 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.46 179.533 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -60.7 -31.27 91.81 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.701 2.268 . . . . 0.0 112.551 -177.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.83 -20.78 62.52 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.79 -179.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -67.21 -37.22 83.27 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.153 0.502 . . . . 0.0 111.127 -178.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -94.51 11.24 31.54 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.564 -178.023 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 43.73 36.97 1.41 Allowed 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 124.147 0.979 . . . . 0.0 112.202 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.8 ptm -73.53 158.47 34.8 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.901 -178.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -109.33 165.43 11.63 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 120.916 0.389 . . . . 0.0 110.534 -178.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.495 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 10.3 p-10 -61.55 142.73 56.9 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.339 0.59 . . . . 0.0 111.196 175.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 72.83 17.33 4.36 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 124.42 1.088 . . . . 0.0 111.721 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -75.48 161.54 29.11 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 176.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 6.7 m -109.95 131.86 54.68 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -174.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 45.9 mm -97.62 134.01 37.33 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 175.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 43.3 m-20 -97.39 124.65 41.64 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-O 121.07 0.462 . . . . 0.0 110.967 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.454 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 87.3 t -115.61 139.09 43.78 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 CA-C-O 120.99 0.424 . . . . 0.0 110.329 177.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 9.7 p90 -134.9 155.87 49.94 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -88.63 116.38 26.84 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.541 0.686 . . . . 0.0 111.48 -175.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 75.0 mm-40 -104.69 23.74 12.9 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.524 178.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -79.65 84.43 5.48 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.434 0.635 . . . . 0.0 110.621 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 17.5 m -99.57 86.48 3.36 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 121.239 0.543 . . . . 0.0 110.227 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 139.19 -146.13 17.64 Favored Glycine 0 N--CA 1.436 -1.318 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.727 -1.041 . . . . 0.0 112.229 179.516 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.3 ptt? . . . . . 0 N--CA 1.484 1.275 0 CA-C-O 121.103 0.478 . . . . 0.0 111.086 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.14 19.09 21.2 Favored 'General case' 0 CA--C 1.509 -0.604 0 CA-C-O 121.775 0.798 . . . . 0.0 109.438 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -71.52 -44.65 64.25 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.397 -178.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.0 mp0 -91.89 9.92 30.94 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.72 -179.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 54.8 tptt -146.02 78.75 11.3 Favored Pre-proline 0 N--CA 1.441 -0.907 0 CA-C-O 121.156 0.503 . . . . 0.0 109.876 -178.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -90.0 -172.8 0.62 Allowed 'Trans proline' 0 N--CA 1.446 -1.267 0 C-N-CA 122.916 2.411 . . . . 0.0 111.438 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -2.12 24.23 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.132 0.491 . . . . 0.0 111.528 179.567 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -68.04 167.44 13.91 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.892 -0.411 . . . . 0.0 109.892 178.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 153.4 29.18 0.04 OUTLIER Glycine 0 C--N 1.311 -0.847 0 C-N-CA 120.09 -1.053 . . . . 0.0 112.895 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.3 p -80.18 135.67 24.93 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.955 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 178.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 49.81 54.0 11.79 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.427 0.632 . . . . 0.0 110.213 -173.087 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.8 t -77.37 50.89 0.82 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 122.58 1.181 . . . . 0.0 111.232 -178.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.489 ' HG3' ' H ' ' A' ' 14' ' ' ASN . 8.9 pt-20 -174.6 -61.89 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.693 0 CA-C-N 114.128 -1.396 . . . . 0.0 108.746 -178.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.489 ' H ' ' HG3' ' A' ' 13' ' ' GLU . 0.9 OUTLIER -85.27 48.7 1.62 Allowed 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 175.776 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -81.01 -41.26 22.97 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.415 -0.812 . . . . 0.0 110.73 -176.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.7 t70 67.57 46.9 1.28 Allowed 'General case' 0 C--O 1.238 0.485 0 CA-C-O 121.68 0.753 . . . . 0.0 111.461 175.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.56 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 5.9 p-80 -117.98 152.18 36.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.403 0.62 . . . . 0.0 111.409 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 29.2 pt -128.96 171.12 17.36 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.128 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.028 178.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.432 ' HB2' ' NZ ' ' A' ' 33' ' ' ALY . 19.2 t-20 -107.27 133.91 51.13 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -124.35 135.35 53.26 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 177.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.435 ' HG2' ' HG3' ' A' ' 31' ' ' GLN . 49.8 mtmt -121.95 144.42 48.88 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 121.155 0.503 . . . . 0.0 110.099 -179.279 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.613 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 2.5 p -121.62 127.45 75.58 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.527 -177.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -117.44 126.69 53.05 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.294 0.568 . . . . 0.0 110.09 -178.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -104.13 152.95 17.71 Favored Glycine 0 N--CA 1.429 -1.812 0 C-N-CA 120.439 -0.886 . . . . 0.0 111.548 -179.303 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.05 -16.2 1.03 Allowed 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 177.465 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -70.26 -22.8 62.84 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.507 0.67 . . . . 0.0 110.51 177.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 102.56 9.66 40.29 Favored Glycine 0 N--CA 1.448 -0.501 0 N-CA-C 111.338 -0.705 . . . . 0.0 111.338 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 39.9 t -101.89 157.15 17.06 Favored 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 122.492 0.317 . . . . 0.0 110.224 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.613 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 3.7 p -149.51 140.59 16.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.0 0.428 . . . . 0.0 110.616 -179.197 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.9 t -125.18 139.71 50.37 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.435 ' HG3' ' HG2' ' A' ' 21' ' ' LYS . 0.4 OUTLIER -108.63 144.55 36.22 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.951 0.405 . . . . 0.0 111.049 -179.46 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -140.42 153.49 46.32 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.171 0.51 . . . . 0.0 111.142 -178.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ALY . . . . . 0.432 ' NZ ' ' HB2' ' A' ' 19' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 37.8 pt -137.63 166.73 24.02 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 -177.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.56 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 3.9 mppt? -77.99 151.88 33.38 Favored 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.187 177.381 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.1 ptt180 -68.06 -14.37 62.92 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 121.378 0.609 . . . . 0.0 110.9 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 76.4 t60 -107.34 -1.62 21.44 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 122.289 1.042 . . . . 0.0 108.645 -178.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.521 ' OG1' ' HE2' ' A' ' 35' ' ' LYS . 1.3 m -86.63 139.34 33.41 Favored Pre-proline 0 N--CA 1.432 -1.362 0 CA-C-N 114.548 -1.205 . . . . 0.0 109.73 178.702 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -59.99 119.31 6.44 Favored 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 122.356 2.038 . . . . 0.0 112.397 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.525 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.7 pt? -67.82 -16.74 64.25 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.515 0.674 . . . . 0.0 110.58 179.296 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 14.4 p -52.25 -28.83 20.22 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.223 177.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.2 mtpt -62.25 -46.96 86.47 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 121.101 0.477 . . . . 0.0 109.739 178.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.8 pp -72.88 -37.52 67.28 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 120.881 0.372 . . . . 0.0 110.265 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 62.7 mtm -61.49 -43.78 98.25 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 120.922 0.391 . . . . 0.0 111.363 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.53 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 43.3 mttp -69.53 -37.63 77.2 Favored 'General case' 0 CA--C 1.514 -0.422 0 O-C-N 122.071 -0.393 . . . . 0.0 110.751 177.607 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.93 -35.49 80.85 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.146 0.498 . . . . 0.0 109.824 -179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -61.73 -54.74 38.48 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.602 178.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.629 ' SG ' HD11 ' A' ' 58' ' ' ILE . 19.5 m -58.77 -39.18 80.26 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.054 0.454 . . . . 0.0 110.447 -179.115 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.53 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 67.2 mt-10 -62.09 -49.33 76.38 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.115 0.483 . . . . 0.0 111.729 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -74.89 -36.63 62.24 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.087 0.402 . . . . 0.0 112.087 -176.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -78.09 -21.19 50.86 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -178.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.46 41.65 6.83 Favored Glycine 0 N--CA 1.431 -1.686 0 C-N-CA 119.905 -1.14 . . . . 0.0 111.271 -178.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -127.64 170.38 12.74 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.453 ' HB2' ' OE1' ' A' ' 57' ' ' GLN . 50.0 m -124.71 157.56 35.36 Favored 'General case' 0 C--N 1.311 -1.088 0 O-C-N 122.303 -0.248 . . . . 0.0 110.491 177.766 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 12.1 mmt -60.73 -28.91 69.04 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-O 121.327 0.584 . . . . 0.0 111.784 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.464 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.36 -16.07 41.12 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.401 0.62 . . . . 0.0 110.634 178.694 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.453 ' OE1' ' HB2' ' A' ' 54' ' ' SER . 1.3 mp0 -90.82 -25.13 20.07 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.782 -177.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.629 HD11 ' SG ' ' A' ' 48' ' ' CYS . 12.7 pt -135.27 177.94 6.02 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.069 0 CA-C-O 120.933 0.397 . . . . 0.0 110.761 -178.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.416 ' CG ' ' HG3' ' A' ' 89' ' ' GLN . 15.0 mmt180 -150.54 139.61 21.08 Favored 'General case' 0 CA--C 1.501 -0.924 0 CA-C-O 121.341 0.591 . . . . 0.0 111.081 178.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -97.91 141.23 31.14 Favored 'General case' 0 N--CA 1.438 -1.033 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.685 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.46 ' HG2' ' N ' ' A' ' 62' ' ' PHE . 8.4 tmm_? -143.48 145.58 32.71 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 121.247 0.546 . . . . 0.0 110.94 -179.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.46 ' N ' ' HG2' ' A' ' 61' ' ' ARG . 86.1 t80 -151.13 148.74 28.65 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.657 179.029 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 19.5 t70 58.4 22.08 9.09 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.753 0.787 . . . . 0.0 110.123 -178.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.0 4.44 88.73 Favored Glycine 0 N--CA 1.43 -1.765 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.662 -178.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.416 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 12.0 pt20 -121.39 143.58 37.98 Favored Pre-proline 0 N--CA 1.444 -0.738 0 O-C-N 122.071 -0.664 . . . . 0.0 110.11 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 65' ' ' GLN . 23.3 Cg_exo -61.71 141.1 89.56 Favored 'Trans proline' 0 C--N 1.329 -0.457 0 C-N-CA 122.848 2.366 . . . . 0.0 112.091 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.452 HD13 ' HB2' ' A' ' 62' ' ' PHE . 41.2 mt -96.78 146.84 6.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 120.859 0.362 . . . . 0.0 110.146 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -114.5 163.01 15.96 Favored 'General case' 0 CA--C 1.5 -0.959 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 176.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -79.04 -11.22 59.99 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 120.106 -0.638 . . . . 0.0 110.597 179.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 35.0 p -84.76 -11.99 54.64 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.72 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.56 165.74 16.82 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -178.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -121.54 153.37 59.25 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.217 173.433 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.427 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 12.2 Cg_endo -57.38 -30.2 87.03 Favored 'Trans proline' 0 C--O 1.236 0.424 0 C-N-CA 122.779 2.319 . . . . 0.0 112.137 -179.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.27 -20.73 62.19 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.163 0.506 . . . . 0.0 111.64 -179.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -69.16 -39.1 78.99 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.318 0.58 . . . . 0.0 110.863 179.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.1 mp -86.92 2.86 47.89 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.143 -178.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 57.02 31.08 19.28 Favored 'General case' 0 C--N 1.349 0.567 0 CA-C-O 121.51 0.671 . . . . 0.0 111.193 178.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.427 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.8 ptm -79.06 164.73 24.09 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.769 -178.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -121.89 172.69 8.0 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.578 -176.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -63.06 145.31 55.73 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-O 121.528 0.68 . . . . 0.0 111.835 177.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 71.16 16.33 6.3 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 114.57 -1.196 . . . . 0.0 111.492 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.4 ' OD1' ' CE1' ' A' ' 62' ' ' PHE . 11.2 t70 -70.79 153.95 42.29 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.156 175.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 19.7 m -112.99 134.99 54.25 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-O 121.454 0.645 . . . . 0.0 112.367 -177.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.404 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 39.2 mm -98.48 145.28 10.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 123.372 0.669 . . . . 0.0 110.089 -179.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -100.27 117.04 33.65 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 122.316 0.246 . . . . 0.0 110.852 179.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 86.4 t -115.37 136.02 53.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-O 121.298 0.57 . . . . 0.0 111.285 177.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -134.05 153.18 51.97 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.061 -178.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -79.47 115.33 19.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.312 0.577 . . . . 0.0 111.623 -178.273 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.416 ' HG3' ' CG ' ' A' ' 59' ' ' ARG . 51.8 mm-40 -104.02 22.09 15.26 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-O 121.485 0.659 . . . . 0.0 110.716 177.144 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -94.79 138.66 32.31 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.521 179.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.4 p -78.51 154.83 30.15 Favored 'General case' 0 N--CA 1.434 -1.233 0 CA-C-O 121.05 0.452 . . . . 0.0 111.397 -179.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 71.87 71.79 1.01 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.014 -179.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.766 0 CA-C-O 118.66 -1.078 . . . . 0.0 112.231 178.737 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.7 ptp . . . . . 0 N--CA 1.476 0.874 0 CA-C-O 120.881 0.372 . . . . 0.0 110.782 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 55.95 65.33 1.47 Allowed 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.274 0.559 . . . . 0.0 112.273 178.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -100.61 -5.44 26.72 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.817 0.818 . . . . 0.0 109.079 177.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -109.3 31.13 5.98 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.152 -0.931 . . . . 0.0 108.733 178.566 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 51.7 tptt -103.75 127.89 28.49 Favored Pre-proline 0 C--N 1.319 -0.741 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.898 -175.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.492 ' HB2' ' OE1' ' A' ' 8' ' ' GLU . 95.4 Cg_endo -78.75 -167.07 0.45 Allowed 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.155 1.903 . . . . 0.0 111.737 178.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -121.5 4.03 10.18 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 121.729 0.776 . . . . 0.0 109.849 -179.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.492 ' OE1' ' HB2' ' A' ' 6' ' ' PRO . 2.5 mp0 -89.07 19.82 4.0 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.74 -178.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -83.25 61.67 4.74 Favored Glycine 0 C--N 1.308 -1.0 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.87 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 41.4 t -116.06 126.37 73.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 -179.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -59.12 97.99 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.603 0.716 . . . . 0.0 112.057 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.7 t -101.92 -165.15 1.16 Allowed 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.096 178.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -92.95 -165.55 1.36 Allowed 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.289 0.566 . . . . 0.0 110.48 179.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -95.91 18.16 13.84 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.541 0.686 . . . . 0.0 110.495 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.9 p30 -111.26 29.65 7.62 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.609 0.719 . . . . 0.0 110.403 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -87.58 -7.32 57.66 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.765 0.793 . . . . 0.0 110.695 -178.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 33.2 p-80 -124.58 159.31 30.96 Favored 'General case' 0 C--N 1.299 -1.605 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.54 -175.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 31.0 pt -130.29 170.85 18.54 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.908 -177.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -105.21 136.23 45.09 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -128.21 136.6 51.31 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 121.01 0.433 . . . . 0.0 109.879 178.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 83' ' ' THR . 52.2 mtmt -120.29 146.46 46.07 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.016 0.436 . . . . 0.0 109.911 179.666 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.609 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 3.8 p -124.56 132.6 71.1 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.615 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.832 -178.28 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -119.26 127.67 53.46 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 121.234 0.54 . . . . 0.0 110.36 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -103.0 147.39 16.89 Favored Glycine 0 N--CA 1.433 -1.556 0 C-N-CA 121.019 -0.61 . . . . 0.0 111.943 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.477 ' HG3' ' HA ' ' A' ' 87' ' ' PHE . 0.0 OUTLIER -51.93 -24.49 6.49 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 177.89 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -75.04 -18.17 60.37 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.218 0.532 . . . . 0.0 110.734 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 106.01 27.4 5.67 Favored Glycine 0 CA--C 1.499 -0.965 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.088 175.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.406 ' HB3' ' OE1' ' A' ' 51' ' ' GLN . 71.0 m -111.29 147.63 34.67 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 120.656 0.265 . . . . 0.0 110.491 179.389 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.609 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.4 p -145.81 132.33 14.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.188 0.518 . . . . 0.0 111.667 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 t -124.15 139.66 49.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -108.03 142.4 38.26 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.816 0.341 . . . . 0.0 110.771 179.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -136.39 152.96 51.19 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.37 0.605 . . . . 0.0 111.797 -177.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 29.1 pt -133.49 162.77 39.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.014 0.435 . . . . 0.0 111.063 -176.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.431 ' HB2' ' HB ' ' A' ' 38' ' ' THR . 36.0 mtmm -74.72 147.15 41.64 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 178.766 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.9 ptt180 -71.24 -13.16 61.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.682 0.753 . . . . 0.0 110.243 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 -100.52 -5.64 26.64 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -178.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.431 ' HB ' ' HB2' ' A' ' 35' ' ' LYS . 1.0 OUTLIER -94.8 141.89 23.95 Favored Pre-proline 0 N--CA 1.445 -0.719 0 CA-C-N 114.763 -1.108 . . . . 0.0 109.73 179.758 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -63.09 128.92 24.14 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.257 1.971 . . . . 0.0 112.375 -179.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.521 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.1 pt? -69.26 -17.29 63.74 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.692 0.758 . . . . 0.0 110.446 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.414 ' N ' HD22 ' A' ' 40' ' ' LEU . 0.9 OUTLIER -51.73 -28.96 16.72 Favored 'General case' 0 C--N 1.31 -1.111 0 C-N-CA 124.43 1.092 . . . . 0.0 111.204 178.57 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 51.5 mtpt -63.38 -43.14 98.47 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.897 179.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.3 pp -73.04 -38.64 66.43 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 120.938 0.399 . . . . 0.0 109.985 178.629 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 59.7 mtm -60.74 -49.41 77.59 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 121.049 0.452 . . . . 0.0 111.108 -179.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.445 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 47.7 mtpt -68.67 -35.36 77.12 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.821 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.49 ' O ' ' HG2' ' A' ' 50' ' ' ARG . . . -63.86 -38.03 89.58 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.055 0.455 . . . . 0.0 110.004 178.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -57.02 -56.34 22.98 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.849 178.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.48 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 26.1 p -63.46 -37.62 87.99 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.869 0.366 . . . . 0.0 111.45 -177.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.445 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 44.8 mt-10 -67.61 -36.45 80.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.788 0.328 . . . . 0.0 111.732 -179.416 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.502 ' HG3' HE21 ' A' ' 51' ' ' GLN . 14.2 ptm180 -85.23 -37.39 20.14 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 121.96 -0.462 . . . . 0.0 111.695 -179.382 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.502 HE21 ' HG3' ' A' ' 50' ' ' ARG . 21.5 mm-40 -77.67 -21.88 51.44 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -176.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 92.45 37.14 5.96 Favored Glycine 0 N--CA 1.439 -1.165 0 C-N-CA 120.281 -0.962 . . . . 0.0 111.173 -178.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.48 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 4.0 mm? -122.25 162.99 20.42 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -179.641 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.449 ' HB2' ' HB2' ' A' ' 57' ' ' GLN . 16.6 m -116.72 152.83 33.49 Favored 'General case' 0 C--N 1.312 -1.036 0 O-C-N 122.017 -0.427 . . . . 0.0 110.556 178.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 11.9 mmt -63.73 -25.9 68.41 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.542 0.687 . . . . 0.0 111.283 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.573 ' HG2' ' NE2' ' A' ' 57' ' ' GLN . 0.0 OUTLIER -85.56 -16.79 38.25 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.325 0.583 . . . . 0.0 110.735 177.133 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.573 ' NE2' ' HG2' ' A' ' 56' ' ' ARG . 2.7 mp0 -93.31 -27.04 17.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.8 -179.357 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.6 pt -129.86 -179.12 2.92 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-O 121.062 0.458 . . . . 0.0 111.266 -179.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.461 ' HD3' ' HA ' ' A' ' 59' ' ' ARG . 8.3 mmt180 -158.17 143.29 16.57 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.851 177.609 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -100.74 145.55 28.35 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.621 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.2 ttt180 -142.48 148.08 37.11 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 120.884 0.373 . . . . 0.0 110.547 -178.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.44 ' HB2' HD13 ' A' ' 67' ' ' ILE . 73.8 t80 -152.72 143.69 23.01 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 178.292 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.0 t70 54.92 23.91 5.42 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.509 0.724 . . . . 0.0 111.244 -178.162 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.92 -23.34 20.91 Favored Glycine 0 N--CA 1.435 -1.427 0 C-N-CA 120.906 -0.664 . . . . 0.0 112.679 -178.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.43 HE21 HD21 ' A' ' 76' ' ' LEU . 9.7 pt20 -94.18 150.4 38.3 Favored Pre-proline 0 C--N 1.315 -0.912 0 O-C-N 122.516 -0.402 . . . . 0.0 110.954 -178.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -72.47 143.32 38.36 Favored 'Trans proline' 0 N--CA 1.462 -0.326 0 C-N-CA 122.434 2.089 . . . . 0.0 111.575 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.44 HD13 ' HB2' ' A' ' 62' ' ' PHE . 38.4 mt -93.31 143.08 12.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-O 120.977 0.417 . . . . 0.0 110.296 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -114.07 157.5 22.47 Favored 'General case' 0 CA--C 1.499 -0.985 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 178.037 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -74.11 -12.04 60.48 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-O 121.24 0.543 . . . . 0.0 110.445 178.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.6 p -95.11 6.28 49.5 Favored 'General case' 0 N--CA 1.438 -1.033 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 178.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -100.13 162.12 13.17 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.974 0.416 . . . . 0.0 111.238 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -116.18 155.34 48.31 Favored Pre-proline 0 C--N 1.318 -0.765 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.149 176.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -61.12 -34.6 89.27 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.715 2.277 . . . . 0.0 111.779 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.72 -10.94 60.0 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.288 -179.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -77.05 -40.74 45.19 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 121.351 0.596 . . . . 0.0 109.758 179.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.43 HD21 HE21 ' A' ' 65' ' ' GLN . 0.3 OUTLIER -85.47 12.22 8.9 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.197 -179.604 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 43.61 43.69 4.86 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.293 1.037 . . . . 0.0 112.134 178.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.2 ptm -86.81 164.89 16.4 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.461 -178.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -117.68 167.82 11.0 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.86 0.362 . . . . 0.0 110.399 -178.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -60.96 142.74 56.23 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.639 0.733 . . . . 0.0 112.171 177.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 73.82 16.51 3.74 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 124.856 1.263 . . . . 0.0 111.506 178.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -77.47 162.09 27.44 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 177.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' THR . . . . . 0.446 ' HA ' ' O ' ' A' ' 21' ' ' LYS . 37.1 m -116.34 139.01 50.86 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 121.661 0.743 . . . . 0.0 112.953 -175.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 44.6 mm -98.48 143.02 13.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.538 178.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -102.39 122.08 43.58 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.847 0.356 . . . . 0.0 110.702 178.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.461 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 76.7 t -115.0 137.86 47.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.717 0 CA-C-O 121.17 0.51 . . . . 0.0 110.932 178.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . 0.477 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 5.3 p90 -136.26 153.04 51.31 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.458 -179.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -80.98 113.56 19.27 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.354 0.597 . . . . 0.0 111.479 -177.189 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 75.9 mm-40 -104.67 21.96 15.92 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-O 121.359 0.599 . . . . 0.0 110.083 176.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -61.96 138.49 58.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.05 -179.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 15.2 p -66.64 -44.53 81.69 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.171 0.51 . . . . 0.0 111.875 -178.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 104.61 -61.93 0.38 Allowed Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.5 -179.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.968 0 CA-C-O 118.79 -1.006 . . . . 0.0 111.604 177.974 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 ptm . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 120.957 0.408 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -114.29 17.62 17.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.908 0.861 . . . . 0.0 109.273 179.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -81.99 -7.32 59.6 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.083 -178.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -117.83 12.29 13.8 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.101 0.476 . . . . 0.0 110.51 178.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.7 mmtm -143.17 169.82 9.87 Favored Pre-proline 0 C--N 1.32 -0.686 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 -175.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -65.9 175.85 4.23 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.344 2.029 . . . . 0.0 112.745 178.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.405 ' H ' ' HD2' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -74.37 -5.82 44.56 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.312 179.156 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -67.74 133.48 49.34 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.179 0.514 . . . . 0.0 111.037 -178.074 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 125.49 -14.32 7.28 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.665 -177.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.1 p -81.18 110.12 16.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 121.464 0.649 . . . . 0.0 111.803 -179.143 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -120.75 99.28 6.44 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.067 178.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.0 t -121.93 141.97 50.75 Favored 'General case' 0 C--N 1.306 -1.284 0 O-C-N 122.022 -0.424 . . . . 0.0 109.967 178.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -50.35 147.3 4.46 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.385 0.612 . . . . 0.0 112.239 177.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 23.4 m-80 -139.98 10.88 2.41 Favored 'General case' 0 CA--C 1.509 -0.628 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 175.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -105.74 110.74 23.14 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 113.043 0.757 . . . . 0.0 113.043 -171.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.0 t0 50.51 48.85 21.85 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 114.666 1.358 . . . . 0.0 114.666 169.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 15.9 p-80 -122.37 148.1 45.48 Favored 'General case' 0 C--N 1.319 -0.732 0 O-C-N 121.714 -0.616 . . . . 0.0 110.922 175.742 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 44.3 pt -129.54 166.95 25.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 121.435 0.636 . . . . 0.0 111.656 -175.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.496 ' HA ' ' O ' ' A' ' 32' ' ' PHE . 16.5 t-20 -97.29 139.94 32.51 Favored 'General case' 0 CA--C 1.506 -0.712 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.872 178.601 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.408 HD13 ' O ' ' A' ' 19' ' ' ASN . 3.0 mm? -130.93 139.98 50.13 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 176.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 47.3 mtmt -125.38 145.28 50.12 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-O 121.07 0.462 . . . . 0.0 110.515 -179.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.651 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 2.5 p -126.23 131.79 71.17 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.638 -178.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -112.57 131.71 55.48 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-O 121.195 0.522 . . . . 0.0 110.884 -178.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -96.94 176.44 31.97 Favored Glycine 0 N--CA 1.438 -1.178 0 CA-C-N 116.24 -0.437 . . . . 0.0 112.483 -179.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.565 ' NE2' ' H ' ' A' ' 25' ' ' GLN . 0.3 OUTLIER -69.39 -24.58 63.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.738 0.78 . . . . 0.0 110.739 -177.894 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -83.93 -4.76 58.95 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.86 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.53 3.57 64.61 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.515 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.5 t -77.58 156.02 31.14 Favored 'General case' 0 C--N 1.322 -0.63 0 O-C-N 122.357 -0.496 . . . . 0.0 109.692 178.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.651 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.5 p -149.3 136.61 13.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-O 121.01 0.433 . . . . 0.0 110.587 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.5 t -119.89 136.57 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.72 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -108.32 143.42 37.22 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.016 0.436 . . . . 0.0 110.785 -179.399 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.496 ' O ' ' HA ' ' A' ' 19' ' ' ASN . 11.4 m-85 -139.4 154.5 47.83 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.085 0.469 . . . . 0.0 110.952 -178.064 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ALY . . . . . 0.49 ' OH ' ' HB2' ' A' ' 19' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 31.9 pt -134.48 165.12 32.33 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.007 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.468 -175.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 32.0 mtmm -75.27 146.85 40.73 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 120.833 0.349 . . . . 0.0 110.604 178.221 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 5.7 ppt_? -71.39 -11.1 60.72 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.435 0.636 . . . . 0.0 110.891 179.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -101.94 -4.07 26.76 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.428 ' HB ' ' O ' ' A' ' 35' ' ' LYS . 1.3 m -92.36 137.33 24.72 Favored Pre-proline 0 N--CA 1.44 -0.94 0 CA-C-N 114.441 -1.254 . . . . 0.0 109.918 178.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -60.45 130.61 34.44 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.599 2.2 . . . . 0.0 112.443 -179.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.464 HD11 ' N ' ' A' ' 41' ' ' SER . 1.2 pp -70.18 -17.34 63.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.154 -0.475 . . . . 0.0 112.011 -179.215 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.464 ' N ' HD11 ' A' ' 40' ' ' LEU . 3.8 p -53.49 -28.58 31.64 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.94 -179.645 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 29.5 mtpp -59.6 -47.38 85.79 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.281 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.8 pp -73.75 -36.28 65.11 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.797 -179.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 39.8 mtm -63.03 -49.41 74.7 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 121.068 0.461 . . . . 0.0 111.02 -178.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.454 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 42.9 mtpt -69.53 -33.32 72.62 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.919 0.39 . . . . 0.0 110.604 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.0 -36.53 84.29 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.302 0.572 . . . . 0.0 109.659 177.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -59.23 -54.31 48.34 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.762 177.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.492 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 24.2 p -65.18 -35.2 80.34 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 122.15 -0.344 . . . . 0.0 111.211 -177.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.454 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 45.0 mt-10 -65.49 -42.1 92.54 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 120.762 0.315 . . . . 0.0 111.359 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -80.08 -33.28 38.99 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 120.969 0.414 . . . . 0.0 111.723 -178.683 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.9 mm-40 -81.84 -22.13 37.19 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -177.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.411 ' C ' HD22 ' A' ' 53' ' ' LEU . . . 88.42 39.57 6.73 Favored Glycine 0 N--CA 1.437 -1.239 0 C-N-CA 119.858 -1.163 . . . . 0.0 111.113 -177.339 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.492 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 4.0 mm? -125.73 168.05 14.31 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.04 0.448 . . . . 0.0 110.104 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.5 m -125.26 158.65 33.6 Favored 'General case' 0 C--N 1.312 -1.025 0 O-C-N 122.142 -0.349 . . . . 0.0 110.72 177.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 18.2 mmt -64.99 -25.29 67.8 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-O 121.367 0.603 . . . . 0.0 111.69 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.97 -14.74 43.71 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.525 0.679 . . . . 0.0 110.819 176.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -94.33 -26.62 16.49 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.087 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.7 pt -132.46 179.02 4.79 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-O 121.071 0.462 . . . . 0.0 110.942 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.41 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 3.8 mmt85 -153.81 140.54 19.02 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.602 178.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -99.59 139.85 34.64 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.333 -179.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.11 136.08 24.73 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.249 0.547 . . . . 0.0 110.607 -177.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.479 ' HB2' HD13 ' A' ' 67' ' ' ILE . 85.7 t80 -141.29 146.86 37.31 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.001 -179.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 52.0 25.79 3.36 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.576 0.75 . . . . 0.0 111.82 -179.077 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.8 -11.67 68.1 Favored Glycine 0 N--CA 1.44 -1.098 0 C-N-CA 120.836 -0.697 . . . . 0.0 113.542 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.418 HE21 HD22 ' A' ' 76' ' ' LEU . 10.8 pt20 -109.01 150.37 40.85 Favored Pre-proline 0 C--N 1.319 -0.733 0 O-C-N 122.118 -0.636 . . . . 0.0 111.075 -179.358 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -71.98 139.81 33.68 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 122.613 2.208 . . . . 0.0 111.724 179.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.479 HD13 ' HB2' ' A' ' 62' ' ' PHE . 21.0 mt -94.75 146.92 6.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-O 120.94 0.4 . . . . 0.0 110.325 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -117.36 162.34 18.08 Favored 'General case' 0 CA--C 1.497 -1.072 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 176.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.412 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 10.0 pt-20 -70.7 -16.16 62.77 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-O 121.473 0.654 . . . . 0.0 110.489 178.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 17.3 p -86.6 -13.93 44.29 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -177.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.06 160.42 19.3 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 121.508 0.67 . . . . 0.0 112.518 -177.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -113.16 154.99 45.03 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.644 178.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.37 -29.57 90.52 Favored 'Trans proline' 0 CA--C 1.531 0.359 0 C-N-CA 123.005 2.47 . . . . 0.0 111.785 178.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -75.78 -19.04 59.29 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.202 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -68.6 -42.64 77.88 Favored 'General case' 0 CA--C 1.51 -0.588 0 CA-C-O 121.726 0.774 . . . . 0.0 109.831 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.418 HD22 HE21 ' A' ' 65' ' ' GLN . 0.4 OUTLIER -85.31 6.84 24.55 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.594 -179.792 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 43.39 43.22 4.2 Favored 'General case' 0 C--N 1.359 1.018 0 C-N-CA 124.381 1.073 . . . . 0.0 111.995 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.4 ptm -83.38 169.64 15.38 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.677 -178.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.437 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 12.5 pt-20 -117.2 168.3 10.43 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 110.097 -0.335 . . . . 0.0 110.097 -179.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -58.95 142.86 49.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.52 0.676 . . . . 0.0 111.842 175.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 73.62 16.02 3.97 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 124.674 1.189 . . . . 0.0 111.902 179.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.437 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 1.5 t0 -73.63 155.5 38.97 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.211 -0.596 . . . . 0.0 109.631 178.434 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 34.7 m -111.58 136.87 50.18 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.636 0.732 . . . . 0.0 112.746 -174.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 43.1 mm -99.52 138.61 23.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.765 178.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -98.22 120.44 38.63 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.817 0.342 . . . . 0.0 110.324 178.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.41 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 96.7 t -113.04 138.73 41.46 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.081 0 CA-C-O 121.064 0.459 . . . . 0.0 109.899 177.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 14.8 p90 -137.28 153.27 50.36 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.016 -179.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -80.03 116.6 20.25 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.364 0.602 . . . . 0.0 112.039 -176.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 71.1 mm-40 -110.54 18.99 19.18 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.63 176.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.439 ' HG2' ' H ' ' A' ' 92' ' ' GLY . 7.9 tt0 -54.64 120.05 6.16 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.819 -179.107 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 7.7 t -97.25 33.16 2.02 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.798 0.809 . . . . 0.0 110.562 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . 0.439 ' H ' ' HG2' ' A' ' 90' ' ' GLN . . . -161.72 43.37 0.38 Allowed Glycine 0 N--CA 1.444 -0.783 0 N-CA-C 111.488 -0.645 . . . . 0.0 111.488 -178.007 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.248 0 CA-C-O 118.293 -1.282 . . . . 0.0 111.477 -179.162 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 ptt? . . . . . 0 N--CA 1.481 1.086 0 CA-C-O 120.831 0.348 . . . . 0.0 111.621 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.6 10.25 13.79 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.585 0.707 . . . . 0.0 110.53 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -81.69 -16.52 51.01 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.766 -179.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -67.2 97.53 0.54 Allowed 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.399 -178.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.1 tmtp? 63.36 83.48 0.2 Allowed Pre-proline 0 CA--C 1.538 0.505 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.874 177.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -84.57 -170.69 0.85 Allowed 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 122.844 2.363 . . . . 0.0 112.301 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.05 3.85 51.66 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.291 0.567 . . . . 0.0 111.26 -179.297 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -136.76 175.52 9.53 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.928 -176.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.17 -55.87 0.96 Allowed Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.816 -0.707 . . . . 0.0 111.497 178.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.8 p -111.02 121.31 63.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.27 0.557 . . . . 0.0 110.405 178.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.64 126.01 30.24 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.594 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.2 t -141.31 136.75 31.86 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.322 0.582 . . . . 0.0 110.999 -178.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -116.07 106.67 14.01 Favored 'General case' 0 CA--C 1.5 -0.948 0 CA-C-O 121.555 0.693 . . . . 0.0 110.907 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.447 ' N ' HD21 ' A' ' 14' ' ' ASN . 0.9 OUTLIER -106.63 133.73 50.86 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-N 115.347 -0.842 . . . . 0.0 108.902 -179.946 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -68.04 100.36 0.98 Allowed 'General case' 0 C--N 1.295 -1.774 0 CA-C-O 121.573 0.701 . . . . 0.0 111.381 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -78.09 94.94 4.77 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.945 -177.535 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.479 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 56.6 p-80 -122.37 154.53 37.56 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.635 -179.31 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 40.3 pt -131.19 169.39 21.79 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.078 0 CA-C-O 121.364 0.602 . . . . 0.0 110.885 -178.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -103.49 139.73 38.45 Favored 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 177.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -126.75 136.97 53.13 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 177.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.458 ' HG2' ' HG3' ' A' ' 31' ' ' GLN . 52.1 mtmt -124.12 139.08 54.28 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.269 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.544 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 61.0 t -124.65 130.58 73.4 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.387 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -175.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -115.56 135.82 53.7 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 -178.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -121.46 162.0 15.35 Favored Glycine 0 N--CA 1.445 -0.763 0 C-N-CA 120.449 -0.881 . . . . 0.0 112.871 -178.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.526 ' HG2' ' HA ' ' A' ' 87' ' ' PHE . 22.8 mm-40 -66.17 -11.73 51.3 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.503 0.668 . . . . 0.0 110.397 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -78.23 6.82 7.35 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.431 179.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 72.82 36.36 57.83 Favored Glycine 0 C--N 1.338 0.658 0 C-N-CA 120.696 -0.764 . . . . 0.0 113.405 178.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.4 t -143.24 160.92 39.57 Favored 'General case' 0 C--N 1.314 -0.948 0 O-C-N 122.14 -0.623 . . . . 0.0 111.35 -179.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.544 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.8 p -149.32 139.12 16.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.39 -179.027 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.9 t -124.31 142.46 41.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 O-C-N 122.119 -0.363 . . . . 0.0 110.43 -179.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.458 ' HG3' ' HG2' ' A' ' 21' ' ' LYS . 0.7 OUTLIER -107.98 141.15 40.07 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 120.916 0.389 . . . . 0.0 110.997 179.092 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -135.72 153.94 51.42 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.921 0.391 . . . . 0.0 111.111 -178.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 30.2 pt -137.23 166.52 25.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-O 121.086 0.469 . . . . 0.0 110.263 -178.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.479 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 36.9 mtmm -75.73 139.57 41.95 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 177.237 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 8.1 ppt_? -69.32 -11.99 61.29 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.448 0.642 . . . . 0.0 110.608 179.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 15.2 t-160 -99.23 2.53 45.75 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 122.181 0.991 . . . . 0.0 108.503 179.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.45 ' HB ' ' HB2' ' A' ' 35' ' ' LYS . 0.9 OUTLIER -103.4 143.29 26.32 Favored Pre-proline 0 N--CA 1.447 -0.599 0 CA-C-N 114.805 -1.089 . . . . 0.0 109.831 178.635 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -60.83 130.08 31.59 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 122.691 2.26 . . . . 0.0 112.493 -179.159 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.543 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.3 pp -70.34 -16.25 62.96 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.09 -0.504 . . . . 0.0 112.014 -179.41 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.448 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 0.1 OUTLIER -51.45 -29.6 16.79 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 122.955 0.502 . . . . 0.0 111.847 179.994 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -61.09 -47.85 84.41 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.222 0.534 . . . . 0.0 110.317 179.028 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.4 pp -73.5 -32.31 64.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.821 -178.724 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 46.7 mtm -62.76 -50.28 71.67 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.006 0.432 . . . . 0.0 111.018 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.442 ' HA ' ' SG ' ' A' ' 48' ' ' CYS . 81.0 mttt -66.97 -33.95 76.7 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.104 178.484 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.72 -35.88 82.47 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.169 0.509 . . . . 0.0 109.936 179.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -62.61 -56.63 16.07 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.544 178.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.502 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 26.3 p -62.1 -36.25 81.16 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.728 0.299 . . . . 0.0 111.649 -177.326 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -64.23 -44.32 92.22 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 120.905 0.383 . . . . 0.0 111.605 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 14.0 ptm180 -80.57 -32.01 36.68 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.047 0.451 . . . . 0.0 111.464 -177.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -80.91 -23.32 39.03 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.114 0.483 . . . . 0.0 112.006 -178.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.59 36.07 8.18 Favored Glycine 0 C--N 1.306 -1.084 0 C-N-CA 120.321 -0.943 . . . . 0.0 111.483 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.502 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 3.8 mm? -119.86 160.52 22.49 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 178.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.405 ' HB2' ' OE1' ' A' ' 57' ' ' GLN . 67.3 m -114.33 157.69 22.46 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 122.162 -0.336 . . . . 0.0 110.227 179.138 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.458 ' HE2' ' SG ' ' A' ' 48' ' ' CYS . 16.7 mmt -64.66 -27.57 69.01 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.264 0.554 . . . . 0.0 111.208 -179.575 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.565 ' O ' ' HA ' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -86.24 -7.59 58.42 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.427 0.632 . . . . 0.0 110.29 177.021 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.405 ' OE1' ' HB2' ' A' ' 54' ' ' SER . 0.9 OUTLIER -97.84 -19.83 17.9 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.59 -178.989 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.479 HG22 HE21 ' A' ' 88' ' ' GLN . 14.8 pt -144.88 -177.39 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 CA-C-O 121.102 0.477 . . . . 0.0 111.241 -177.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 16.8 mmt180 -155.58 141.45 18.12 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.56 177.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -96.63 139.82 32.14 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 178.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -140.4 139.83 35.37 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.245 0.545 . . . . 0.0 110.905 -178.153 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.45 ' HB2' HD12 ' A' ' 67' ' ' ILE . 64.3 t80 -144.88 147.01 32.29 Favored 'General case' 0 C--O 1.21 -1.017 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.956 178.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.8 t70 57.0 23.45 8.36 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 121.633 0.73 . . . . 0.0 110.805 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.6 -2.69 86.95 Favored Glycine 0 N--CA 1.429 -1.791 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.816 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -115.14 148.74 41.3 Favored Pre-proline 0 C--N 1.323 -0.549 0 O-C-N 122.293 -0.534 . . . . 0.0 110.645 -179.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -69.33 142.94 51.29 Favored 'Trans proline' 0 C--O 1.236 0.392 0 C-N-CA 122.323 2.015 . . . . 0.0 111.836 179.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.45 HD12 ' HB2' ' A' ' 62' ' ' PHE . 32.4 mt -96.4 146.24 7.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.972 0.415 . . . . 0.0 110.53 -179.422 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -126.21 170.32 11.95 Favored 'General case' 0 CA--C 1.504 -0.81 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 178.399 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.448 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 11.2 pt-20 -70.32 -19.04 63.1 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-O 120.982 0.42 . . . . 0.0 111.657 -179.663 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.3 t -90.93 3.67 54.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.193 0.521 . . . . 0.0 111.288 -178.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.7 142.09 28.41 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-O 121.423 0.63 . . . . 0.0 111.412 178.172 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.689 ' HB ' ' OE1' ' A' ' 75' ' ' GLN . 1.1 m -112.48 140.69 24.07 Favored Pre-proline 0 C--N 1.317 -0.82 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.464 ' HD2' ' CG2' ' A' ' 72' ' ' THR . 15.7 Cg_endo -54.23 -33.75 76.55 Favored 'Trans proline' 0 N--CA 1.481 0.76 0 C-N-CA 123.478 2.785 . . . . 0.0 113.244 -176.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.45 -27.12 64.97 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.0 0.429 . . . . 0.0 111.574 -178.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.689 ' OE1' ' HB ' ' A' ' 72' ' ' THR . 5.9 mp0 -68.29 -32.61 72.88 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.053 0.454 . . . . 0.0 111.564 -178.855 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -92.58 10.07 31.94 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.005 0.431 . . . . 0.0 110.045 179.9 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 43.62 41.16 3.32 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.598 1.159 . . . . 0.0 112.264 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.41 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 5.9 ptm -80.3 163.62 23.8 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.5 -178.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -107.48 165.96 11.02 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.129 -177.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -59.48 143.23 50.58 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 121.448 0.642 . . . . 0.0 110.802 171.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 69.55 19.15 7.55 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.032 -0.985 . . . . 0.0 111.67 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -62.49 149.27 43.28 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.186 176.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.0 m -102.05 122.09 43.44 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 121.597 0.713 . . . . 0.0 112.052 -177.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.528 HG13 HG23 ' A' ' 22' ' ' VAL . 14.0 mm -93.22 139.15 18.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.658 179.033 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -97.57 118.79 34.87 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 120.989 0.423 . . . . 0.0 110.687 179.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 43.5 t -114.06 133.11 61.1 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 CA-C-O 121.406 0.622 . . . . 0.0 110.114 176.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . 0.526 ' HA ' ' HG2' ' A' ' 25' ' ' GLN . 24.2 p90 -134.39 153.37 51.94 Favored 'General case' 0 C--N 1.3 -1.587 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.431 -178.355 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.479 HE21 HG22 ' A' ' 58' ' ' ILE . 0.6 OUTLIER -62.27 157.9 18.5 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-O 121.12 0.486 . . . . 0.0 110.747 179.711 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.446 ' HG2' ' O ' ' A' ' 88' ' ' GLN . 35.0 mm-40 -163.07 17.4 0.08 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.696 -177.197 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.565 ' HA ' ' O ' ' A' ' 56' ' ' ARG . 0.6 OUTLIER -65.85 107.09 1.71 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.764 0.792 . . . . 0.0 111.337 -178.629 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 10.0 m -136.45 117.31 14.15 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.855 -179.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -177.18 155.52 18.18 Favored Glycine 0 N--CA 1.444 -0.817 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.038 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.125 0 CA-C-O 118.674 -1.07 . . . . 0.0 111.744 179.741 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.1 ttt . . . . . 0 N--CA 1.473 0.712 0 CA-C-O 121.076 0.465 . . . . 0.0 112.149 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -101.83 10.46 39.86 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -175.902 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -78.08 -27.06 48.43 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.049 0.452 . . . . 0.0 111.045 179.044 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -63.09 94.59 0.07 Allowed 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.133 0.492 . . . . 0.0 111.187 179.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -170.42 106.93 0.43 Allowed Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.051 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -83.76 170.73 11.2 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 122.9 2.4 . . . . 0.0 113.372 -178.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.94 -27.88 2.41 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.967 173.182 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -91.51 149.72 21.55 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 120.935 0.397 . . . . 0.0 109.964 179.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -67.64 -53.88 21.9 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.955 -0.641 . . . . 0.0 112.362 -177.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 12.2 p -143.71 151.25 16.66 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 178.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.8 tptt -83.54 154.38 23.86 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 109.851 -0.425 . . . . 0.0 109.851 -177.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.2 t -150.21 164.7 35.01 Favored 'General case' 0 C--N 1.316 -0.865 0 O-C-N 122.139 -0.351 . . . . 0.0 110.453 179.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 67.02 74.82 0.32 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.674 0.79 . . . . 0.0 112.318 -178.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 70.7 85.01 0.14 Allowed 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.788 177.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -102.6 -154.52 0.49 Allowed 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.846 -178.082 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.475 ' O ' ' HG2' ' A' ' 36' ' ' ARG . 7.3 p-10 -75.41 10.17 1.78 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.094 0.473 . . . . 0.0 112.077 -178.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 11.5 p-80 -114.69 136.17 53.35 Favored 'General case' 0 C--N 1.311 -1.089 0 O-C-N 121.893 -0.505 . . . . 0.0 109.681 177.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 43.5 pt -128.01 167.47 23.01 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.072 0 CA-C-O 121.105 0.478 . . . . 0.0 111.036 -176.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.49 ' HA ' ' O ' ' A' ' 32' ' ' PHE . 45.1 t-20 -107.18 128.03 54.05 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.719 -0.475 . . . . 0.0 109.719 179.412 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -118.64 134.06 55.39 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 178.156 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.4 mtmp? -115.37 149.18 38.35 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-O 120.999 0.428 . . . . 0.0 109.979 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.691 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 2.7 p -125.15 129.01 73.3 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.011 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.693 -177.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -110.64 120.84 43.72 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.058 0.456 . . . . 0.0 109.836 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.479 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -92.88 156.07 22.81 Favored Glycine 0 N--CA 1.427 -1.946 0 C-N-CA 120.575 -0.822 . . . . 0.0 112.837 -178.673 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.56 -13.42 1.56 Allowed 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 178.562 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -90.3 -13.3 35.54 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.131 0.491 . . . . 0.0 110.728 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 104.94 6.56 39.82 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 121.01 -0.614 . . . . 0.0 112.225 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 40.1 t -89.83 155.53 19.1 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 120.821 0.343 . . . . 0.0 110.421 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.691 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.7 p -147.95 134.59 13.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 CA-C-O 121.096 0.474 . . . . 0.0 110.714 178.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.5 t -122.22 139.23 49.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -107.74 142.79 37.2 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 120.741 0.305 . . . . 0.0 110.907 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.49 ' O ' ' HA ' ' A' ' 19' ' ' ASN . 10.1 m-85 -140.73 146.79 38.22 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-O 121.318 0.58 . . . . 0.0 111.587 -178.422 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 39.9 pt -131.89 173.84 14.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 120.965 0.412 . . . . 0.0 110.594 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.9 mtmm -87.66 150.14 23.83 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 120.923 0.392 . . . . 0.0 110.421 178.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.475 ' HG2' ' O ' ' A' ' 16' ' ' ASP . 23.8 ptt180 -62.68 -24.33 67.58 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.488 0.661 . . . . 0.0 111.099 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 14.6 t60 -103.11 1.72 33.67 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.883 0.849 . . . . 0.0 109.594 -177.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.1 m -92.56 139.35 23.7 Favored Pre-proline 0 C--N 1.31 -1.123 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.878 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.76 128.64 19.32 Favored 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 121.934 1.756 . . . . 0.0 112.185 -177.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.517 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.0 OUTLIER -66.83 -16.86 64.57 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.01 -179.445 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.526 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 1.0 OUTLIER -52.14 -29.87 24.01 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.921 0.391 . . . . 0.0 111.882 179.607 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 35.3 mtpt -62.83 -44.58 95.75 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-O 120.996 0.427 . . . . 0.0 110.417 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.9 pp -73.47 -33.9 65.09 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 120.896 0.379 . . . . 0.0 110.29 178.71 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 47.8 mtm -62.12 -49.31 76.4 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 121.32 0.581 . . . . 0.0 110.411 -179.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -68.65 -35.3 77.07 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.073 178.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.13 -33.13 75.06 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.309 0.576 . . . . 0.0 109.826 178.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 62.3 t80 -63.72 -55.19 25.2 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.797 178.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.419 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 25.3 p -63.13 -35.82 81.56 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.803 0.335 . . . . 0.0 110.922 -178.082 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -61.75 -48.63 79.83 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 121.035 0.445 . . . . 0.0 111.422 178.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -76.72 -31.08 56.92 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.967 0.413 . . . . 0.0 111.383 -177.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -82.77 -21.96 34.47 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 -178.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 93.75 8.13 60.95 Favored Glycine 0 CA--C 1.523 0.561 0 C-N-CA 120.268 -0.968 . . . . 0.0 113.319 179.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.419 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 3.2 mm? -97.98 173.74 6.91 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 122.205 -0.585 . . . . 0.0 111.01 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 71.7 m -122.27 157.8 30.91 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 120.719 0.295 . . . . 0.0 111.154 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.7 mmt -63.7 -27.28 69.1 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.118 0.485 . . . . 0.0 112.247 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.73 -12.61 53.42 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.636 0.731 . . . . 0.0 109.944 177.531 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -93.66 -30.97 14.65 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.699 -177.721 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 9.6 pt -132.56 177.34 7.26 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-O 121.132 0.492 . . . . 0.0 111.5 -177.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.404 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 12.9 mmt180 -150.1 143.77 25.3 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.164 179.407 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -100.9 141.44 33.78 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.705 179.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -142.99 139.34 30.59 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-O 121.19 0.519 . . . . 0.0 111.118 -177.002 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.444 ' HB2' HD13 ' A' ' 67' ' ' ILE . 72.5 t80 -144.61 145.92 32.03 Favored 'General case' 0 C--O 1.214 -0.767 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 16.7 t70 57.43 23.44 9.04 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 121.885 0.85 . . . . 0.0 109.962 -178.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.77 -25.88 8.05 Favored Glycine 0 N--CA 1.426 -1.977 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.548 -178.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -90.25 149.26 40.95 Favored Pre-proline 0 C--N 1.323 -0.561 0 O-C-N 122.582 -0.363 . . . . 0.0 111.301 -177.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -71.7 141.58 37.98 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 122.206 1.938 . . . . 0.0 111.391 178.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.444 HD13 ' HB2' ' A' ' 62' ' ' PHE . 39.0 mt -91.9 149.27 4.18 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-O 120.964 0.411 . . . . 0.0 110.905 -177.657 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -115.53 175.57 5.46 Favored 'General case' 0 CA--C 1.502 -0.903 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 177.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.526 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 0.2 OUTLIER -77.5 -20.67 53.96 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-O 121.503 0.668 . . . . 0.0 110.223 179.423 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.8 t -95.22 8.59 42.6 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.843 0.83 . . . . 0.0 110.529 -178.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -78.49 134.97 37.26 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.0 178.006 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.27 137.42 21.52 Favored Pre-proline 0 C--N 1.311 -1.074 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.035 176.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.612 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 10.9 Cg_endo -55.81 -34.13 90.31 Favored 'Trans proline' 0 C--O 1.236 0.375 0 C-N-CA 123.027 2.485 . . . . 0.0 112.477 -177.622 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.25 -17.39 61.34 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.795 -179.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.6 -33.66 53.7 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.916 0.388 . . . . 0.0 110.98 -179.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -89.86 -2.85 58.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.24 0.543 . . . . 0.0 109.974 178.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 57.01 36.75 28.18 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.862 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.612 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.9 ptm -76.27 160.83 29.28 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.635 -178.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.473 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 12.3 pt-20 -112.51 166.11 11.62 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-O 120.854 0.359 . . . . 0.0 110.469 -177.285 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -62.76 148.27 47.26 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 121.343 0.592 . . . . 0.0 110.975 174.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 73.07 13.52 4.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.424 -179.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.473 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 2.2 t0 -74.66 158.66 33.23 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.798 -0.361 . . . . 0.0 110.154 178.494 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 39.6 m -116.01 136.59 52.89 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.783 0.801 . . . . 0.0 112.982 -176.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.41 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 44.5 mm -97.26 140.94 16.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.371 178.668 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -99.11 117.38 33.46 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.707 0.289 . . . . 0.0 110.28 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.479 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 73.0 t -113.52 136.11 50.95 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 CA-C-O 121.432 0.634 . . . . 0.0 110.671 178.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -137.34 155.26 49.63 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.075 -178.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -80.83 111.91 17.72 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.187 0.517 . . . . 0.0 110.999 -176.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 64.4 mm-40 -109.49 30.95 6.16 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.744 179.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -62.18 96.45 0.07 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.177 0.513 . . . . 0.0 110.329 178.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.4 p -144.02 149.09 36.15 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.296 -179.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 111.02 -33.57 5.81 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.749 -0.738 . . . . 0.0 111.793 -179.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.263 0 CA-C-O 118.59 -1.117 . . . . 0.0 111.333 179.013 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ptt? . . . . . 0 N--CA 1.476 0.859 0 CA-C-O 121.114 0.483 . . . . 0.0 111.403 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -124.42 25.72 7.56 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 122.135 0.969 . . . . 0.0 108.601 178.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -85.25 -0.05 53.44 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.915 -1.038 . . . . 0.0 112.004 -177.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.471 ' O ' ' HG2' ' A' ' 5' ' ' LYS . 36.7 mt-10 -113.84 98.27 6.91 Favored 'General case' 0 C--N 1.321 -0.636 0 O-C-N 122.298 -0.251 . . . . 0.0 110.499 177.624 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.471 ' HG2' ' O ' ' A' ' 4' ' ' GLU . 13.9 pttp 54.91 166.1 0.05 OUTLIER Pre-proline 0 N--CA 1.485 1.286 0 C-N-CA 124.773 1.229 . . . . 0.0 112.201 -178.602 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -83.33 -177.23 3.15 Favored 'Trans proline' 0 C--O 1.241 0.631 0 C-N-CA 121.995 1.797 . . . . 0.0 111.356 176.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.481 ' HD2' ' HG3' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -98.44 -16.6 19.18 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.336 0.588 . . . . 0.0 110.863 178.539 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.481 ' HG3' ' HD2' ' A' ' 7' ' ' LYS . 0.8 OUTLIER -125.84 144.94 50.45 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.858 174.967 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -153.0 86.58 0.14 Allowed Glycine 0 N--CA 1.439 -1.138 0 C-N-CA 120.007 -1.092 . . . . 0.0 112.592 -177.078 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 46.3 t -67.12 131.91 32.57 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 177.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 25.6 tptp -65.76 106.76 1.59 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.478 0.656 . . . . 0.0 111.126 -177.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -140.03 -167.47 2.31 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.688 178.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -78.38 78.33 4.85 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 121.487 0.661 . . . . 0.0 109.461 176.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -91.54 -25.02 19.43 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-O 121.223 0.535 . . . . 0.0 111.097 -176.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -103.25 126.21 50.3 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.142 0.496 . . . . 0.0 110.559 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -80.96 104.75 11.68 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 122.288 1.042 . . . . 0.0 109.448 -179.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 43.9 p-80 -121.11 163.03 19.03 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.753 -175.154 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 31.5 pt -133.5 170.97 18.85 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.835 178.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -107.46 134.03 51.09 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -125.05 139.14 54.06 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 177.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 52.3 mtmt -121.8 143.43 49.4 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.518 HG22 HG13 ' A' ' 84' ' ' ILE . 65.8 t -121.68 128.87 75.86 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -179.238 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -108.51 134.97 50.55 Favored 'General case' 0 C--O 1.245 0.835 0 CA-C-O 121.377 0.608 . . . . 0.0 111.092 -177.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -96.18 170.68 27.58 Favored Glycine 0 N--CA 1.428 -1.847 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.899 179.136 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.594 ' NE2' ' H ' ' A' ' 25' ' ' GLN . 0.0 OUTLIER -69.78 -25.46 63.81 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.207 0.527 . . . . 0.0 110.498 -176.568 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -84.66 -2.85 58.08 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.161 -178.049 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 94.9 7.61 59.75 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 120.197 -1.002 . . . . 0.0 113.515 179.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 37.0 t -85.45 155.25 21.33 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 177.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.487 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 5.3 p -150.82 143.05 16.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-O 121.164 0.507 . . . . 0.0 111.021 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.468 HG11 ' HD3' ' A' ' 50' ' ' ARG . 16.4 t -123.63 140.48 47.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 178.614 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -106.2 138.66 42.0 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 120.999 0.428 . . . . 0.0 110.356 179.104 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -132.3 153.03 51.1 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.047 0.451 . . . . 0.0 110.895 -177.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 20.9 pt -133.03 167.54 26.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-O 121.17 0.51 . . . . 0.0 110.777 -178.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.524 ' HB2' ' OG1' ' A' ' 38' ' ' THR . 46.6 mtpt -81.83 148.25 28.94 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.267 179.108 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.9 ppt_? -69.01 -16.84 63.82 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.829 0.347 . . . . 0.0 111.397 -179.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 11.4 t-80 -100.95 -3.5 29.41 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 122.291 1.043 . . . . 0.0 108.52 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.524 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 2.4 m -90.81 137.28 26.96 Favored Pre-proline 0 N--CA 1.432 -1.334 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.429 -179.184 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_endo -61.6 129.15 26.83 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.39 2.06 . . . . 0.0 112.04 -179.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.736 HD13 ' SD ' ' A' ' 44' ' ' MET . 0.4 OUTLIER -69.36 -17.95 63.74 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.02 -0.537 . . . . 0.0 112.317 -178.868 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.525 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 7.8 p -50.93 -32.46 20.86 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 122.995 0.518 . . . . 0.0 111.658 179.01 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt -59.8 -48.34 82.08 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.446 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.6 pp -71.42 -33.78 69.72 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.234 0.54 . . . . 0.0 110.075 179.106 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.736 ' SD ' HD13 ' A' ' 40' ' ' LEU . 38.5 mtp -60.6 -49.28 78.18 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.183 0.516 . . . . 0.0 111.053 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 27.6 mmtp -67.23 -35.89 80.52 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.77 177.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.45 ' O ' ' HG2' ' A' ' 50' ' ' ARG . . . -63.68 -39.26 93.89 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 121.23 0.538 . . . . 0.0 110.186 179.326 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -57.81 -55.37 35.75 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.231 177.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.592 ' SG ' HD12 ' A' ' 58' ' ' ILE . 32.5 m -59.92 -41.26 91.37 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.104 -178.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -65.68 -39.91 91.79 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.468 ' HD3' HG11 ' A' ' 30' ' ' VAL . 14.6 ptm180 -82.08 -35.7 28.38 Favored 'General case' 0 C--N 1.329 -0.313 0 O-C-N 121.912 -0.492 . . . . 0.0 111.578 -178.822 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.9 mm-40 -77.67 -22.37 50.67 Favored 'General case' 0 CA--C 1.502 -0.896 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -179.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 84.48 42.8 7.21 Favored Glycine 0 N--CA 1.427 -1.957 0 C-N-CA 119.773 -1.203 . . . . 0.0 111.168 -177.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -122.8 164.17 18.86 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 178.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.8 m -113.58 150.25 33.31 Favored 'General case' 0 N--CA 1.44 -0.968 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 178.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 10.6 mmt -59.32 -29.16 67.44 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-O 121.3 0.571 . . . . 0.0 111.651 178.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -84.87 -13.58 50.5 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.511 0.672 . . . . 0.0 110.651 178.241 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -91.45 -19.07 23.24 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.77 -178.428 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.592 HD12 ' SG ' ' A' ' 48' ' ' CYS . 16.3 pt -139.41 -176.46 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.118 0.485 . . . . 0.0 111.026 -178.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.419 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 7.2 mmt180 -157.14 131.68 8.62 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.678 177.228 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -89.38 145.5 25.3 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.514 178.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.582 ' HD3' ' CA ' ' A' ' 64' ' ' GLY . 7.2 tmm_? -150.65 145.52 25.9 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-O 121.137 0.494 . . . . 0.0 110.596 -176.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -146.88 147.13 30.5 Favored 'General case' 0 C--O 1.216 -0.709 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 18.8 t70 55.83 23.75 6.75 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-O 121.753 0.787 . . . . 0.0 110.517 -177.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.582 ' CA ' ' HD3' ' A' ' 61' ' ' ARG . . . 83.9 -16.38 32.48 Favored Glycine 0 N--CA 1.428 -1.863 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.698 -179.182 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.572 ' O ' ' HG2' ' A' ' 61' ' ' ARG . 12.2 pt20 -97.1 148.0 33.76 Favored Pre-proline 0 CA--C 1.537 0.474 0 O-C-N 122.619 -0.342 . . . . 0.0 110.603 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -68.58 141.19 49.59 Favored 'Trans proline' 0 CA--C 1.53 0.325 0 C-N-CA 122.572 2.181 . . . . 0.0 112.337 -179.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 50.3 mt -90.25 146.78 5.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 179.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.592 HD21 ' HB2' ' A' ' 71' ' ' ASP . 0.2 OUTLIER -116.45 164.67 14.21 Favored 'General case' 0 CA--C 1.498 -1.054 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.463 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.525 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 9.5 pt-20 -75.84 -18.0 59.61 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.679 0.752 . . . . 0.0 109.859 177.649 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 23.5 p -93.0 1.65 57.2 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.735 -176.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.592 ' HB2' HD21 ' A' ' 68' ' ' ASN . 14.4 t70 -101.56 159.64 15.13 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 121.817 -0.552 . . . . 0.0 111.103 -177.585 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -114.79 151.31 45.29 Favored Pre-proline 0 C--O 1.219 -0.509 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 178.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.86 -29.86 91.31 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.978 2.452 . . . . 0.0 112.116 -179.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.45 -17.84 61.74 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.214 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -68.25 -41.51 81.04 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-O 121.64 0.733 . . . . 0.0 110.382 -178.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -86.75 2.93 47.05 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.862 -174.634 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 56.55 33.21 22.26 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-O 121.399 0.619 . . . . 0.0 111.044 178.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.9 ptm -77.96 156.77 30.03 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.097 -177.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.575 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 12.3 pt-20 -107.08 162.61 13.71 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.274 -177.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -58.72 138.49 57.04 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.146 0.498 . . . . 0.0 111.127 174.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 77.21 19.54 1.3 Allowed 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 124.665 1.186 . . . . 0.0 110.613 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.575 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 0.7 OUTLIER -70.54 152.1 44.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.145 177.985 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 31.5 m -106.85 121.49 44.51 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.527 0.679 . . . . 0.0 112.694 -176.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.518 HG13 HG22 ' A' ' 22' ' ' VAL . 18.3 mm -85.3 140.53 15.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.232 176.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -102.23 116.18 32.12 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 120.837 0.351 . . . . 0.0 110.926 -179.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.419 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 72.3 t -109.69 138.43 37.26 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.938 0 CA-C-O 120.963 0.411 . . . . 0.0 110.471 177.378 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.6 p90 -133.99 149.01 51.2 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 116.092 -0.503 . . . . 0.0 109.817 178.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.407 ' NE2' HG23 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -75.5 131.72 40.28 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.789 0.804 . . . . 0.0 112.168 -176.607 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 -105.78 17.28 23.97 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.162 -0.926 . . . . 0.0 111.772 178.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.45 ' HA ' ' OE1' ' A' ' 90' ' ' GLN . 6.0 tp60 -131.22 125.75 33.73 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 -179.316 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 7.8 p -82.89 -47.76 11.47 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 -178.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -66.28 -60.45 6.32 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.947 -0.644 . . . . 0.0 112.373 -179.173 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.246 0 CA-C-O 118.793 -1.004 . . . . 0.0 112.05 179.232 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.1 ptt? . . . . . 0 N--CA 1.485 1.301 0 CA-C-O 121.025 0.44 . . . . 0.0 110.959 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -168.03 22.07 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.888 0.851 . . . . 0.0 109.059 -178.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -108.04 -31.55 7.91 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.164 -176.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -92.96 29.19 1.88 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.617 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.9 ptpp? -148.3 152.76 39.76 Favored Pre-proline 0 N--CA 1.435 -1.189 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 179.191 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_exo -70.14 -168.17 0.28 Allowed 'Trans proline' 0 CA--C 1.533 0.457 0 C-N-CA 122.618 2.212 . . . . 0.0 111.972 178.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.31 -4.1 2.37 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.832 177.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -62.63 97.06 0.09 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.057 0.456 . . . . 0.0 111.552 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 91.86 21.15 34.41 Favored Glycine 0 N--CA 1.446 -0.681 0 C-N-CA 120.851 -0.69 . . . . 0.0 113.017 178.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 12.6 p -72.63 131.16 35.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 O-C-N 122.315 -0.521 . . . . 0.0 110.618 179.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -159.1 147.02 17.73 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 120.751 0.31 . . . . 0.0 110.77 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.6 t -72.53 150.47 43.15 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 175.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -109.9 148.74 31.02 Favored 'General case' 0 CA--C 1.501 -0.918 0 CA-C-O 121.577 0.703 . . . . 0.0 112.074 -177.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -66.45 103.7 1.09 Allowed 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.58 178.34 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -121.64 -80.86 0.63 Allowed 'General case' 0 C--N 1.315 -0.918 0 CA-C-O 120.965 0.412 . . . . 0.0 111.535 -179.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -64.72 80.77 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.99 1.107 . . . . 0.0 113.99 -177.198 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.457 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 24.8 p-80 -119.85 143.07 48.1 Favored 'General case' 0 C--N 1.32 -0.703 0 O-C-N 121.967 -0.458 . . . . 0.0 110.813 175.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 42.1 pt -129.65 171.21 17.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.277 0.56 . . . . 0.0 110.416 178.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.517 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 23.4 t-20 -110.5 135.72 50.73 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.099 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -124.65 143.57 50.66 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.42 ' HG2' ' HG3' ' A' ' 31' ' ' GLN . 54.6 mtmt -126.48 140.74 52.23 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-O 121.22 0.533 . . . . 0.0 109.826 179.262 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.533 HG21 HG13 ' A' ' 84' ' ' ILE . 60.1 t -122.99 131.96 72.31 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 -178.488 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.06 129.25 55.45 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 -178.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.41 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -105.66 156.95 16.41 Favored Glycine 0 N--CA 1.428 -1.872 0 C-N-CA 120.193 -1.003 . . . . 0.0 111.962 -179.388 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.24 -9.48 0.43 Allowed 'General case' 0 CA--C 1.55 0.96 0 N-CA-C 113.552 0.945 . . . . 0.0 113.552 178.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -82.48 -21.22 35.63 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.3 0.571 . . . . 0.0 110.208 178.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.51 3.52 40.6 Favored Glycine 0 CA--C 1.508 -0.394 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.7 t -91.03 152.66 20.57 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.505 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 3.2 p -148.35 137.02 15.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.161 0.505 . . . . 0.0 110.145 -178.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.401 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 3.8 t -125.99 141.72 44.82 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 O-C-N 122.108 -0.37 . . . . 0.0 110.516 -177.777 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.42 ' HG3' ' HG2' ' A' ' 21' ' ' LYS . 0.8 OUTLIER -106.07 141.71 36.98 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.195 179.166 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.436 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 20.1 m-85 -134.4 153.03 52.13 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.172 0.51 . . . . 0.0 110.99 -177.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 33.7 pt -140.71 175.42 6.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.908 0.385 . . . . 0.0 110.177 -178.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.512 ' HB2' ' OG1' ' A' ' 38' ' ' THR . 22.5 mtpp -85.89 151.23 23.94 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-O 121.131 0.491 . . . . 0.0 110.417 177.803 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -64.32 -25.1 67.89 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.072 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 19.5 t-160 -102.39 1.07 34.96 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.998 0.904 . . . . 0.0 109.25 -176.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.512 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.6 m -91.8 136.04 26.82 Favored Pre-proline 0 C--N 1.3 -1.575 0 CA-C-N 114.828 -1.078 . . . . 0.0 109.965 -179.26 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -58.23 125.85 19.74 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.597 2.198 . . . . 0.0 112.341 -179.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.572 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.3 pp -68.4 -16.8 64.05 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.039 -179.059 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.436 ' N ' HD13 ' A' ' 40' ' ' LEU . 26.2 t -51.19 -31.95 21.89 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 121.006 0.431 . . . . 0.0 111.125 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.3 mtpp -56.52 -50.49 71.68 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.305 0.574 . . . . 0.0 110.802 178.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.6 pp -71.5 -32.74 68.57 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.991 -179.082 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 49.5 mtm -64.0 -42.99 96.99 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.224 0.535 . . . . 0.0 110.731 -179.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.608 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 1.4 mmpt? -68.04 -38.94 83.09 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.54 177.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.19 -35.5 80.51 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-O 121.174 0.511 . . . . 0.0 110.068 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.507 ' CE2' ' HG3' ' A' ' 51' ' ' GLN . 64.4 t80 -61.79 -54.9 35.98 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.081 177.434 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.602 ' SG ' HD13 ' A' ' 58' ' ' ILE . 30.4 m -58.89 -39.04 80.27 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.127 0.489 . . . . 0.0 110.993 -179.146 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.608 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 73.6 mm-40 -59.84 -52.79 63.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.006 0.431 . . . . 0.0 111.399 178.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.419 ' HG2' ' O ' ' A' ' 47' ' ' TYR . 9.6 ptp180 -71.17 -36.05 71.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.993 0.425 . . . . 0.0 111.965 -177.046 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.507 ' HG3' ' CE2' ' A' ' 47' ' ' TYR . 24.3 mm-40 -72.68 -16.95 61.68 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -179.157 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 74.9 38.04 42.56 Favored Glycine 0 N--CA 1.435 -1.381 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -174.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.459 HD23 HG22 ' A' ' 58' ' ' ILE . 3.7 mp -123.41 165.66 16.67 Favored 'General case' 0 N--CA 1.433 -1.292 0 C-N-CA 123.631 0.772 . . . . 0.0 109.376 -175.431 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.409 ' HB2' ' OE1' ' A' ' 57' ' ' GLN . 61.8 m -124.88 158.09 34.34 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-O 120.67 0.272 . . . . 0.0 111.082 178.362 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.8 mmt -61.56 -30.2 70.5 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-O 121.069 0.461 . . . . 0.0 111.998 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.57 -13.36 51.97 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.615 0.721 . . . . 0.0 110.491 177.724 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.492 ' HG3' ' HG2' ' A' ' 90' ' ' GLN . 1.2 mp0 -89.95 -20.71 23.0 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.723 -178.61 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.602 HD13 ' SG ' ' A' ' 48' ' ' CYS . 13.5 pt -142.91 -177.2 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.306 0.574 . . . . 0.0 111.871 -177.701 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.7 mmt180 -157.26 140.83 15.78 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.861 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -97.36 145.58 26.01 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.886 -179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.439 ' NE ' ' HA2' ' A' ' 64' ' ' GLY . 1.2 tmt_? -143.32 138.84 29.79 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-O 121.068 0.461 . . . . 0.0 110.664 -177.857 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.566 ' HE1' ' OD1' ' A' ' 82' ' ' ASP . 80.6 t80 -143.36 147.42 34.65 Favored 'General case' 0 C--O 1.208 -1.089 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.994 179.46 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.0 t70 57.55 22.84 8.55 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 121.73 0.776 . . . . 0.0 110.665 179.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.439 ' HA2' ' NE ' ' A' ' 61' ' ' ARG . . . 80.27 2.74 89.47 Favored Glycine 0 N--CA 1.427 -1.95 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.706 -178.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -119.43 149.96 48.73 Favored Pre-proline 0 N--CA 1.442 -0.864 0 O-C-N 122.313 -0.522 . . . . 0.0 109.741 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_exo -65.06 141.26 69.26 Favored 'Trans proline' 0 C--N 1.327 -0.56 0 C-N-CA 122.245 1.963 . . . . 0.0 111.654 178.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.421 HD12 ' HB2' ' A' ' 62' ' ' PHE . 44.2 mt -92.74 146.21 6.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 178.147 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -112.85 170.46 8.18 Favored 'General case' 0 CA--C 1.502 -0.87 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -75.92 -15.72 60.14 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.515 0.674 . . . . 0.0 109.772 176.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 18.9 p -93.86 3.92 54.68 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.313 179.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.474 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 22.4 m-20 -82.09 142.05 32.62 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.477 0.656 . . . . 0.0 111.951 -179.359 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -116.41 139.31 25.19 Favored Pre-proline 0 C--N 1.317 -0.843 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.408 174.391 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.447 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 13.5 Cg_endo -56.76 -33.3 93.86 Favored 'Trans proline' 0 C--O 1.237 0.439 0 C-N-CA 123.036 2.491 . . . . 0.0 113.131 -175.783 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.83 -27.93 66.28 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.688 -179.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -65.05 -37.9 89.06 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.926 0.393 . . . . 0.0 111.296 -179.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -93.09 7.14 45.4 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 -179.855 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 43.35 40.21 2.5 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.636 1.174 . . . . 0.0 112.479 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.447 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 5.5 ptm -74.16 157.09 36.58 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.827 -178.409 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -103.39 159.85 15.21 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.013 -176.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.517 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 10.5 p-10 -57.69 141.92 46.84 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.245 0.545 . . . . 0.0 111.057 174.423 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.417 ' HB2' ' O ' ' A' ' 80' ' ' ASP . 8.3 mt-10 74.77 19.1 2.58 Favored 'General case' 0 CA--C 1.506 -0.727 0 C-N-CA 124.337 1.055 . . . . 0.0 111.48 -179.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.566 ' OD1' ' HE1' ' A' ' 62' ' ' PHE . 16.4 t70 -64.16 150.05 46.51 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.685 177.146 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 23.2 m -104.07 113.9 27.76 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.413 0.625 . . . . 0.0 112.044 -179.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.533 HG13 HG21 ' A' ' 22' ' ' VAL . 17.3 mm -83.59 145.08 8.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.532 178.278 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -102.83 116.86 33.38 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.124 -179.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.41 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 71.3 t -113.06 134.85 54.4 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-O 121.321 0.582 . . . . 0.0 111.175 176.496 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 13.0 p90 -132.9 155.5 48.94 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.749 -179.712 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.515 ' HG3' ' HG3' ' A' ' 90' ' ' GLN . 4.4 tp60 -75.55 132.1 40.47 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.49 0.662 . . . . 0.0 112.051 -176.693 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -114.82 11.08 16.63 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.2 178.238 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.515 ' HG3' ' HG3' ' A' ' 88' ' ' GLN . 0.0 OUTLIER -105.81 153.15 22.3 Favored 'General case' 0 C--N 1.317 -0.838 0 O-C-N 121.826 -0.546 . . . . 0.0 111.187 -178.203 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 36.0 m -149.11 97.31 2.67 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 121.198 0.523 . . . . 0.0 110.123 178.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -175.39 75.04 0.08 OUTLIER Glycine 0 N--CA 1.441 -0.981 0 N-CA-C 110.966 -0.854 . . . . 0.0 110.966 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.249 0 CA-C-O 118.351 -1.25 . . . . 0.0 111.386 -177.818 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.1 ttp . . . . . 0 N--CA 1.473 0.693 0 CA-C-O 120.844 0.354 . . . . 0.0 111.332 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -88.71 10.92 19.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.0 0.428 . . . . 0.0 112.02 -177.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -86.01 41.09 0.9 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 122.001 0.905 . . . . 0.0 109.959 179.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -58.09 116.03 3.28 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.039 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -78.07 133.58 64.9 Favored Pre-proline 0 C--N 1.318 -0.779 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.219 -179.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.411 ' O ' ' N ' ' A' ' 8' ' ' GLU . 18.2 Cg_endo -66.43 143.29 69.05 Favored 'Trans proline' 0 CA--C 1.507 -0.849 0 C-N-CA 122.637 2.225 . . . . 0.0 113.296 -177.256 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.51 ' CD ' ' HG3' ' A' ' 8' ' ' GLU . 0.9 OUTLIER -6.04 -46.15 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 116.724 2.12 . . . . 0.0 116.724 173.187 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.51 ' HG3' ' CD ' ' A' ' 7' ' ' LYS . 45.4 mt-10 -85.5 52.3 2.42 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 121.192 -0.942 . . . . 0.0 109.89 178.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -147.05 70.49 0.35 Allowed Glycine 0 N--CA 1.441 -0.994 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.002 -178.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.9 p -114.2 22.67 5.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-O 122.575 1.179 . . . . 0.0 109.358 178.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -74.03 88.18 1.88 Allowed 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 114.891 -1.049 . . . . 0.0 111.684 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 13.4 t -139.21 3.35 2.16 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.537 177.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -155.3 159.43 39.99 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.872 -178.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -136.78 43.97 2.38 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 74.66 16.55 3.11 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-O 122.532 1.158 . . . . 0.0 109.192 -176.178 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -69.42 93.0 0.63 Allowed 'General case' 0 C--O 1.236 0.361 0 CA-C-N 114.632 -1.167 . . . . 0.0 110.749 -176.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -121.14 154.12 36.61 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.429 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 31.9 pt -130.95 170.72 19.13 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.066 0 CA-C-O 121.379 0.609 . . . . 0.0 110.994 -178.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -104.85 136.23 44.74 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.563 178.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -127.93 135.93 50.64 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 177.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -121.81 146.82 46.7 Favored 'General case' 0 C--N 1.308 -1.215 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 179.018 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.659 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 3.4 p -124.62 131.44 72.7 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.797 -176.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -112.06 132.03 55.07 Favored 'General case' 0 C--O 1.244 0.79 0 CA-C-O 121.151 0.5 . . . . 0.0 110.762 -178.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -102.92 174.12 23.09 Favored Glycine 0 N--CA 1.435 -1.391 0 C-N-CA 121.292 -0.48 . . . . 0.0 112.725 -179.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.611 ' NE2' ' H ' ' A' ' 25' ' ' GLN . 0.1 OUTLIER -66.92 -31.41 71.98 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.531 0.681 . . . . 0.0 110.782 -177.529 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -77.31 -10.65 59.57 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.984 -178.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 98.82 7.37 55.51 Favored Glycine 0 N--CA 1.443 -0.894 0 C-N-CA 120.448 -0.882 . . . . 0.0 112.578 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 18.7 t -83.46 154.24 24.03 Favored 'General case' 0 N--CA 1.444 -0.765 0 O-C-N 122.416 -0.461 . . . . 0.0 109.976 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.659 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.2 p -146.68 132.69 13.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.269 0.557 . . . . 0.0 111.074 179.564 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.0 t -117.12 135.16 58.4 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -105.35 142.75 34.56 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.754 0.311 . . . . 0.0 110.92 -179.568 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -138.44 156.46 47.54 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.109 0.48 . . . . 0.0 110.96 -179.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 35.5 pt -131.94 165.19 32.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.149 0.499 . . . . 0.0 111.32 -177.314 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.471 ' HB2' ' OG1' ' A' ' 38' ' ' THR . 15.6 mtpp -75.48 153.79 37.35 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.042 178.335 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.9 ptt180 -67.14 -22.38 65.78 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.507 0.67 . . . . 0.0 110.492 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -103.76 2.31 32.78 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 122.205 1.002 . . . . 0.0 109.357 -176.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.471 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.2 m -89.97 134.47 31.76 Favored Pre-proline 0 C--N 1.302 -1.476 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.808 178.551 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -61.34 125.51 17.07 Favored 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 122.33 2.02 . . . . 0.0 112.27 -178.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.515 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.0 OUTLIER -65.92 -17.42 64.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.112 0.482 . . . . 0.0 111.899 -179.57 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.446 ' N ' HD13 ' A' ' 40' ' ' LEU . 5.9 p -55.68 -28.25 54.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.416 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -60.91 -45.55 94.21 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 116.25 -0.432 . . . . 0.0 109.946 179.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.515 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.5 pp -72.91 -36.73 67.33 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.014 0.435 . . . . 0.0 110.231 178.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 45.1 mtm -63.58 -49.59 72.78 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 120.996 0.426 . . . . 0.0 110.855 -178.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.471 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 92.5 mttt -66.25 -36.1 82.13 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-O 120.688 0.28 . . . . 0.0 110.866 178.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.54 -37.42 87.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.114 0.483 . . . . 0.0 109.981 178.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -58.73 -55.43 35.16 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.793 178.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.502 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 24.4 p -64.8 -35.47 81.19 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 122.141 -0.349 . . . . 0.0 111.325 -177.061 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.471 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 60.7 mt-10 -67.04 -40.75 87.22 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.795 0.331 . . . . 0.0 111.507 179.653 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -81.82 -32.26 31.32 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 120.935 0.398 . . . . 0.0 111.472 -178.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.7 mm-40 -82.04 -22.69 36.28 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -177.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 90.2 37.7 6.6 Favored Glycine 0 N--CA 1.437 -1.262 0 C-N-CA 120.114 -1.041 . . . . 0.0 111.174 -178.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.502 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 3.9 mm? -123.62 165.35 17.33 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 179.297 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.1 m -119.49 155.48 32.02 Favored 'General case' 0 C--N 1.312 -1.031 0 O-C-N 121.922 -0.486 . . . . 0.0 110.971 178.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 12.9 mmt -63.15 -26.04 68.63 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.448 0.642 . . . . 0.0 111.453 178.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.462 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.84 -12.65 50.24 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.553 0.692 . . . . 0.0 110.52 177.219 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -96.94 -27.23 14.74 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.748 -0.66 . . . . 0.0 112.178 -178.112 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.8 pt -132.59 176.12 9.8 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.041 0 CA-C-O 121.076 0.465 . . . . 0.0 110.485 -178.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 16.1 mmt180 -149.72 141.67 23.83 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.729 178.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -100.08 139.41 35.78 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.977 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.621 ' HG2' ' N ' ' A' ' 62' ' ' PHE . 1.5 ttm180 -137.83 150.63 47.33 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-O 121.179 0.514 . . . . 0.0 110.865 -178.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.621 ' N ' ' HG2' ' A' ' 61' ' ' ARG . 74.4 t80 -155.23 146.1 22.44 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.841 176.511 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.2 t70 57.45 24.6 10.4 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 121.637 0.732 . . . . 0.0 110.403 -178.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.95 0.18 84.62 Favored Glycine 0 N--CA 1.435 -1.417 0 C-N-CA 121.011 -0.614 . . . . 0.0 113.292 -179.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -115.87 146.52 37.12 Favored Pre-proline 0 C--N 1.319 -0.728 0 O-C-N 122.13 -0.629 . . . . 0.0 110.067 179.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.55 139.74 45.58 Favored 'Trans proline' 0 C--O 1.238 0.495 0 C-N-CA 122.053 1.836 . . . . 0.0 111.806 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.445 HD12 ' HB2' ' A' ' 62' ' ' PHE . 42.8 mt -91.72 146.43 6.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 120.929 0.395 . . . . 0.0 110.242 -178.631 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.435 HD21 ' HB2' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -109.53 157.74 18.7 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 177.222 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.446 ' OE2' HG23 ' A' ' 70' ' ' THR . 0.1 OUTLIER -68.65 -19.53 64.41 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-O 121.649 0.738 . . . . 0.0 110.579 178.061 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.446 HG23 ' OE2' ' A' ' 69' ' ' GLU . 1.0 OUTLIER -96.32 14.81 23.03 Favored 'General case' 0 N--CA 1.421 -1.905 0 CA-C-N 116.011 -0.54 . . . . 0.0 112.107 179.693 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.435 ' HB2' HD21 ' A' ' 68' ' ' ASN . 3.3 t70 -96.4 150.84 20.14 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 120.881 0.372 . . . . 0.0 110.31 -179.576 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.725 ' HB ' ' OE1' ' A' ' 75' ' ' GLN . 0.9 OUTLIER -117.61 141.39 28.85 Favored Pre-proline 0 CA--C 1.545 0.754 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 179.179 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.498 ' HD2' ' CG2' ' A' ' 72' ' ' THR . 12.2 Cg_endo -53.66 -34.26 73.03 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 123.545 2.83 . . . . 0.0 113.122 -177.246 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.81 -26.25 65.98 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.76 -178.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.725 ' OE1' ' HB ' ' A' ' 72' ' ' THR . 6.3 mp0 -67.29 -38.83 85.65 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.936 0.398 . . . . 0.0 111.444 -179.332 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.1 mp -81.51 -10.48 59.47 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.513 -179.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 55.01 46.74 23.64 Favored 'General case' 0 C--N 1.347 0.474 0 CA-C-O 121.971 0.891 . . . . 0.0 109.785 -179.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 5.6 ptm -76.04 -141.22 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 114.703 -1.135 . . . . 0.0 112.048 -176.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.547 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 11.9 pt-20 -160.74 152.07 19.19 Favored 'General case' 0 CA--C 1.508 -0.641 0 O-C-N 121.673 -0.642 . . . . 0.0 109.367 -176.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -59.01 142.97 49.75 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.285 0.564 . . . . 0.0 111.163 173.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 71.56 15.63 6.03 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 124.14 0.976 . . . . 0.0 111.175 179.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.547 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 3.6 t0 -70.98 158.92 35.68 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.811 0.339 . . . . 0.0 110.131 179.261 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 27.3 m -108.31 126.51 52.92 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.616 0.722 . . . . 0.0 112.562 -176.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 44.7 mm -89.75 133.85 30.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.118 176.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -93.85 114.44 26.68 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 120.769 0.318 . . . . 0.0 110.605 -178.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 92.5 t -112.55 137.19 46.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-O 121.096 0.474 . . . . 0.0 110.533 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.7 p90 -139.64 154.1 47.46 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.109 -179.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -80.35 111.51 16.81 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.465 0.65 . . . . 0.0 111.691 -176.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 77.1 mm-40 -109.04 32.23 5.09 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.029 177.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 18.0 tm0? -54.62 -43.34 72.17 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.129 0.49 . . . . 0.0 110.377 178.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 11.5 m -102.79 132.48 48.93 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 65.59 34.27 88.57 Favored Glycine 0 C--O 1.239 0.42 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.233 -176.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.136 0 CA-C-O 118.587 -1.118 . . . . 0.0 111.616 -178.182 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 pmm? . . . . . 0 N--CA 1.476 0.872 0 CA-C-O 120.34 0.114 . . . . 0.0 111.18 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 86.41 119.56 0.04 OUTLIER 'General case' 0 C--N 1.354 0.772 0 C-N-CA 124.272 1.029 . . . . 0.0 110.745 178.206 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -109.56 30.24 6.83 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.924 -178.156 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -28.88 112.02 0.07 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.392 1.077 . . . . 0.0 113.738 178.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -139.58 139.06 21.21 Favored Pre-proline 0 C--N 1.309 -1.17 0 CA-C-N 115.028 -0.987 . . . . 0.0 108.781 178.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -67.88 -163.29 0.08 OUTLIER 'Trans proline' 0 CA--C 1.535 0.552 0 C-N-CA 122.439 2.093 . . . . 0.0 112.244 179.021 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.23 1.11 46.95 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.549 0.69 . . . . 0.0 110.761 -179.054 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -148.87 129.9 14.41 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.915 178.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -147.1 39.29 1.07 Allowed Glycine 0 C--N 1.309 -0.933 0 N-CA-C 111.499 -0.641 . . . . 0.0 111.499 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.7 p -100.22 126.14 53.82 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 CA-C-O 121.677 0.751 . . . . 0.0 110.928 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.48 123.39 16.46 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.292 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.6 t -90.37 135.55 33.61 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.202 0.525 . . . . 0.0 110.444 178.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -125.57 173.87 8.64 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.774 -179.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -85.0 -4.28 59.09 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.391 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 31.0 m-80 -101.31 158.39 16.08 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.016 0.436 . . . . 0.0 110.376 -179.208 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -122.08 -167.2 1.51 Allowed 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 177.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.513 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 50.2 p-80 -120.35 152.46 37.84 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.369 0.605 . . . . 0.0 112.027 -176.449 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 38.9 pt -132.2 170.53 19.71 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.653 178.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.425 HD22 ' HB3' ' A' ' 31' ' ' GLN . 16.6 t-20 -104.57 129.64 52.63 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 121.02 0.438 . . . . 0.0 110.797 -179.819 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -123.1 135.18 54.27 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 176.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.401 ' HG2' ' HG3' ' A' ' 31' ' ' GLN . 51.5 mtmt -119.86 141.69 49.34 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 -179.625 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.565 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 62.9 t -121.58 131.51 72.91 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 -177.785 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.25 125.71 50.67 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.152 0.501 . . . . 0.0 110.07 -178.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -103.23 156.29 17.97 Favored Glycine 0 N--CA 1.432 -1.576 0 C-N-CA 120.332 -0.937 . . . . 0.0 112.139 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.08 -10.9 0.21 Allowed 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 178.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -78.31 -21.64 49.35 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.612 0.72 . . . . 0.0 109.854 178.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 98.72 24.23 11.08 Favored Glycine 0 N--CA 1.443 -0.84 0 N-CA-C 110.196 -1.161 . . . . 0.0 110.196 -177.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.5 t -117.54 131.44 56.7 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.084 -0.558 . . . . 0.0 110.186 -177.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.565 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 3.1 p -124.55 142.61 40.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-O 121.317 0.58 . . . . 0.0 110.912 179.26 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.8 t -125.19 140.91 46.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.425 ' HB3' HD22 ' A' ' 19' ' ' ASN . 0.7 OUTLIER -106.28 140.26 39.5 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 120.844 0.354 . . . . 0.0 110.944 -179.675 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 12.5 m-85 -133.79 152.14 51.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.851 0.358 . . . . 0.0 110.439 -179.043 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.414 HD12 HD22 ' A' ' 43' ' ' LEU . 24.9 pt -127.53 168.27 20.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.984 0.421 . . . . 0.0 111.314 -177.141 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.513 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 10.6 mptt -80.82 153.73 27.54 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.023 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.5 ptt180 -71.46 -13.95 61.98 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.217 0.532 . . . . 0.0 111.21 -178.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -105.75 -5.41 19.92 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 122.16 0.981 . . . . 0.0 108.479 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.502 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.8 m -85.77 130.3 51.29 Favored Pre-proline 0 N--CA 1.427 -1.613 0 CA-C-N 114.594 -1.185 . . . . 0.0 109.776 -179.649 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -61.88 123.01 11.82 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.367 2.045 . . . . 0.0 112.198 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.612 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.3 pp -61.42 -16.56 47.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.707 179.221 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.455 ' N ' HD11 ' A' ' 40' ' ' LEU . 47.9 t -50.15 -35.29 25.42 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 123.34 0.656 . . . . 0.0 111.569 179.309 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -66.59 -42.77 86.43 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 120.985 -0.286 . . . . 0.0 110.902 -178.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.612 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.0 pp -69.98 -33.27 71.84 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.988 0.423 . . . . 0.0 109.991 178.396 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 48.1 mtm -65.75 -48.27 72.44 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.24 0.543 . . . . 0.0 110.731 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 10.8 mmmm -64.31 -38.12 89.9 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 121.002 0.43 . . . . 0.0 110.158 177.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.62 -40.59 97.47 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.196 178.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -58.26 -54.56 45.65 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.615 178.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.608 ' SG ' HD11 ' A' ' 58' ' ' ILE . 31.4 m -58.92 -44.16 91.25 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.881 0.372 . . . . 0.0 110.976 -178.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -62.01 -42.42 99.14 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.014 0.375 . . . . 0.0 112.014 -179.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -78.8 -36.9 42.07 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.177 0.513 . . . . 0.0 111.732 -177.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.427 ' CB ' HD21 ' A' ' 53' ' ' LEU . 24.9 mm-40 -79.09 -20.38 48.91 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 112.403 0.52 . . . . 0.0 112.403 -177.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.51 42.29 6.98 Favored Glycine 0 N--CA 1.429 -1.792 0 C-N-CA 119.926 -1.13 . . . . 0.0 110.856 -177.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.427 HD21 ' CB ' ' A' ' 51' ' ' GLN . 4.0 mm? -124.01 163.66 20.94 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.405 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.418 ' HB2' ' HB2' ' A' ' 57' ' ' GLN . 48.6 m -116.59 151.37 36.35 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 178.516 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.433 ' HE1' ' SG ' ' A' ' 48' ' ' CYS . 10.0 mmt -60.39 -28.01 67.89 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.321 0.581 . . . . 0.0 111.382 179.306 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.428 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -84.81 -17.33 38.48 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.529 0.681 . . . . 0.0 110.503 177.923 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.418 ' HB2' ' HB2' ' A' ' 54' ' ' SER . 1.0 OUTLIER -90.43 -22.96 21.17 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.215 -178.277 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.608 HD11 ' SG ' ' A' ' 48' ' ' CYS . 16.1 pt -136.49 177.84 5.73 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 CA-C-O 121.513 0.673 . . . . 0.0 111.944 -178.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.449 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 17.0 mmt-85 -151.82 140.01 20.3 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.344 178.126 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -96.18 142.7 28.04 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.249 179.035 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -142.42 144.99 33.34 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-O 121.112 0.482 . . . . 0.0 110.888 -176.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.427 ' HB2' HD11 ' A' ' 67' ' ' ILE . 73.1 t80 -150.72 146.1 26.22 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 178.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 22.7 t70 56.71 23.42 7.86 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 121.772 0.796 . . . . 0.0 110.836 -178.163 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.01 -19.81 28.41 Favored Glycine 0 N--CA 1.428 -1.84 0 C-N-CA 121.055 -0.593 . . . . 0.0 112.312 -178.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -97.21 149.5 35.78 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-O 120.833 0.349 . . . . 0.0 111.199 -178.189 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.56 142.68 36.81 Favored 'Trans proline' 0 C--O 1.237 0.474 0 C-N-CA 122.651 2.234 . . . . 0.0 112.285 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.427 HD11 ' HB2' ' A' ' 62' ' ' PHE . 23.7 mt -95.69 149.68 4.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.104 0.478 . . . . 0.0 110.16 -179.442 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -127.03 173.01 10.0 Favored 'General case' 0 CA--C 1.5 -0.947 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 178.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -75.31 -9.68 58.77 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.399 0.619 . . . . 0.0 110.041 177.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 22.1 p -92.22 -4.76 53.66 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.585 -179.084 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -95.76 143.57 26.88 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-O 121.608 0.718 . . . . 0.0 112.229 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.95 152.13 43.43 Favored Pre-proline 0 C--N 1.312 -1.055 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.377 177.354 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.475 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 18.8 Cg_endo -58.64 -29.62 89.79 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.538 2.159 . . . . 0.0 112.251 -177.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -77.27 -13.37 59.95 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.952 -178.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -76.39 -37.54 57.02 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.374 0.607 . . . . 0.0 110.545 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -91.15 9.68 30.07 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.99 -179.688 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 44.16 36.87 1.64 Allowed 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.253 1.021 . . . . 0.0 111.857 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.475 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 7.0 ptm -76.36 159.71 30.26 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.554 -178.485 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.549 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 7.4 pt-20 -115.03 167.92 10.38 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.446 -176.705 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.437 ' O ' ' HB2' ' A' ' 81' ' ' GLU . 6.8 p-10 -59.49 144.97 45.66 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-O 121.017 0.436 . . . . 0.0 111.202 175.221 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' A' ' 80' ' ' ASP . 56.3 mm-40 74.39 14.74 3.6 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.181 0.992 . . . . 0.0 111.7 -179.58 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.549 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 0.6 OUTLIER -74.52 154.23 38.74 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.293 178.627 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 18.1 m -112.33 131.67 55.4 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.597 0.713 . . . . 0.0 112.919 -175.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.53 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 22.8 mm -94.92 142.78 12.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.838 178.208 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -101.84 116.14 32.06 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.935 0.398 . . . . 0.0 110.547 179.017 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.449 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 44.7 t -111.19 135.98 48.69 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.085 0 CA-C-O 121.302 0.572 . . . . 0.0 110.91 178.279 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.2 p90 -135.5 160.09 39.55 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.781 -179.103 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -88.47 120.87 30.25 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.411 0.624 . . . . 0.0 111.698 -176.13 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 -106.14 19.88 19.82 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.333 177.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -63.39 121.43 13.77 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.133 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 8.2 m -59.77 117.8 5.41 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.174 0.511 . . . . 0.0 111.35 -178.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -91.26 75.81 1.52 Allowed Glycine 0 N--CA 1.442 -0.929 0 C-N-CA 120.875 -0.678 . . . . 0.0 111.597 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.908 0 CA-C-O 118.717 -1.046 . . . . 0.0 111.936 -179.489 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 47.3 tpp . . . . . 0 N--CA 1.477 0.882 0 CA-C-O 121.095 0.474 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.453 ' HA ' ' HG3' ' A' ' 5' ' ' LYS . . . -117.05 26.24 9.93 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.508 0.67 . . . . 0.0 109.969 179.768 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -59.67 -43.16 94.07 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.58 -0.736 . . . . 0.0 112.03 -176.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -115.26 35.13 4.5 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.208 0.527 . . . . 0.0 110.867 -179.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.453 ' HG3' ' HA ' ' A' ' 2' ' ' ALA . 16.2 ptmt -169.16 88.97 0.6 Allowed Pre-proline 0 C--N 1.32 -0.708 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.593 -177.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -79.85 156.86 24.07 Favored 'Trans proline' 0 N--CA 1.45 -1.071 0 C-N-CA 122.565 2.177 . . . . 0.0 112.081 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.67 -16.57 30.15 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 121.446 0.641 . . . . 0.0 110.353 178.295 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -100.39 103.47 14.85 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.193 178.317 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 82.09 60.57 2.13 Favored Glycine 0 N--CA 1.439 -1.146 0 C-N-CA 120.634 -0.793 . . . . 0.0 111.998 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 14.9 p -57.68 147.6 6.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 177.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -98.02 -168.22 1.63 Allowed 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 121.544 -0.722 . . . . 0.0 111.007 -176.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.0 t -128.19 139.08 52.67 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.353 179.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -93.59 -6.83 45.68 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.235 0.54 . . . . 0.0 110.315 179.058 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 70.35 27.31 4.05 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.254 -0.884 . . . . 0.0 111.225 175.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -81.61 69.54 8.3 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.673 0.749 . . . . 0.0 111.205 179.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -62.83 169.45 3.2 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.898 177.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.477 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 42.5 p-80 -117.28 143.76 45.57 Favored 'General case' 0 C--N 1.291 -1.968 0 CA-C-O 121.363 0.602 . . . . 0.0 110.474 -177.518 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 35.3 pt -123.33 168.46 15.82 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.563 0 CA-C-O 121.466 0.65 . . . . 0.0 111.211 -176.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -105.65 135.86 46.3 Favored 'General case' 0 C--N 1.307 -1.278 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 179.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -125.96 134.03 51.64 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.075 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -120.21 141.63 49.74 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.555 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 61.5 t -124.27 134.77 65.75 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.388 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 -176.663 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.72 130.13 55.65 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.035 0.445 . . . . 0.0 110.574 -177.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -102.6 174.1 23.41 Favored Glycine 0 N--CA 1.436 -1.341 0 N-CA-C 111.446 -0.662 . . . . 0.0 111.446 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -72.57 -18.73 61.59 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.353 0.597 . . . . 0.0 111.185 -177.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -71.11 -16.91 62.59 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.868 177.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 96.46 16.37 37.39 Favored Glycine 0 CA--C 1.496 -1.124 0 N-CA-C 110.836 -0.906 . . . . 0.0 110.836 179.11 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.1 m -106.68 132.11 53.05 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 115.257 -0.471 . . . . 0.0 111.032 -177.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.555 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.2 p -122.48 139.03 50.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 121.199 0.523 . . . . 0.0 111.292 178.492 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.2 t -118.99 137.48 52.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -104.79 140.49 38.02 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.904 0.383 . . . . 0.0 111.022 -179.063 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.434 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 15.1 m-85 -136.15 155.68 49.81 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 121.01 0.433 . . . . 0.0 110.974 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 36.8 pt -141.29 164.77 19.7 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 CA-C-O 120.762 0.315 . . . . 0.0 110.514 -178.172 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.477 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 30.8 mtmm -78.26 154.14 31.24 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.808 0.337 . . . . 0.0 110.69 178.148 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -69.03 -18.13 63.99 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.084 0.468 . . . . 0.0 111.024 -179.26 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 -102.51 1.78 35.5 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.833 0.825 . . . . 0.0 109.045 -179.087 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 m -96.24 133.48 24.95 Favored Pre-proline 0 N--CA 1.437 -1.119 0 CA-C-N 114.959 -1.018 . . . . 0.0 109.569 179.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -65.97 134.88 38.76 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.517 2.145 . . . . 0.0 112.63 -177.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.596 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -68.55 -16.04 63.74 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -178.863 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.463 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 3.8 p -50.99 -31.31 17.61 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.8 mtpt -61.39 -47.88 83.82 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.241 0.543 . . . . 0.0 110.084 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.6 pp -73.93 -32.32 63.46 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.78 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 46.0 mtm -64.55 -45.47 86.97 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 121.19 0.519 . . . . 0.0 110.743 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.507 ' HZ1' ' HB3' ' A' ' 45' ' ' LYS . 7.0 mtpm? -69.86 -34.94 74.27 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.401 178.276 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.06 -37.38 87.22 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.308 0.575 . . . . 0.0 109.801 179.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -59.92 -55.55 32.71 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.907 177.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.676 ' SG ' HD11 ' A' ' 58' ' ' ILE . 33.1 m -60.46 -44.32 96.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.403 -178.098 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -66.4 -31.51 72.32 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -177.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 11.6 ptm180 -87.02 -36.68 18.07 Favored 'General case' 0 C--N 1.328 -0.352 0 O-C-N 121.853 -0.529 . . . . 0.0 111.095 178.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -77.79 -22.46 50.1 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-O 121.148 0.499 . . . . 0.0 112.041 -177.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.18 38.76 6.64 Favored Glycine 0 N--CA 1.434 -1.479 0 C-N-CA 120.386 -0.911 . . . . 0.0 111.523 -179.088 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -121.09 159.63 25.35 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.124 0.487 . . . . 0.0 110.32 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.473 ' HB2' ' HB2' ' A' ' 57' ' ' GLN . 51.1 m -108.8 148.21 30.89 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 178.201 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.9 mmt -58.35 -30.18 66.54 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-O 121.16 0.505 . . . . 0.0 111.626 179.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.68 -10.56 55.51 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.136 0.493 . . . . 0.0 111.662 178.35 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.473 ' HB2' ' HB2' ' A' ' 54' ' ' SER . 2.3 mp0 -98.24 -17.19 19.09 Favored 'General case' 0 CA--C 1.504 -0.809 0 CA-C-O 120.96 0.41 . . . . 0.0 111.497 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.676 HD11 ' SG ' ' A' ' 48' ' ' CYS . 17.0 pt -139.68 179.18 2.98 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 CA-C-O 120.937 0.398 . . . . 0.0 110.506 179.235 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.498 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 19.6 mmt-85 -154.43 144.74 22.07 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.097 0.475 . . . . 0.0 111.03 177.473 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -100.22 141.81 32.55 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.262 178.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -142.22 138.9 31.79 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-O 121.155 0.502 . . . . 0.0 110.701 -177.084 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.419 ' HB2' HD11 ' A' ' 67' ' ' ILE . 71.5 t80 -146.16 147.45 31.51 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 179.717 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 54.93 24.48 5.89 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.172 0.589 . . . . 0.0 111.524 -179.174 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.84 3.3 90.63 Favored Glycine 0 N--CA 1.442 -0.961 0 C-N-CA 120.652 -0.785 . . . . 0.0 113.177 179.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -121.88 151.49 57.91 Favored Pre-proline 0 C--N 1.317 -0.84 0 O-C-N 121.846 -0.797 . . . . 0.0 110.798 178.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.56 141.24 54.68 Favored 'Trans proline' 0 N--CA 1.459 -0.542 0 C-N-CA 122.259 1.973 . . . . 0.0 111.121 177.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.419 HD11 ' HB2' ' A' ' 62' ' ' PHE . 45.7 mt -90.63 145.01 7.94 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.94 0 CA-C-O 120.816 0.341 . . . . 0.0 110.102 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.493 HD21 ' HB2' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -111.92 157.53 20.55 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 178.034 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.463 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 16.9 pt-20 -71.01 -19.56 62.5 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 121.644 0.735 . . . . 0.0 110.019 179.257 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.2 p -91.27 5.97 47.08 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.878 -178.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.493 ' HB2' HD21 ' A' ' 68' ' ' ASN . 2.9 t70 -93.35 151.53 19.71 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-O 121.001 0.429 . . . . 0.0 110.365 -178.448 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.509 ' HB ' ' OE1' ' A' ' 75' ' ' GLN . 1.7 m -118.62 140.16 27.99 Favored Pre-proline 0 C--N 1.316 -0.867 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.555 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 12.4 Cg_endo -52.55 -32.28 52.87 Favored 'Trans proline' 0 C--N 1.355 0.872 0 C-N-CA 123.657 2.905 . . . . 0.0 113.146 -176.294 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.43 -20.82 64.67 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.098 -177.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.509 ' OE1' ' HB ' ' A' ' 72' ' ' THR . 1.6 mp0 -73.4 -37.35 65.99 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.919 0.39 . . . . 0.0 111.096 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -88.43 -2.91 58.86 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.92 0.39 . . . . 0.0 110.541 -178.146 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 58.5 34.14 23.68 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.343 0.592 . . . . 0.0 110.884 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.555 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.7 ptm -75.35 160.07 30.71 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.74 -178.573 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -116.4 168.26 10.31 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.582 -175.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -60.95 141.16 57.5 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.774 0.797 . . . . 0.0 111.636 177.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 70.12 17.98 7.13 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.412 -1.267 . . . . 0.0 112.609 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -70.03 156.83 38.59 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 176.332 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 10.5 m -107.83 132.33 53.53 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -174.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.522 HG13 HG21 ' A' ' 22' ' ' VAL . 20.8 mm -97.08 142.67 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.555 178.465 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -100.42 117.96 35.67 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 120.637 0.256 . . . . 0.0 110.406 178.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.498 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 47.9 t -112.92 132.92 60.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 CA-C-O 121.124 0.487 . . . . 0.0 110.346 176.069 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 16.6 p90 -131.65 149.04 52.63 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.938 -178.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -73.92 111.34 8.98 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.242 0.544 . . . . 0.0 111.344 -178.559 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.434 ' H ' ' HA ' ' A' ' 58' ' ' ILE . 8.9 mm-40 -93.85 22.94 5.17 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.357 0.599 . . . . 0.0 110.444 176.804 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -76.53 110.42 11.07 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 13.7 t -69.44 154.73 41.58 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 64.62 52.7 40.6 Favored Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 120.598 -0.811 . . . . 0.0 111.45 -177.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.41 0 CA-C-O 118.13 -1.372 . . . . 0.0 111.105 -178.985 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.489 1.498 0 CA-C-O 121.163 0.506 . . . . 0.0 111.284 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -154.53 24.55 0.46 Allowed 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.845 0.831 . . . . 0.0 109.209 -179.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -128.14 7.7 6.03 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.949 -176.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -55.44 111.91 0.99 Allowed 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.134 -0.939 . . . . 0.0 112.174 -178.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -136.13 125.27 15.76 Favored Pre-proline 0 C--N 1.315 -0.901 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.006 176.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -70.27 161.08 47.33 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.199 1.932 . . . . 0.0 111.695 178.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.433 ' HD2' ' N ' ' A' ' 8' ' ' GLU . 0.2 OUTLIER -79.98 -20.19 46.1 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -179.41 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.433 ' N ' ' HD2' ' A' ' 7' ' ' LYS . 23.5 mm-40 -136.62 175.55 9.51 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-O 121.257 0.551 . . . . 0.0 111.849 -178.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 86.09 -41.62 3.09 Favored Glycine 0 C--N 1.332 0.316 0 CA-C-N 116.027 -0.533 . . . . 0.0 112.818 178.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 61.8 t 55.49 74.46 0.09 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.407 0 CA-C-O 121.691 0.758 . . . . 0.0 111.2 -178.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.549 ' HD3' ' O ' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -38.12 125.68 1.26 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 114.584 -1.189 . . . . 0.0 113.227 177.361 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.5 t -162.98 170.13 18.54 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.93 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -102.29 -72.39 0.69 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.816 0.341 . . . . 0.0 111.261 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 58.15 39.23 26.2 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-O 121.133 0.492 . . . . 0.0 111.344 -178.116 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -98.85 12.11 36.74 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.242 0.544 . . . . 0.0 110.067 -179.235 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -64.8 92.25 0.09 Allowed 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.758 0.79 . . . . 0.0 111.662 -179.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 52.5 p-80 -124.74 147.76 48.46 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.39 0.614 . . . . 0.0 111.757 -179.32 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 32.1 pt -130.87 170.75 19.03 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.297 -179.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.419 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 26.3 t-20 -107.12 125.09 50.62 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 116.272 -0.422 . . . . 0.0 109.862 179.181 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.422 HD12 ' OD2' ' A' ' 82' ' ' ASP . 2.7 mm? -114.72 141.66 47.53 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.824 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -128.37 142.24 51.18 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 -178.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.533 ' HA ' ' HB ' ' A' ' 84' ' ' ILE . 57.7 t -122.79 132.75 70.7 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.364 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 -178.049 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.47 124.58 47.96 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 -179.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.472 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -102.66 169.13 19.0 Favored Glycine 0 N--CA 1.431 -1.643 0 C-N-CA 120.086 -1.054 . . . . 0.0 112.737 -178.306 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -61.43 -5.6 1.82 Allowed 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.205 0.602 . . . . 0.0 112.514 178.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -86.36 -21.66 27.09 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.62 0.724 . . . . 0.0 109.683 178.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 104.73 -16.46 47.46 Favored Glycine 0 CA--C 1.491 -1.409 0 N-CA-C 109.957 -1.257 . . . . 0.0 109.957 -178.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.9 m -76.72 131.91 39.02 Favored 'General case' 0 N--CA 1.429 -1.516 0 CA-C-N 114.639 -0.781 . . . . 0.0 111.233 -178.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.491 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.1 p -122.17 140.81 44.92 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.896 178.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.9 t -121.99 138.46 52.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 -179.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -107.18 140.11 40.56 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.041 0.448 . . . . 0.0 111.139 -179.888 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.483 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 15.5 m-85 -132.84 151.97 51.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.128 0.49 . . . . 0.0 110.727 -177.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.411 HG12 HD22 ' A' ' 20' ' ' LEU . 24.5 pt -138.15 168.97 19.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.052 0.453 . . . . 0.0 110.933 -177.146 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 7.1 mtmp? -80.92 144.87 31.6 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 120.81 0.338 . . . . 0.0 110.693 178.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -68.73 -14.12 62.82 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.186 0.517 . . . . 0.0 111.475 -177.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 -101.76 -3.27 28.4 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-O 122.247 1.022 . . . . 0.0 108.367 -178.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.451 ' HB ' ' O ' ' A' ' 35' ' ' LYS . 1.5 m -93.96 140.33 22.91 Favored Pre-proline 0 N--CA 1.437 -1.082 0 CA-C-N 114.244 -1.343 . . . . 0.0 110.796 -178.715 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.502 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 35.5 Cg_endo -59.71 126.11 19.64 Favored 'Trans proline' 0 C--O 1.238 0.478 0 C-N-CA 122.98 2.453 . . . . 0.0 112.29 -179.346 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.644 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.9 OUTLIER -69.92 -16.55 63.24 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.378 0.609 . . . . 0.0 111.346 179.579 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.456 ' N ' HD13 ' A' ' 40' ' ' LEU . 0.7 OUTLIER -50.53 -31.79 16.57 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 123.919 0.887 . . . . 0.0 111.742 -179.597 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.502 ' HE3' ' HG2' ' A' ' 39' ' ' PRO . 90.6 mttt -59.08 -50.63 73.34 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.431 0.634 . . . . 0.0 109.982 179.293 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.644 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.7 pp -70.17 -32.25 70.12 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.049 -178.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 45.2 mtm -64.71 -50.63 66.18 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 120.786 0.327 . . . . 0.0 111.305 -178.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.472 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 24.4 mmmt -65.61 -33.81 76.76 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 120.911 0.386 . . . . 0.0 110.469 178.104 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.77 -37.5 87.82 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.136 0.493 . . . . 0.0 109.979 178.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -60.08 -56.41 21.96 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.464 177.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.462 ' SG ' ' HA ' ' A' ' 45' ' ' LYS . 24.5 p -61.88 -35.63 78.89 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 111.814 0.301 . . . . 0.0 111.814 -178.167 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.472 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 48.3 mt-10 -66.72 -43.52 84.06 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 122.214 -0.303 . . . . 0.0 111.525 179.59 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 14.0 ptm180 -76.66 -37.28 56.52 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.117 0.484 . . . . 0.0 111.483 -178.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.45 ' HB3' HD23 ' A' ' 53' ' ' LEU . 21.1 mm-40 -74.29 -21.92 59.52 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 120.967 0.413 . . . . 0.0 111.914 -178.561 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.96 42.14 7.78 Favored Glycine 0 N--CA 1.428 -1.882 0 C-N-CA 119.767 -1.206 . . . . 0.0 110.995 -177.318 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.45 HD23 ' HB3' ' A' ' 51' ' ' GLN . 4.0 mm? -125.05 167.0 15.37 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 51.1 m -116.88 151.67 36.11 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 178.076 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.3 mmt -59.62 -28.12 66.93 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-O 121.197 0.522 . . . . 0.0 111.779 178.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.416 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -84.67 -13.87 50.2 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.58 0.705 . . . . 0.0 110.587 177.646 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -93.48 -17.2 23.7 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.026 -178.618 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 14.3 pt -141.49 179.66 2.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 121.176 0.512 . . . . 0.0 111.426 -179.163 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.476 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 6.1 mmt180 -155.23 140.23 17.35 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.689 177.725 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -97.83 143.02 28.87 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.732 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? -141.8 135.98 30.2 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.556 0.693 . . . . 0.0 111.402 -178.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 78.6 t80 -142.87 146.93 34.57 Favored 'General case' 0 N--CA 1.433 -1.302 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 177.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.444 ' C ' ' H ' ' A' ' 65' ' ' GLN . 13.0 t70 50.45 40.69 23.69 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 121.254 0.549 . . . . 0.0 109.906 -176.639 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 66.2 -20.9 0.17 Allowed Glycine 0 CA--C 1.532 1.152 0 N-CA-C 115.462 0.945 . . . . 0.0 115.462 -176.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.444 ' H ' ' C ' ' A' ' 63' ' ' ASP . 12.6 pt20 -92.81 147.11 33.43 Favored Pre-proline 0 C--N 1.316 -0.867 0 CA-C-N 117.516 0.658 . . . . 0.0 110.944 -177.597 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -69.68 142.51 48.46 Favored 'Trans proline' 0 N--CA 1.452 -0.919 0 C-N-CA 122.146 1.898 . . . . 0.0 110.912 179.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 34.4 mt -91.52 144.12 9.86 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.184 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 -178.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -121.42 162.7 19.97 Favored 'General case' 0 CA--C 1.499 -0.986 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -178.834 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -72.73 -13.75 61.4 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 121.244 0.545 . . . . 0.0 110.49 178.339 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 22.0 p -95.07 4.7 53.43 Favored 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 179.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -105.45 154.61 20.1 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.4 0.619 . . . . 0.0 112.01 178.719 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.403 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.6 OUTLIER -116.46 155.49 48.52 Favored Pre-proline 0 C--N 1.319 -0.738 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.978 177.724 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.625 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 13.2 Cg_endo -57.28 -30.92 89.29 Favored 'Trans proline' 0 C--O 1.236 0.381 0 C-N-CA 122.835 2.357 . . . . 0.0 112.253 -179.329 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.95 -16.57 60.64 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.75 -178.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.403 ' HB2' ' O ' ' A' ' 72' ' ' THR . 20.2 mm-40 -73.2 -39.64 65.4 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.375 0.607 . . . . 0.0 110.314 178.621 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.407 HD12 ' SD ' ' A' ' 78' ' ' MET . 1.1 mp -86.05 -2.57 58.44 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.682 179.047 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 59.33 30.84 20.62 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.261 179.077 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.625 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 5.7 ptm -76.55 168.21 20.48 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.031 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -136.59 -178.62 5.25 Favored 'General case' 0 C--N 1.313 -1.004 0 O-C-N 122.167 -0.333 . . . . 0.0 110.65 -177.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.438 ' O ' ' HB2' ' A' ' 81' ' ' GLU . 8.0 p-10 -61.56 141.08 57.99 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.553 0.692 . . . . 0.0 112.121 179.174 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.438 ' HB2' ' O ' ' A' ' 80' ' ' ASP . 4.6 mm-40 80.31 15.93 0.73 Allowed 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.278 1.431 . . . . 0.0 111.531 178.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.422 ' OD2' HD12 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -62.24 146.11 51.76 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.857 176.897 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 17.6 m -114.17 111.73 22.04 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-O 121.822 0.82 . . . . 0.0 112.332 175.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.533 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 14.3 mm -80.82 144.39 10.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 114.955 -1.021 . . . . 0.0 109.741 179.283 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -107.43 123.48 48.46 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 120.962 0.411 . . . . 0.0 110.982 178.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.476 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 86.7 t -113.46 139.04 40.95 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-O 121.205 0.526 . . . . 0.0 110.998 177.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.6 p90 -133.61 150.12 51.6 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.052 179.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.55 127.53 33.31 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.741 0.782 . . . . 0.0 112.102 -177.35 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -101.98 16.15 26.86 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.563 176.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -96.57 86.68 4.18 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 15.1 p -126.55 119.57 27.45 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.424 -177.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 58.52 42.81 96.15 Favored Glycine 0 N--CA 1.453 -0.216 0 CA-C-N 116.378 -0.374 . . . . 0.0 113.1 178.474 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.274 0 CA-C-O 118.313 -1.271 . . . . 0.0 111.363 -179.946 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 54.2 tpp . . . . . 0 N--CA 1.473 0.681 0 CA-C-O 120.891 0.377 . . . . 0.0 110.721 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -116.84 35.06 4.77 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.578 0.704 . . . . 0.0 110.55 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -76.33 -42.74 43.97 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 121.348 0.594 . . . . 0.0 110.686 -176.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -95.05 22.57 6.46 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.182 -176.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -137.52 96.4 10.89 Favored Pre-proline 0 C--N 1.315 -0.918 0 O-C-N 122.074 -0.391 . . . . 0.0 110.058 -179.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -77.51 175.79 10.85 Favored 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 122.637 2.225 . . . . 0.0 111.526 178.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.485 ' HD2' ' H ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -71.93 -2.52 18.33 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.198 0.523 . . . . 0.0 111.035 178.087 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -84.03 173.73 10.89 Favored 'General case' 0 N--CA 1.436 -1.134 0 CA-C-O 121.251 0.548 . . . . 0.0 111.212 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 120.04 32.11 1.22 Allowed Glycine 0 N--CA 1.442 -0.93 0 N-CA-C 111.564 -0.614 . . . . 0.0 111.564 -179.508 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.3 t -106.35 99.88 9.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.073 0.463 . . . . 0.0 110.221 -179.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 14.4 tppt? -67.8 148.87 50.65 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.255 0.55 . . . . 0.0 111.185 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.4 t -151.03 148.29 28.17 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.006 177.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 60.81 13.16 4.22 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.609 0.763 . . . . 0.0 112.501 179.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -133.34 16.13 4.09 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-O 121.733 0.777 . . . . 0.0 109.28 178.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -114.82 -41.04 3.43 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.153 -0.93 . . . . 0.0 108.945 179.022 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.442 ' O ' ' HB3' ' A' ' 17' ' ' HIS . 2.9 p-10 -136.64 -158.17 0.84 Allowed 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 177.179 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.442 ' HB3' ' O ' ' A' ' 16' ' ' ASP . 6.0 t-160 75.64 96.94 0.07 Allowed 'General case' 0 CA--C 1.493 -1.247 0 CA-C-O 122.139 0.971 . . . . 0.0 108.853 -179.035 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 45.2 pt -121.52 170.55 11.48 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.215 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.952 -173.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -105.5 135.43 46.91 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.37 178.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -127.25 134.42 50.07 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 177.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -118.51 146.54 44.46 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-O 121.23 0.538 . . . . 0.0 110.14 179.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.561 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 4.8 p -125.09 128.93 73.32 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.897 0 CA-C-N 116.108 -0.497 . . . . 0.0 109.992 -179.705 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -119.52 131.34 55.54 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.223 0.535 . . . . 0.0 109.906 -178.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -107.08 158.02 15.3 Favored Glycine 0 N--CA 1.432 -1.615 0 C-N-CA 120.41 -0.9 . . . . 0.0 111.355 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.19 -18.71 6.3 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 177.84 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -69.26 -21.88 63.87 Favored 'General case' 0 C--O 1.224 -0.288 0 O-C-N 121.961 -0.462 . . . . 0.0 110.574 177.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 103.79 2.77 46.25 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.043 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.0 t -93.7 159.39 15.23 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 179.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.561 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.6 p -148.97 136.91 14.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.05 0.452 . . . . 0.0 110.662 -179.445 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.8 t -118.93 135.54 59.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -106.72 143.14 35.25 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.824 0.345 . . . . 0.0 110.733 -179.384 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -137.16 161.56 35.83 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.167 0.508 . . . . 0.0 110.83 -178.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 19.4 pt -130.67 171.54 17.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 121.1 0.476 . . . . 0.0 110.826 -177.472 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 32.7 mtmm -83.51 150.33 26.06 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 176.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -71.73 -11.07 60.64 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.269 0.556 . . . . 0.0 111.082 -178.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 18.8 t60 -99.16 -2.01 37.93 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.535 0.683 . . . . 0.0 109.636 -178.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -99.33 148.17 34.29 Favored Pre-proline 0 N--CA 1.442 -0.864 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.006 -178.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -65.12 131.53 28.91 Favored 'Trans proline' 0 C--O 1.239 0.553 0 C-N-CA 122.582 2.188 . . . . 0.0 112.509 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.471 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.2 pp -70.28 -16.93 63.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.131 0.491 . . . . 0.0 111.628 179.444 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.456 ' N ' HD12 ' A' ' 40' ' ' LEU . 9.0 p -53.16 -28.25 25.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.076 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.0 mtmt -66.1 -42.98 88.55 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 120.861 0.362 . . . . 0.0 110.907 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.7 pp -71.89 -34.3 69.05 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 121.17 0.509 . . . . 0.0 109.794 178.382 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 47.9 mtm -65.07 -46.62 80.39 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 120.997 0.427 . . . . 0.0 110.722 -179.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.483 ' HA ' ' SG ' ' A' ' 48' ' ' CYS . 80.8 mttt -66.76 -36.15 81.77 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 120.855 0.36 . . . . 0.0 110.796 177.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.474 ' O ' ' HG2' ' A' ' 50' ' ' ARG . . . -63.34 -37.88 88.98 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.232 0.539 . . . . 0.0 109.666 178.732 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -61.14 -56.4 21.28 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.945 178.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.483 ' SG ' ' HA ' ' A' ' 45' ' ' LYS . 24.3 p -62.52 -38.65 90.8 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.727 0.298 . . . . 0.0 111.436 -177.435 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -65.95 -37.4 85.93 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 -179.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . 0.474 ' HG2' ' O ' ' A' ' 46' ' ' ALA . 14.7 ptm180 -83.26 -33.25 26.07 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 121.87 -0.519 . . . . 0.0 111.438 -179.656 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -78.61 -21.85 47.89 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-O 120.998 0.428 . . . . 0.0 112.053 -178.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.71 39.83 7.46 Favored Glycine 0 N--CA 1.433 -1.531 0 C-N-CA 120.167 -1.016 . . . . 0.0 111.24 -178.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -126.37 168.2 14.48 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.013 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.6 m -120.61 157.22 30.01 Favored 'General case' 0 C--N 1.312 -1.041 0 O-C-N 122.264 -0.273 . . . . 0.0 110.647 179.038 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 15.5 mmt -63.13 -26.76 68.97 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.422 0.63 . . . . 0.0 111.457 179.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.413 ' HD2' ' H ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.53 -12.99 50.34 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 121.548 0.689 . . . . 0.0 110.437 177.74 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -96.48 -26.03 15.44 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.911 -178.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.3 pt -135.29 176.37 8.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 120.819 0.342 . . . . 0.0 110.714 -179.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 17.4 mmt180 -152.88 146.57 25.12 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.209 0.528 . . . . 0.0 111.07 179.018 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -104.6 143.25 33.32 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.439 -177.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.435 ' HG2' ' O ' ' A' ' 65' ' ' GLN . 7.7 tmm_? -143.03 141.31 31.29 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-O 121.172 0.511 . . . . 0.0 110.859 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.454 ' HB2' HD13 ' A' ' 67' ' ' ILE . 69.5 t80 -146.8 147.42 30.87 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 178.45 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 24.8 t70 58.59 23.19 10.62 Favored 'General case' 0 N--CA 1.483 1.182 0 CA-C-O 121.869 0.842 . . . . 0.0 110.728 -178.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.415 ' HA2' ' HD3' ' A' ' 61' ' ' ARG . . . 79.2 1.32 85.48 Favored Glycine 0 N--CA 1.428 -1.835 0 C-N-CA 120.939 -0.648 . . . . 0.0 112.849 -179.213 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.435 ' O ' ' HG2' ' A' ' 61' ' ' ARG . 12.0 pt20 -116.72 147.44 39.9 Favored Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 122.148 -0.619 . . . . 0.0 110.599 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -67.62 141.05 53.71 Favored 'Trans proline' 0 C--O 1.237 0.431 0 C-N-CA 122.602 2.202 . . . . 0.0 111.824 -179.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.454 HD13 ' HB2' ' A' ' 62' ' ' PHE . 24.1 mt -98.79 141.24 16.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-O 121.049 0.452 . . . . 0.0 110.088 -179.183 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -112.39 170.61 8.05 Favored 'General case' 0 CA--C 1.497 -1.08 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 177.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.439 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 8.9 pt-20 -73.76 -17.01 61.15 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.564 0.697 . . . . 0.0 110.119 177.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 17.6 p -82.96 -21.62 33.97 Favored 'General case' 0 N--CA 1.434 -1.225 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.707 -177.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.64 154.08 32.55 Favored 'General case' 0 N--CA 1.437 -1.11 0 N-CA-C 112.999 0.741 . . . . 0.0 112.999 -178.079 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -115.31 154.22 47.5 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.892 175.5 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_endo -57.88 -29.3 85.85 Favored 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.981 2.454 . . . . 0.0 111.915 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.83 -20.24 60.51 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.673 -178.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -69.52 -37.06 76.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.363 0.602 . . . . 0.0 111.146 179.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.1 mp -88.76 -2.15 58.45 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.204 -178.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 53.87 38.14 28.04 Favored 'General case' 0 C--N 1.345 0.388 0 CA-C-O 121.772 0.796 . . . . 0.0 110.985 179.351 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.1 ptm -77.79 169.49 18.2 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.631 -178.543 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -117.68 169.15 9.81 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -177.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -62.58 142.63 57.92 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 121.64 0.733 . . . . 0.0 111.439 176.481 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 74.71 16.77 3.03 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 124.847 1.259 . . . . 0.0 111.953 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.69 155.4 40.58 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.769 0.318 . . . . 0.0 110.276 176.365 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 84.3 m -111.0 132.15 54.45 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.696 0.76 . . . . 0.0 112.708 -175.543 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 41.5 mm -96.7 141.93 14.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.341 -0.845 . . . . 0.0 108.906 177.651 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -103.51 124.12 48.17 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 120.957 0.408 . . . . 0.0 110.919 179.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 99.0 t -115.28 136.16 52.94 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-O 121.264 0.555 . . . . 0.0 111.113 178.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.4 p90 -135.98 152.95 51.47 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.916 -179.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -80.04 113.91 18.57 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.339 0.59 . . . . 0.0 112.504 -176.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 26.3 mm-40 -95.14 22.81 6.28 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.359 0.599 . . . . 0.0 111.303 176.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.435 HE21 ' HB3' ' A' ' 90' ' ' GLN . 0.9 OUTLIER -105.92 101.5 11.0 Favored 'General case' 0 N--CA 1.438 -1.069 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 -179.755 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.8 t -145.74 143.75 29.92 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.251 -178.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 110.98 148.52 11.41 Favored Glycine 0 N--CA 1.431 -1.638 0 C-N-CA 120.543 -0.837 . . . . 0.0 111.996 178.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.372 0 CA-C-O 118.63 -1.094 . . . . 0.0 111.472 179.628 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.8 ptt? . . . . . 0 N--CA 1.482 1.16 0 N-CA-C 111.775 0.287 . . . . 0.0 111.775 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.56 4.71 17.56 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.381 0.61 . . . . 0.0 111.091 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -80.73 -13.94 58.55 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.634 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . 0.498 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 45.0 mt-10 -108.91 138.3 45.46 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 177.258 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.498 ' HB2' ' O ' ' A' ' 4' ' ' GLU . 0.9 OUTLIER 76.13 155.6 0.15 Allowed Pre-proline 0 N--CA 1.472 0.637 0 C-N-CA 123.295 0.638 . . . . 0.0 111.343 178.18 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_endo -79.29 -160.19 0.12 Allowed 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.595 2.197 . . . . 0.0 110.904 177.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.437 ' HD2' ' N ' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -76.3 -12.79 60.13 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.382 0.611 . . . . 0.0 110.871 177.908 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.437 ' N ' ' HD2' ' A' ' 7' ' ' LYS . 9.5 pt-20 -108.4 176.59 5.07 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.213 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 93.47 22.5 26.5 Favored Glycine 0 N--CA 1.446 -0.695 0 N-CA-C 110.786 -0.926 . . . . 0.0 110.786 -176.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.2 p -97.45 134.08 36.81 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 CA-C-O 120.892 0.377 . . . . 0.0 110.407 -178.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.2 mptt 56.66 68.13 0.9 Allowed 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.737 0.78 . . . . 0.0 111.424 -177.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.0 t -85.38 165.8 16.93 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.217 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -81.79 28.37 0.42 Allowed 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.603 0.716 . . . . 0.0 111.355 -178.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -105.68 8.32 33.0 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.305 0.574 . . . . 0.0 109.815 177.709 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -84.13 -3.83 58.37 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.725 0.774 . . . . 0.0 109.953 179.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -73.95 103.83 4.59 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.099 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . 0.459 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 55.8 p-80 -122.88 152.5 40.72 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.042 -177.168 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 36.5 pt -131.66 164.02 35.69 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-O 121.376 0.608 . . . . 0.0 111.037 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -96.11 136.92 35.93 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.377 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.451 HD22 HG12 ' A' ' 34' ' ' ILE . 3.0 mm? -129.75 139.66 51.25 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 176.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -125.03 144.98 50.12 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-O 121.213 0.53 . . . . 0.0 110.305 -179.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.598 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 5.2 p -122.72 132.06 72.02 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.532 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.551 -178.496 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.1 119.07 33.64 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.376 0.608 . . . . 0.0 110.151 -179.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -96.33 146.5 18.29 Favored Glycine 0 N--CA 1.428 -1.854 0 C-N-CA 120.836 -0.697 . . . . 0.0 111.493 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.48 ' HG3' ' O ' ' A' ' 86' ' ' VAL . 0.0 OUTLIER -53.29 -16.36 1.28 Allowed 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 178.866 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -71.91 -21.37 61.64 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.206 0.527 . . . . 0.0 110.394 177.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 103.71 27.22 6.45 Favored Glycine 0 N--CA 1.443 -0.855 0 N-CA-C 110.651 -0.98 . . . . 0.0 110.651 -178.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.1 p -122.01 131.84 54.21 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-O 120.977 0.418 . . . . 0.0 111.475 -178.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.598 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.4 p -124.08 137.1 58.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 121.161 0.505 . . . . 0.0 111.525 178.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.1 t -120.79 137.16 55.45 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 179.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -107.15 144.16 34.28 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.934 0.397 . . . . 0.0 111.265 -179.394 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -140.79 158.86 43.35 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.282 0.563 . . . . 0.0 110.982 -178.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.451 HG12 HD22 ' A' ' 20' ' ' LEU . 33.7 pt -136.86 167.93 22.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-O 120.829 0.347 . . . . 0.0 110.44 -177.43 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.503 ' HB2' ' OG1' ' A' ' 38' ' ' THR . 0.0 OUTLIER -79.39 151.74 30.77 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.184 0.516 . . . . 0.0 110.919 179.584 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 5.9 ptt180 -67.05 -18.0 65.15 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.384 0.611 . . . . 0.0 110.723 179.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 59.8 t60 -102.93 -3.5 26.06 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 122.186 0.993 . . . . 0.0 108.897 -177.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.503 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 2.3 m -90.16 136.01 29.26 Favored Pre-proline 0 C--N 1.306 -1.311 0 CA-C-N 114.502 -1.227 . . . . 0.0 110.473 -178.711 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.45 125.26 15.26 Favored 'Trans proline' 0 C--O 1.24 0.578 0 C-N-CA 122.447 2.098 . . . . 0.0 111.979 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.48 HD11 ' N ' ' A' ' 41' ' ' SER . 1.2 pp -62.61 -17.34 60.04 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.445 0.64 . . . . 0.0 111.303 179.247 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.48 ' N ' HD11 ' A' ' 40' ' ' LEU . 0.7 OUTLIER -51.42 -29.49 16.1 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 124.11 0.964 . . . . 0.0 111.37 179.312 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -62.85 -49.1 76.2 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.618 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.8 pp -68.83 -34.78 76.07 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 120.968 0.413 . . . . 0.0 110.058 179.57 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 48.1 mtm -61.36 -45.92 92.39 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 121.059 0.457 . . . . 0.0 110.447 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.67 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 7.9 mtpm? -69.28 -40.44 77.75 Favored 'General case' 0 C--O 1.212 -0.897 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.642 177.802 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.64 -40.17 82.66 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-O 121.444 0.64 . . . . 0.0 109.83 -179.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 58.8 t80 -56.89 -55.67 31.56 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.224 176.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.673 ' SG ' HD11 ' A' ' 58' ' ' ILE . 21.7 m -61.16 -39.94 91.98 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.87 0.367 . . . . 0.0 110.698 -179.231 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.67 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 69.2 mm-40 -58.75 -49.91 75.89 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 121.274 0.559 . . . . 0.0 111.098 178.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 -77.71 -36.83 50.61 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.805 -176.187 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.427 ' CB ' HD23 ' A' ' 53' ' ' LEU . 23.0 mm-40 -76.25 -22.14 55.51 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -177.506 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.22 42.52 7.0 Favored Glycine 0 N--CA 1.431 -1.659 0 C-N-CA 119.523 -1.323 . . . . 0.0 110.782 -176.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.427 HD23 ' CB ' ' A' ' 51' ' ' GLN . 4.1 mm? -125.16 164.15 20.89 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-O 121.149 0.5 . . . . 0.0 110.157 -179.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.8 m -117.0 154.15 31.41 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.0 mmt -63.88 -25.59 68.23 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-O 121.336 0.589 . . . . 0.0 111.093 179.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.85 -17.89 36.58 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.42 0.628 . . . . 0.0 110.772 177.554 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -88.78 -25.74 22.1 Favored 'General case' 0 CA--C 1.507 -0.697 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.352 -178.012 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.673 HD11 ' SG ' ' A' ' 48' ' ' CYS . 15.1 pt -136.08 -178.02 2.21 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.088 0 CA-C-O 121.022 0.439 . . . . 0.0 111.344 -179.204 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.415 ' CG ' ' HG3' ' A' ' 89' ' ' GLN . 19.3 mmt180 -157.89 146.9 19.46 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.505 177.222 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -102.77 146.34 28.39 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.151 -178.437 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 8.0 tmm_? -143.58 142.32 31.03 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.545 0.688 . . . . 0.0 111.326 -179.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.459 ' HB2' HD13 ' A' ' 67' ' ' ILE . 65.7 t80 -148.59 148.11 29.78 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 18.5 t70 57.59 22.7 8.47 Favored 'General case' 0 N--CA 1.484 1.273 0 CA-C-O 121.667 0.746 . . . . 0.0 110.978 -177.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.05 11.61 84.66 Favored Glycine 0 N--CA 1.43 -1.744 0 C-N-CA 120.477 -0.868 . . . . 0.0 112.627 -179.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -126.87 147.08 59.77 Favored Pre-proline 0 CA--C 1.534 0.338 0 O-C-N 122.222 -0.575 . . . . 0.0 109.891 178.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -66.21 143.34 70.65 Favored 'Trans proline' 0 CA--C 1.532 0.42 0 C-N-CA 122.314 2.01 . . . . 0.0 111.959 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.459 HD13 ' HB2' ' A' ' 62' ' ' PHE . 28.7 mt -97.7 148.84 5.43 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-O 120.95 0.405 . . . . 0.0 110.244 -178.484 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -125.79 169.96 12.08 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 178.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -77.19 -8.72 58.02 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-O 121.316 0.579 . . . . 0.0 110.311 177.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 41.0 p -91.12 -3.65 56.9 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.34 179.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -100.52 148.4 24.83 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.413 0.625 . . . . 0.0 112.173 -179.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -111.8 157.26 40.01 Favored Pre-proline 0 C--N 1.323 -0.559 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.766 178.137 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.587 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 18.0 Cg_endo -60.32 -31.24 92.59 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.733 2.289 . . . . 0.0 111.595 178.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -77.91 -11.02 59.86 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.555 -179.165 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.467 ' NE2' ' HA ' ' A' ' 75' ' ' GLN . 8.6 tp60 -71.44 -48.37 49.95 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 121.638 0.732 . . . . 0.0 110.118 -179.465 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.11 0.46 53.45 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.364 -178.169 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 51.98 44.17 29.71 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 121.731 0.777 . . . . 0.0 110.674 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.587 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.0 ptm -76.35 158.81 31.1 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.956 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -108.84 167.11 10.31 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-O 120.804 0.335 . . . . 0.0 110.577 -176.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -52.08 137.63 27.11 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.326 0.584 . . . . 0.0 111.443 174.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 67.65 23.76 8.66 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.083 -0.962 . . . . 0.0 112.482 178.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.98 150.41 47.72 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 175.307 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 28.8 m -106.31 126.75 52.62 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 121.558 0.694 . . . . 0.0 112.807 -174.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 42.0 mm -93.06 140.93 15.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 176.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -106.36 123.33 47.9 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-O 121.054 0.454 . . . . 0.0 110.916 179.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.48 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 85.9 t -111.38 137.08 45.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.029 0.442 . . . . 0.0 111.193 179.682 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.2 p90 -134.3 152.87 52.05 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.855 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -77.31 118.56 19.91 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.516 0.674 . . . . 0.0 111.507 -178.106 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.415 ' HG3' ' CG ' ' A' ' 59' ' ' ARG . 55.5 mm-40 -102.72 20.26 17.62 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.075 178.017 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -88.36 109.37 19.93 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 178.133 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 62.3 m -131.1 99.51 4.9 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.232 0.539 . . . . 0.0 110.572 179.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 79.5 -76.59 1.96 Allowed Glycine 0 N--CA 1.444 -0.812 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.122 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.51 0 CA-C-O 118.181 -1.344 . . . . 0.0 111.477 -179.486 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.559 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 43.7 p-80 . . . . . 0 N--CA 1.434 -1.248 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 40.5 pt -119.26 162.14 17.75 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.838 0 CA-C-O 121.634 0.73 . . . . 0.0 111.375 -176.202 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.513 ' HA ' ' O ' ' A' ' 32' ' ' PHE . 23.7 t-20 -100.11 132.88 45.21 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.27 178.481 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -122.6 134.56 54.51 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-O 121.102 0.477 . . . . 0.0 109.793 177.523 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.412 ' HG2' ' HG3' ' A' ' 31' ' ' GLN . 48.3 mtmt -117.39 144.41 44.99 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.586 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.695 HG22 HG13 ' A' ' 84' ' ' ILE . 90.5 t -124.86 134.98 65.48 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.705 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -177.942 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -117.08 130.11 56.43 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.171 0.51 . . . . 0.0 110.819 -178.512 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -101.69 178.32 27.32 Favored Glycine 0 N--CA 1.43 -1.71 0 C-N-CA 121.036 -0.602 . . . . 0.0 111.896 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.472 ' CD ' ' H ' ' A' ' 25' ' ' GLN . 0.3 OUTLIER -60.52 -31.74 70.8 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.76 0.791 . . . . 0.0 110.592 -179.002 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -71.33 -16.0 62.42 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.285 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.31 5.95 69.27 Favored Glycine 0 N--CA 1.446 -0.684 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 -175.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 9.2 t -80.84 126.45 31.36 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.622 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 28.3 t -120.42 138.84 49.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-O 121.272 0.558 . . . . 0.0 110.878 -178.544 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.8 t -122.12 136.85 57.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 177.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.413 ' HB3' HD21 ' A' ' 19' ' ' ASN . 0.2 OUTLIER -104.74 143.82 32.58 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.742 0.306 . . . . 0.0 110.562 -179.586 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.513 ' O ' ' HA ' ' A' ' 19' ' ' ASN . 14.4 m-85 . . . . . 0 N--CA 1.47 0.543 0 CA-C-O 120.808 0.337 . . . . 0.0 110.702 -179.138 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.458 HD13 HD23 ' A' ' 43' ' ' LEU . 36.6 pt . . . . . 0 N--CA 1.465 0.284 0 CA-C-O 120.805 0.336 . . . . 0.0 111.007 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.559 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 0.0 OUTLIER -80.7 153.28 27.95 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 121.123 0.487 . . . . 0.0 110.641 178.456 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.5 ptt180 -63.43 -19.37 64.64 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.762 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 67.1 t60 -104.3 -3.55 24.07 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 122.161 0.981 . . . . 0.0 108.728 -176.811 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 m -86.68 132.32 42.81 Favored Pre-proline 0 N--CA 1.43 -1.441 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.96 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -59.91 122.07 10.83 Favored 'Trans proline' 0 C--O 1.239 0.565 0 C-N-CA 122.482 2.121 . . . . 0.0 112.413 -178.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.658 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.9 OUTLIER -63.37 -17.23 62.4 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.375 0.607 . . . . 0.0 111.102 179.075 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.491 ' N ' HD12 ' A' ' 40' ' ' LEU . 0.8 OUTLIER -50.69 -34.68 27.62 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 123.974 0.91 . . . . 0.0 111.211 179.193 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.3 mtpm? -59.15 -51.42 70.11 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.361 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.658 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.3 pp -68.72 -34.54 75.81 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.738 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 48.2 mtm -63.01 -51.18 67.8 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-O 121.152 0.501 . . . . 0.0 110.863 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -66.58 -34.59 78.22 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-O 121.021 0.438 . . . . 0.0 110.932 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.23 -36.52 84.36 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.08 0.467 . . . . 0.0 110.022 177.107 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -59.92 -55.63 31.68 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.672 178.111 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 26.5 p -65.12 -34.98 79.69 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 122.097 -0.377 . . . . 0.0 111.557 -177.098 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -65.89 -38.64 89.3 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.93 0.395 . . . . 0.0 111.751 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -85.27 -30.18 24.0 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.009 0.433 . . . . 0.0 111.165 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -82.66 -21.65 34.91 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -177.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 87.9 40.45 6.66 Favored Glycine 0 N--CA 1.437 -1.272 0 C-N-CA 119.882 -1.152 . . . . 0.0 111.198 -177.621 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.406 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 4.0 mm? -123.34 161.88 23.82 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.879 0.371 . . . . 0.0 110.262 179.374 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.459 ' HB2' ' HB2' ' A' ' 57' ' ' GLN . 48.3 m -114.79 150.07 35.99 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 110.346 -0.242 . . . . 0.0 110.346 178.888 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.2 mmt -64.44 -23.95 67.46 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.216 0.532 . . . . 0.0 111.508 178.488 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.425 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -84.41 -17.48 39.15 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.306 0.574 . . . . 0.0 110.368 176.922 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.459 ' HB2' ' HB2' ' A' ' 54' ' ' SER . 2.4 mp0 -93.31 -30.13 15.29 Favored 'General case' 0 CA--C 1.507 -0.696 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.896 -178.286 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.7 pt -128.57 178.35 5.06 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.249 0 CA-C-O 121.39 0.614 . . . . 0.0 111.862 -178.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.405 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 15.5 mmt180 -156.55 142.54 18.0 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.394 177.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -97.36 148.3 23.3 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -147.65 134.75 20.39 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-O 121.245 0.545 . . . . 0.0 111.087 -176.858 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.492 ' HB2' HD11 ' A' ' 67' ' ' ILE . 69.2 t80 -141.41 147.86 38.66 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.44 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 17.3 t70 55.94 23.52 6.71 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-O 121.826 0.822 . . . . 0.0 110.32 -176.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.58 -21.63 21.09 Favored Glycine 0 N--CA 1.423 -2.21 0 CA-C-N 115.7 -0.682 . . . . 0.0 112.638 -179.057 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -95.31 149.07 35.64 Favored Pre-proline 0 C--N 1.324 -0.54 0 O-C-N 122.518 -0.401 . . . . 0.0 111.502 -177.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -70.96 142.95 43.84 Favored 'Trans proline' 0 C--O 1.235 0.351 0 C-N-CA 122.776 2.317 . . . . 0.0 112.138 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.492 HD11 ' HB2' ' A' ' 62' ' ' PHE . 15.9 mt -99.0 147.28 7.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-O 120.983 0.421 . . . . 0.0 110.825 -179.36 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -128.24 172.95 10.56 Favored 'General case' 0 CA--C 1.507 -0.673 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.356 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -75.01 -8.08 55.5 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.235 0.541 . . . . 0.0 110.984 177.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 26.2 p -93.45 -4.17 51.77 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.276 0.56 . . . . 0.0 111.141 178.896 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -94.68 144.51 25.56 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.487 0.661 . . . . 0.0 112.006 179.652 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -117.46 149.41 44.72 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.686 177.119 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.403 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 17.8 Cg_endo -59.71 -31.32 94.0 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.939 2.426 . . . . 0.0 113.469 -175.057 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.28 -23.05 63.78 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -178.226 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 6.1 mp0 -69.86 -37.35 76.09 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.098 0.475 . . . . 0.0 111.125 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.439 ' H ' HD12 ' A' ' 76' ' ' LEU . 1.2 mp -86.48 -5.21 59.21 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 -178.754 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 55.96 44.48 25.57 Favored 'General case' 0 C--N 1.344 0.332 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.514 179.158 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.403 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 5.8 ptm -86.12 161.35 18.93 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.003 -177.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -112.18 164.94 12.61 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 -178.112 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.452 ' CB ' ' H ' ' A' ' 19' ' ' ASN . 6.2 p-10 -62.48 144.77 55.59 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.654 0.74 . . . . 0.0 112.137 176.565 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 73.82 17.9 3.47 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.282 -1.326 . . . . 0.0 112.109 179.477 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -78.19 164.42 24.95 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 120.303 -0.559 . . . . 0.0 109.731 176.757 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 21.0 m -114.21 138.15 50.84 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.611 0.72 . . . . 0.0 112.868 -175.848 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.695 HG13 HG22 ' A' ' 22' ' ' VAL . 19.7 mm -99.18 139.34 21.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.443 -0.798 . . . . 0.0 109.858 178.675 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -98.32 116.78 31.26 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.981 0.42 . . . . 0.0 110.76 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.405 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 73.4 t -111.03 137.87 41.68 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.12 0 CA-C-O 121.189 0.519 . . . . 0.0 110.133 177.774 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.8 p90 -136.52 156.7 48.22 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.858 -178.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -85.95 116.05 23.94 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.436 0.636 . . . . 0.0 111.443 -177.399 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 . . . . . 0 C--N 1.319 -0.74 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.604 177.97 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.45 -0.448 0 CA-C-O 122.09 0.948 . . . . 0.0 112.341 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.525 HG13 HD21 ' A' ' 20' ' ' LEU . 39.6 pt -131.95 171.03 18.71 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.212 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.159 -177.696 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.519 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 24.8 t-20 -102.52 126.96 49.76 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-O 120.881 0.372 . . . . 0.0 110.162 179.096 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.609 HD23 HG12 ' A' ' 34' ' ' ILE . 2.7 mm? -118.84 141.54 48.55 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 177.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.422 ' HE2' ' HA ' ' A' ' 81' ' ' GLU . 49.4 mtmt -128.78 141.25 51.37 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-O 121.725 0.774 . . . . 0.0 110.814 -178.82 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.624 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 3.6 p -120.8 127.61 75.96 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.943 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.262 -177.396 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -120.83 131.91 54.71 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-O 121.19 0.519 . . . . 0.0 110.052 -179.183 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -109.19 148.01 16.94 Favored Glycine 0 N--CA 1.426 -1.98 0 C-N-CA 120.519 -0.848 . . . . 0.0 111.241 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.51 ' HG3' ' O ' ' A' ' 86' ' ' VAL . 0.0 OUTLIER -53.56 -12.31 0.46 Allowed 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 179.261 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -73.55 -21.88 60.24 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.505 0.669 . . . . 0.0 110.219 176.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.86 30.15 4.66 Favored Glycine 0 CA--C 1.501 -0.812 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.398 176.621 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.0 p -124.25 157.93 33.69 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 120.857 0.36 . . . . 0.0 110.735 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.624 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.7 p -149.55 139.2 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-O 121.116 0.484 . . . . 0.0 111.266 -178.263 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.468 HG11 ' HD3' ' A' ' 50' ' ' ARG . 6.4 t -122.88 138.03 54.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.204 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -108.17 144.83 35.05 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.827 0.346 . . . . 0.0 110.553 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.548 ' HE1' HG12 ' A' ' 22' ' ' VAL . 7.0 m-85 . . . . . 0 N--CA 1.463 0.216 0 CA-C-O 120.898 0.38 . . . . 0.0 110.567 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.609 HG12 HD23 ' A' ' 20' ' ' LEU . 21.2 pt . . . . . 0 CA--C 1.514 -0.408 0 CA-C-O 120.837 0.351 . . . . 0.0 110.514 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 9.5 mptt -75.6 150.8 37.95 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.2 ppt_? -71.79 -12.91 61.53 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 121.194 0.521 . . . . 0.0 110.951 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -103.1 -4.44 24.5 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 122.115 0.96 . . . . 0.0 108.669 179.03 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.533 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.8 m -86.39 135.23 36.77 Favored Pre-proline 0 C--N 1.304 -1.386 0 CA-C-N 114.799 -1.092 . . . . 0.0 110.241 -178.699 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -59.48 124.21 15.01 Favored 'Trans proline' 0 C--O 1.236 0.399 0 C-N-CA 122.668 2.245 . . . . 0.0 112.326 -179.029 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.6 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.2 pp -66.13 -17.19 64.56 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.298 0.571 . . . . 0.0 111.688 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.478 ' N ' HD12 ' A' ' 40' ' ' LEU . 3.3 p -54.25 -29.34 46.4 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.895 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -64.24 -40.99 97.16 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.461 -179.172 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.0 pp -73.28 -33.66 65.36 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.055 0.455 . . . . 0.0 110.074 178.672 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 51.6 mtm -65.66 -49.81 67.25 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.941 -178.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.41 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 38.0 mttp -67.75 -35.4 78.66 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.624 178.714 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.22 -32.02 73.44 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.146 0.498 . . . . 0.0 109.988 178.073 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -64.11 -55.95 18.35 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.609 178.817 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 17.6 p -63.16 -36.11 82.54 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.841 0.353 . . . . 0.0 111.194 -177.451 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 43.9 mt-10 -67.12 -40.35 86.8 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.92 0.391 . . . . 0.0 111.711 -179.484 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.468 ' HD3' HG11 ' A' ' 30' ' ' VAL . 10.3 ptm180 -84.64 -31.28 24.3 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 122.02 -0.425 . . . . 0.0 111.84 -177.803 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.3 mm-40 -80.7 -22.53 40.27 Favored 'General case' 0 CA--C 1.508 -0.672 0 CA-C-O 121.006 0.431 . . . . 0.0 111.747 -178.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.401 ' C ' HD22 ' A' ' 53' ' ' LEU . . . 88.32 40.98 6.3 Favored Glycine 0 N--CA 1.431 -1.691 0 C-N-CA 120.153 -1.022 . . . . 0.0 111.249 -178.124 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.454 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 3.9 mm? -125.09 166.38 16.51 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.878 -0.415 . . . . 0.0 109.878 179.404 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 57.4 m -117.03 152.95 33.57 Favored 'General case' 0 C--N 1.316 -0.856 0 O-C-N 122.218 -0.301 . . . . 0.0 110.285 178.297 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 12.9 mmt -61.28 -27.44 68.47 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.213 0.53 . . . . 0.0 111.566 178.352 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.76 -12.34 53.92 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.518 0.675 . . . . 0.0 110.49 176.795 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -96.82 -16.87 20.57 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.159 -178.729 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.6 pt -140.37 176.75 4.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-O 121.204 0.526 . . . . 0.0 111.32 -179.26 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.553 ' CG ' ' HG3' ' A' ' 89' ' ' GLN . 3.3 mmt85 -151.53 140.15 20.7 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.914 178.539 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -101.39 138.77 37.96 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.415 -178.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 4.9 ttt180 -140.11 146.96 39.55 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.055 -178.137 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.532 ' HB2' HD11 ' A' ' 67' ' ' ILE . 78.3 t80 -152.57 143.82 23.22 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 178.253 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 54.71 24.87 5.92 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.351 0.596 . . . . 0.0 111.355 -178.193 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.38 -21.96 32.44 Favored Glycine 0 N--CA 1.443 -0.896 0 CA-C-N 116.161 -0.472 . . . . 0.0 113.141 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -98.84 151.59 37.47 Favored Pre-proline 0 C--N 1.321 -0.639 0 O-C-N 122.434 -0.45 . . . . 0.0 111.52 -177.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -71.27 139.61 35.47 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.499 2.132 . . . . 0.0 111.36 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.532 HD11 ' HB2' ' A' ' 62' ' ' PHE . 39.0 mt -89.58 147.22 5.35 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-O 120.839 0.352 . . . . 0.0 110.418 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -114.84 156.83 24.2 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.461 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 14.6 pt-20 -73.25 -12.08 60.73 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.547 0.689 . . . . 0.0 110.997 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 16.4 p -97.61 14.24 27.34 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.344 177.556 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -98.04 151.69 20.08 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.123 0.487 . . . . 0.0 110.817 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.452 ' CG2' ' HD2' ' A' ' 73' ' ' PRO . 1.6 m -113.57 141.02 25.26 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 178.7 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.484 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 16.2 Cg_endo -54.39 -34.03 79.33 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 123.01 2.474 . . . . 0.0 112.263 -178.72 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.69 -16.14 63.29 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.865 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 24.8 mm-40 -74.62 -37.49 62.8 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.093 0.473 . . . . 0.0 111.079 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.461 ' H ' HD12 ' A' ' 76' ' ' LEU . 1.0 OUTLIER -86.86 -1.24 57.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.222 -178.24 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 60.0 mm-40 58.4 33.56 23.23 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.562 0.696 . . . . 0.0 110.887 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.484 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.1 ptm -78.83 161.28 26.89 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.967 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -125.17 174.4 8.1 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 -178.591 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.519 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 7.0 p-10 -57.11 144.01 36.38 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 121.438 0.637 . . . . 0.0 112.08 177.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.422 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 58.2 mm-40 77.44 19.64 1.22 Allowed 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 124.901 1.28 . . . . 0.0 111.526 178.091 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.27 150.57 38.83 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.109 177.404 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 16.5 m -112.61 114.21 26.72 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 121.271 0.557 . . . . 0.0 112.053 175.223 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.499 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 28.9 mm -81.54 142.16 14.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.322 177.223 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -100.07 116.23 31.61 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-O 120.615 0.245 . . . . 0.0 111.102 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.51 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 67.6 t -114.71 135.66 53.86 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-O 121.041 0.448 . . . . 0.0 110.762 177.225 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' PHE . . . . . 0.434 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 10.7 p90 -135.5 153.77 51.63 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.931 -179.248 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -77.35 120.92 23.04 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.456 0.646 . . . . 0.0 112.11 -175.875 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.553 ' HG3' ' CG ' ' A' ' 59' ' ' ARG . 30.3 mm-40 . . . . . 0 C--N 1.319 -0.759 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.686 177.329 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.591 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 38.8 p-80 . . . . . 0 N--CA 1.438 -1.047 0 CA-C-O 121.75 0.786 . . . . 0.0 112.609 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.483 HG13 HD21 ' A' ' 20' ' ' LEU . 29.7 pt -132.86 170.13 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.244 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.64 178.824 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.499 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 27.5 t-20 -105.2 129.42 53.58 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 178.375 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.557 HD23 HG12 ' A' ' 34' ' ' ILE . 2.7 mm? -117.38 142.48 47.06 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -127.56 140.59 52.02 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-O 121.477 0.655 . . . . 0.0 110.155 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.618 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 2.7 p -120.89 126.12 74.85 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.035 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.808 -176.923 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -115.2 128.22 56.02 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.263 0.554 . . . . 0.0 110.154 -178.569 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.458 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -99.87 158.66 19.65 Favored Glycine 0 N--CA 1.43 -1.714 0 C-N-CA 120.335 -0.936 . . . . 0.0 111.312 179.421 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.67 -16.49 1.66 Allowed 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 177.668 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -77.38 -21.6 52.97 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.458 0.647 . . . . 0.0 110.844 178.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.01 -8.55 45.77 Favored Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.915 -0.659 . . . . 0.0 111.928 -178.096 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.9 t -78.85 153.99 30.17 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.319 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.618 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.7 p -149.75 140.57 16.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 120.875 0.369 . . . . 0.0 111.071 -177.404 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.55 HG11 ' HD3' ' A' ' 50' ' ' ARG . 4.7 t -123.2 139.59 49.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.483 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -108.82 142.34 39.54 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.842 0.353 . . . . 0.0 110.674 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.556 ' HE1' HG12 ' A' ' 22' ' ' VAL . 16.7 m-85 . . . . . 0 N--CA 1.468 0.472 0 CA-C-O 121.289 0.566 . . . . 0.0 111.293 -177.704 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.557 HG12 HD23 ' A' ' 20' ' ' LEU . 27.2 pt . . . . . 0 CA--C 1.513 -0.478 0 CA-C-O 120.844 0.354 . . . . 0.0 110.097 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.591 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 0.0 OUTLIER -77.34 150.01 35.22 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.553 179.843 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 3.4 ppt_? -70.41 -8.35 50.15 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.673 0.749 . . . . 0.0 110.211 179.362 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 30.1 t-80 -104.48 -8.22 19.25 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 -179.561 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.406 ' HB ' ' O ' ' A' ' 35' ' ' LYS . 1.2 m -87.16 137.9 32.72 Favored Pre-proline 0 N--CA 1.44 -0.956 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.108 179.525 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -60.7 126.48 19.9 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.374 2.05 . . . . 0.0 112.176 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.512 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.3 pp -67.21 -17.75 64.95 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -178.753 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.469 ' N ' HD12 ' A' ' 40' ' ' LEU . 2.8 p -55.89 -28.86 58.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.886 0.374 . . . . 0.0 111.831 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -60.29 -46.24 90.54 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 120.928 0.394 . . . . 0.0 110.375 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.8 pp -71.83 -35.65 69.95 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.043 0.449 . . . . 0.0 110.436 179.27 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 47.6 mtm -63.07 -46.01 89.46 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.18 0.514 . . . . 0.0 110.863 -178.37 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.5 mtpm? -69.84 -37.05 76.05 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.44 178.685 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.415 ' O ' ' HG2' ' A' ' 50' ' ' ARG . . . -62.27 -37.76 86.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.157 0.503 . . . . 0.0 109.945 178.821 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -58.42 -55.64 32.44 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.184 177.808 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.611 ' SG ' HD11 ' A' ' 58' ' ' ILE . 22.5 m -60.24 -44.93 94.81 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.339 0.59 . . . . 0.0 110.741 -177.83 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -67.32 -30.85 70.8 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 112.824 0.676 . . . . 0.0 112.824 -176.828 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.55 ' HD3' HG11 ' A' ' 30' ' ' VAL . 13.8 ptm180 -90.65 -34.06 15.58 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.823 -0.548 . . . . 0.0 111.551 179.141 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 21.4 mm-40 -78.52 -21.82 48.27 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 121.154 0.502 . . . . 0.0 111.924 -178.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.82 39.83 6.45 Favored Glycine 0 N--CA 1.432 -1.614 0 C-N-CA 119.947 -1.12 . . . . 0.0 110.933 -177.587 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -123.81 166.18 16.04 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.7 m -118.31 155.27 30.93 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 178.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.6 mmt -61.93 -28.16 69.34 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-O 121.451 0.644 . . . . 0.0 111.185 177.382 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.27 -17.89 38.19 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.44 0.638 . . . . 0.0 110.841 177.537 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -88.58 -25.8 22.28 Favored 'General case' 0 CA--C 1.504 -0.807 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.815 -177.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.611 HD11 ' SG ' ' A' ' 48' ' ' CYS . 12.0 pt -133.27 178.65 5.32 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.157 0 CA-C-O 121.497 0.665 . . . . 0.0 112.532 -178.273 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 6.7 mmt180 -148.4 139.4 23.13 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.303 177.578 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -99.69 141.68 32.17 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.886 179.224 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -142.33 143.79 32.91 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-O 121.006 0.431 . . . . 0.0 110.937 -176.839 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.454 ' HB2' HD11 ' A' ' 67' ' ' ILE . 73.0 t80 -149.28 146.21 27.45 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.646 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 17.9 t70 56.82 22.83 7.39 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-O 121.778 0.799 . . . . 0.0 110.481 -178.273 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.19 -21.05 26.44 Favored Glycine 0 N--CA 1.429 -1.817 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.562 -179.051 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -95.72 156.46 37.34 Favored Pre-proline 0 C--N 1.329 -0.313 0 O-C-N 122.575 -0.368 . . . . 0.0 111.131 -178.486 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -77.17 142.04 21.24 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 122.496 2.131 . . . . 0.0 111.589 178.414 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.454 HD11 ' HB2' ' A' ' 62' ' ' PHE . 38.8 mt -90.04 153.41 3.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 120.949 0.404 . . . . 0.0 110.589 -178.432 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -116.38 162.82 16.95 Favored 'General case' 0 CA--C 1.498 -1.038 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 178.889 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.496 ' H ' ' CD ' ' A' ' 69' ' ' GLU . 0.8 OUTLIER -75.27 -18.82 59.99 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-O 121.39 0.614 . . . . 0.0 110.349 178.984 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 8.3 t -98.96 11.97 37.33 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.375 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -95.53 154.09 17.38 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-O 120.959 0.409 . . . . 0.0 110.596 -179.594 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -114.03 147.83 38.66 Favored Pre-proline 0 C--N 1.316 -0.891 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.249 178.575 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.547 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 18.6 Cg_endo -58.91 -28.65 88.1 Favored 'Trans proline' 0 C--O 1.238 0.514 0 C-N-CA 122.79 2.327 . . . . 0.0 112.018 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -77.91 -14.77 59.44 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.506 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -68.32 -42.35 79.5 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.653 0.74 . . . . 0.0 109.56 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.449 ' H ' HD12 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -91.05 -1.8 57.74 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.146 -179.472 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 56.94 34.75 25.37 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.277 179.384 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.547 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 4.7 ptm -68.92 159.8 31.99 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.012 0.434 . . . . 0.0 110.851 -178.357 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -115.98 166.53 11.89 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.173 -176.621 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.499 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 9.7 p-10 -61.1 141.37 57.47 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.39 0.614 . . . . 0.0 111.775 177.014 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 81.83 17.06 0.43 Allowed 'General case' 0 C--O 1.236 0.355 0 C-N-CA 125.419 1.487 . . . . 0.0 110.877 -179.267 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.41 ' OD1' HD12 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -61.52 148.73 41.12 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.523 178.496 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 29.4 m -111.07 110.52 21.1 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 121.419 0.628 . . . . 0.0 112.252 176.354 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.475 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 28.1 mm -79.45 139.37 18.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.523 177.824 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -98.12 113.86 25.88 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.915 0.388 . . . . 0.0 110.541 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.458 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 82.0 t -111.55 134.72 53.03 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 CA-C-O 121.292 0.568 . . . . 0.0 111.019 178.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -131.27 166.78 20.43 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.546 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 5.0 tp60 -95.1 133.02 39.37 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.597 0.713 . . . . 0.0 111.93 -174.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 . . . . . 0 C--N 1.318 -0.78 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.717 177.124 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.51 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 11.4 p-80 . . . . . 0 N--CA 1.448 -0.567 0 CA-C-O 121.114 0.483 . . . . 0.0 110.682 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.447 HG13 HD21 ' A' ' 20' ' ' LEU . 29.2 pt -127.53 170.91 16.62 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.122 0 CA-C-O 121.295 0.569 . . . . 0.0 110.725 -178.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.452 ' HA ' ' O ' ' A' ' 32' ' ' PHE . 6.7 t30 -107.28 122.5 46.67 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.838 179.47 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.447 HD21 HG13 ' A' ' 18' ' ' ILE . 2.8 mm? -113.16 139.58 48.64 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 178.558 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -125.01 141.29 52.22 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 -178.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.73 HG22 HG13 ' A' ' 84' ' ' ILE . 85.6 t -120.7 130.31 74.69 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.697 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.121 -177.118 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -116.37 123.81 48.53 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-O 121.293 0.568 . . . . 0.0 110.295 -179.464 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.505 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -96.13 158.72 21.84 Favored Glycine 0 N--CA 1.426 -2.001 0 C-N-CA 120.238 -0.982 . . . . 0.0 110.98 178.8 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.57 -16.42 0.92 Allowed 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 178.688 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -76.14 -22.13 55.8 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.387 0.613 . . . . 0.0 110.854 178.673 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 99.33 9.93 49.54 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 -177.423 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.4 t -96.45 125.05 40.67 Favored 'General case' 0 N--CA 1.44 -0.94 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.555 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 16.3 t -118.08 141.16 38.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 121.062 0.458 . . . . 0.0 110.953 -179.008 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.599 HG11 ' HD3' ' A' ' 50' ' ' ARG . 16.2 t -124.56 138.7 53.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 178.163 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -107.89 142.41 38.01 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.748 0.308 . . . . 0.0 110.591 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.504 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 15.9 m-85 . . . . . 0 C--N 1.329 -0.324 0 CA-C-O 120.99 0.424 . . . . 0.0 110.687 -178.239 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.493 HD13 HD23 ' A' ' 43' ' ' LEU . 22.3 pt . . . . . 0 CA--C 1.516 -0.356 0 CA-C-O 120.751 0.31 . . . . 0.0 110.48 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.51 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 86.3 mttt -77.28 150.36 35.3 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 178.783 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.4 ptt180 -69.37 -18.47 63.78 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.302 0.573 . . . . 0.0 111.092 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 49.3 t-80 -103.33 -1.14 29.2 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 122.329 1.061 . . . . 0.0 108.867 -176.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.434 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.7 m -91.17 138.21 25.94 Favored Pre-proline 0 C--N 1.304 -1.381 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.46 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -58.0 120.06 7.71 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.676 2.251 . . . . 0.0 112.085 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.601 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.3 pt? -66.93 -15.95 64.02 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.21 0.529 . . . . 0.0 111.364 -179.022 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.533 ' HB2' ' O ' ' A' ' 69' ' ' GLU . 44.4 t -49.71 -32.87 14.41 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.219 177.5 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 39.2 mtmt -60.57 -47.48 86.02 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 120.978 0.418 . . . . 0.0 110.305 179.436 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.2 pp -72.67 -35.75 67.77 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.468 -179.456 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 63.3 mtm -62.61 -48.0 81.29 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 120.997 0.427 . . . . 0.0 110.831 179.343 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.441 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 47.9 mttp -66.72 -35.57 80.42 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.144 0.497 . . . . 0.0 110.344 177.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.83 -35.31 80.19 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.297 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -63.5 -54.38 37.18 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.788 178.797 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 22.5 p -64.01 -36.4 83.86 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 120.726 0.298 . . . . 0.0 111.314 -176.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 44.3 mt-10 -66.6 -42.05 87.51 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.749 0.309 . . . . 0.0 111.673 -179.172 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.599 ' HD3' HG11 ' A' ' 30' ' ' VAL . 9.9 ptm180 -79.21 -27.03 42.52 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.251 0.548 . . . . 0.0 110.77 -178.963 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 23.4 mm-40 -84.03 -20.64 32.39 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 94.29 7.04 61.01 Favored Glycine 0 N--CA 1.444 -0.803 0 C-N-CA 120.339 -0.934 . . . . 0.0 112.817 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -98.13 174.27 6.61 Favored 'General case' 0 C--N 1.321 -0.672 0 O-C-N 122.071 -0.664 . . . . 0.0 111.199 -179.281 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.403 ' HB2' ' OE1' ' A' ' 57' ' ' GLN . 16.8 m -125.1 158.84 32.86 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.617 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.0 mmt -62.87 -27.21 69.19 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.134 0.492 . . . . 0.0 111.954 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.501 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.18 -14.38 47.08 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.482 0.658 . . . . 0.0 110.527 177.485 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.403 ' OE1' ' HB2' ' A' ' 54' ' ' SER . 1.2 mp0 -92.1 -25.87 18.55 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.779 -178.889 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.409 HG22 ' NE2' ' A' ' 88' ' ' GLN . 12.8 pt -136.42 178.93 4.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.181 0.515 . . . . 0.0 111.442 -178.799 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.445 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 7.8 mmt180 -154.74 140.9 18.49 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.708 177.418 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -97.91 142.35 29.76 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.639 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.01 137.98 28.06 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-O 121.119 0.485 . . . . 0.0 111.029 -176.946 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.437 ' HB2' HD11 ' A' ' 67' ' ' ILE . 85.5 t80 -143.64 147.48 34.39 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.9 t70 59.43 21.2 9.58 Favored 'General case' 0 N--CA 1.482 1.16 0 CA-C-O 122.181 0.991 . . . . 0.0 109.701 -178.069 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.15 -20.36 21.65 Favored Glycine 0 N--CA 1.42 -2.394 0 CA-C-N 115.532 -0.758 . . . . 0.0 112.299 -178.56 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -95.6 149.53 36.21 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-O 121.124 0.488 . . . . 0.0 111.336 -177.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_exo -66.57 138.08 48.58 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.787 2.325 . . . . 0.0 111.823 177.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.545 HG21 HD11 ' A' ' 40' ' ' LEU . 53.2 mt -89.04 150.57 3.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 110.17 -0.307 . . . . 0.0 110.17 179.09 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -120.2 152.99 36.91 Favored 'General case' 0 CA--C 1.502 -0.897 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 177.865 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.533 ' O ' ' HB2' ' A' ' 41' ' ' SER . 7.3 pt-20 -72.59 -18.07 61.64 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-O 121.296 0.57 . . . . 0.0 111.569 -177.655 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.9 t -92.98 7.7 42.96 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-O 120.934 0.397 . . . . 0.0 111.383 -178.289 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -101.05 171.77 7.42 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.204 0.526 . . . . 0.0 111.335 -179.678 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.404 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.6 OUTLIER -124.29 149.8 62.08 Favored Pre-proline 0 C--N 1.319 -0.758 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.877 177.901 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.6 -31.39 92.17 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.056 2.504 . . . . 0.0 112.684 -178.338 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.63 -18.9 63.63 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.938 0.399 . . . . 0.0 111.346 -179.614 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLN . . . . . 0.404 ' HB2' ' O ' ' A' ' 72' ' ' THR . 26.4 mm-40 -70.67 -37.85 73.69 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.212 0.529 . . . . 0.0 110.685 178.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.467 ' H ' HD12 ' A' ' 76' ' ' LEU . 0.9 OUTLIER -90.52 5.9 45.82 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 179.433 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 45.43 33.68 1.37 Allowed 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.004 1.322 . . . . 0.0 112.213 -179.013 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.1 ptm -69.6 160.89 30.71 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.366 -179.025 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -119.76 166.96 12.56 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.258 -176.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.451 ' O ' ' HB2' ' A' ' 81' ' ' GLU . 5.9 p-10 -59.84 145.61 44.96 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.119 0.485 . . . . 0.0 111.579 177.667 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.451 ' HB2' ' O ' ' A' ' 80' ' ' ASP . 3.4 mm-40 79.8 16.3 0.82 Allowed 'General case' 0 C--O 1.233 0.213 0 C-N-CA 124.862 1.265 . . . . 0.0 110.936 -178.845 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.414 ' OD2' HD12 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -63.84 147.97 50.52 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.161 177.956 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 11.7 m -110.87 110.33 20.88 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.43 0.633 . . . . 0.0 111.748 176.335 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.73 HG13 HG22 ' A' ' 22' ' ' VAL . 13.2 mm -80.02 139.67 17.89 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.216 178.96 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -96.79 113.07 24.59 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.887 0.375 . . . . 0.0 110.582 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.505 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 43.9 t -111.02 134.82 52.09 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 CA-C-O 121.55 0.69 . . . . 0.0 110.808 177.663 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.6 p90 -134.2 153.89 51.57 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.81 -178.329 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.409 ' NE2' HG22 ' A' ' 58' ' ' ILE . 4.9 tp60 -78.49 114.12 17.11 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.044 0.45 . . . . 0.0 110.824 -177.594 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 . . . . . 0 C--N 1.32 -0.682 0 CA-C-O 121.479 0.657 . . . . 0.0 110.061 178.427 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 30.5 p-80 . . . . . 0 N--CA 1.451 -0.397 0 CA-C-O 121.567 0.698 . . . . 0.0 112.613 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 35.0 pt -133.19 170.74 19.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.94 179.344 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.483 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 11.2 m120 -97.29 138.57 34.55 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 178.091 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.495 HD23 HG12 ' A' ' 34' ' ' ILE . 3.2 mm? -130.14 138.26 50.56 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 174.846 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -126.25 142.4 51.54 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-O 121.175 0.512 . . . . 0.0 110.334 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.691 HG22 HG13 ' A' ' 84' ' ' ILE . 90.4 t -124.02 133.91 67.99 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.147 -177.388 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -111.46 129.13 56.13 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 121.211 0.529 . . . . 0.0 110.945 -177.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -100.47 167.28 20.05 Favored Glycine 0 N--CA 1.435 -1.397 0 C-N-CA 121.238 -0.505 . . . . 0.0 111.874 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.461 ' CD ' ' H ' ' A' ' 25' ' ' GLN . 0.1 OUTLIER -65.64 -30.19 70.86 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.44 0.638 . . . . 0.0 110.487 -177.075 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -73.67 -12.78 60.84 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.1 -178.518 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 102.3 0.61 50.69 Favored Glycine 0 C--O 1.227 -0.327 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.167 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.9 t -82.52 149.08 27.73 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 120.895 0.379 . . . . 0.0 110.202 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.554 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 47.5 t -142.7 135.28 26.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 -177.896 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.471 HG11 ' HD3' ' A' ' 50' ' ' ARG . 13.8 t -120.79 136.24 58.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.466 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -104.36 140.34 38.03 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.75 0.309 . . . . 0.0 110.266 178.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.404 ' O ' ' HA ' ' A' ' 19' ' ' ASN . 19.8 m-85 . . . . . 0 C--N 1.324 -0.506 0 CA-C-O 121.016 0.436 . . . . 0.0 111.215 -178.406 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.539 HD13 HD23 ' A' ' 43' ' ' LEU . 20.9 pt . . . . . 0 N--CA 1.467 0.412 0 CA-C-O 120.945 0.402 . . . . 0.0 111.013 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 23.8 mtpp -77.7 146.23 36.11 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.995 0.426 . . . . 0.0 110.632 178.692 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.414 ' HA ' ' HG2' ' A' ' 73' ' ' PRO . 1.4 ppt_? -71.8 -13.71 61.77 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.314 0.578 . . . . 0.0 111.025 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 32.0 t60 -98.91 -5.38 30.87 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.42 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.487 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.8 m -91.66 136.17 26.86 Favored Pre-proline 0 C--N 1.305 -1.341 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.321 -178.42 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.402 ' HB2' ' OG ' ' A' ' 41' ' ' SER . 19.4 Cg_endo -60.91 126.19 19.03 Favored 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 122.473 2.115 . . . . 0.0 111.83 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.569 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.2 pp -64.78 -16.55 63.19 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.777 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.54 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 4.0 p -51.8 -31.96 29.35 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 122.873 0.469 . . . . 0.0 111.679 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -61.67 -49.13 77.75 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.01 0.433 . . . . 0.0 110.342 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.6 pp -67.48 -35.08 78.46 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 121.053 0.454 . . . . 0.0 110.142 179.357 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 48.3 mtm -63.55 -49.3 73.98 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 121.087 0.47 . . . . 0.0 110.896 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.41 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 16.5 mtpp -67.54 -36.94 81.96 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.269 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.418 ' O ' ' HG2' ' A' ' 50' ' ' ARG . . . -62.03 -38.8 90.06 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.128 0.489 . . . . 0.0 109.851 178.356 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -58.74 -53.71 55.33 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.108 177.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 29.6 p -65.99 -36.51 83.48 Favored 'General case' 0 N--CA 1.453 -0.285 0 O-C-N 121.981 -0.449 . . . . 0.0 111.184 -177.193 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 45.2 mt-10 -66.11 -40.2 90.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.797 0.332 . . . . 0.0 111.547 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.471 ' HD3' HG11 ' A' ' 30' ' ' VAL . 13.9 ptm180 -80.29 -30.5 38.26 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.052 0.453 . . . . 0.0 111.117 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -83.97 -16.13 45.23 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -178.135 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 92.61 6.77 63.76 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 119.955 -1.117 . . . . 0.0 112.954 179.065 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -98.94 175.22 6.01 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.444 0.64 . . . . 0.0 111.197 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.432 ' HB2' ' OE1' ' A' ' 57' ' ' GLN . 68.7 m -126.06 159.89 31.58 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.652 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.6 mmt -66.43 -25.16 66.62 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.3 0.572 . . . . 0.0 111.428 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.46 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.32 -18.34 34.14 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.677 0.751 . . . . 0.0 110.285 176.448 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.432 ' OE1' ' HB2' ' A' ' 54' ' ' SER . 1.3 mp0 -89.2 -28.15 20.17 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.812 -179.399 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 11.2 pt -136.46 177.29 6.44 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 CA-C-O 121.354 0.597 . . . . 0.0 112.007 -177.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.463 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 15.9 mmt180 -151.9 143.43 23.5 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.65 178.812 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -99.01 144.73 27.82 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.71 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.612 ' HG2' ' N ' ' A' ' 62' ' ' PHE . 0.8 OUTLIER -142.14 151.0 41.84 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-O 121.224 0.535 . . . . 0.0 111.211 -177.521 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.612 ' N ' ' HG2' ' A' ' 61' ' ' ARG . 66.7 t80 -155.77 146.81 22.38 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 177.899 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 22.5 t70 56.72 23.88 8.39 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-O 121.795 0.807 . . . . 0.0 110.251 -177.115 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.38 -16.41 29.75 Favored Glycine 0 N--CA 1.431 -1.638 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.945 -178.582 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -97.99 147.41 33.03 Favored Pre-proline 0 C--N 1.326 -0.44 0 O-C-N 122.414 -0.462 . . . . 0.0 110.716 -179.44 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.97 138.77 34.65 Favored 'Trans proline' 0 CA--C 1.533 0.465 0 C-N-CA 122.544 2.163 . . . . 0.0 112.091 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.455 HD11 ' HB2' ' A' ' 62' ' ' PHE . 31.6 mt -88.14 151.96 3.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 120.889 0.376 . . . . 0.0 110.285 -178.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -128.79 172.08 11.62 Favored 'General case' 0 CA--C 1.499 -1.003 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.54 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 7.1 pt-20 -78.77 -8.43 58.75 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 121.508 0.671 . . . . 0.0 110.064 177.197 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 23.5 p -93.29 -1.77 55.68 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.158 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -104.0 144.03 32.08 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.299 0.571 . . . . 0.0 112.277 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.533 ' OG1' ' HG2' ' A' ' 75' ' ' GLN . 0.6 OUTLIER -111.65 157.95 37.87 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.981 176.612 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.53 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 17.9 Cg_endo -58.59 -28.62 86.52 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.755 2.303 . . . . 0.0 112.16 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -78.87 -10.74 59.9 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.907 -178.244 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLN . . . . . 0.533 ' HG2' ' OG1' ' A' ' 72' ' ' THR . 23.5 mm-40 -79.26 -38.88 34.42 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.1 0.476 . . . . 0.0 111.683 -178.729 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.563 ' H ' HD12 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -93.59 1.01 56.81 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 179.621 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 54.01 48.64 20.66 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.815 0.817 . . . . 0.0 110.705 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.53 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.4 ptm -82.42 152.96 25.93 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.283 -179.325 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.532 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 13.3 pt-20 -99.34 163.97 12.31 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.142 -177.274 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.483 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 7.3 p-10 -57.37 143.93 38.11 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 121.36 0.6 . . . . 0.0 110.737 173.481 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 68.07 20.98 8.9 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.821 -179.233 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.532 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 0.5 OUTLIER -69.56 155.39 40.56 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 120.414 -0.514 . . . . 0.0 109.976 179.218 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 24.4 m -102.1 119.93 39.61 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 -174.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.691 HG13 HG22 ' A' ' 22' ' ' VAL . 19.8 mm -90.5 136.53 23.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.292 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -100.67 118.59 37.11 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.064 0.459 . . . . 0.0 110.676 178.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.463 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 76.1 t -111.14 140.39 30.64 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.518 0 CA-C-O 121.051 0.453 . . . . 0.0 110.0 177.946 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.3 p90 -136.31 153.66 51.09 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 38.4 tp60 -83.46 117.48 23.1 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 121.144 0.497 . . . . 0.0 110.714 -176.576 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.482 ' HA ' ' OE1' ' A' ' 89' ' ' GLN . 11.6 mm-40 . . . . . 0 C--N 1.316 -0.852 0 CA-C-O 121.437 0.637 . . . . 0.0 111.293 178.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 22.0 p-80 . . . . . 0 N--CA 1.455 -0.213 0 CA-C-O 121.081 0.467 . . . . 0.0 111.233 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.412 HG13 HD21 ' A' ' 20' ' ' LEU . 42.8 pt -136.87 170.65 17.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.443 -179.571 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.405 ' C ' HD22 ' A' ' 20' ' ' LEU . 23.2 t-20 -105.51 134.2 49.01 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.179 179.065 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.61 HD23 HG12 ' A' ' 34' ' ' ILE . 2.7 mm? -126.41 145.07 50.62 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 177.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -129.86 144.24 51.21 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-O 121.297 0.57 . . . . 0.0 110.402 -178.762 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.64 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 4.7 p -125.01 132.25 71.54 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.874 -176.623 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -122.33 138.74 54.41 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.18 0.514 . . . . 0.0 110.662 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -112.98 160.4 13.14 Favored Glycine 0 N--CA 1.437 -1.275 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -62.71 -19.13 63.6 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.677 0.751 . . . . 0.0 110.02 -179.008 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -81.27 11.01 4.66 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.871 -177.748 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 71.45 39.52 61.25 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 119.893 -1.146 . . . . 0.0 113.186 179.05 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.5 t -132.06 147.37 52.44 Favored 'General case' 0 C--N 1.31 -1.114 0 O-C-N 122.038 -0.683 . . . . 0.0 110.287 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.64 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.5 p -146.72 137.16 17.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.124 0.488 . . . . 0.0 111.523 -178.327 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 t -123.85 138.05 54.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 178.654 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -107.8 140.73 40.45 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.819 0.342 . . . . 0.0 110.939 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.528 ' HE1' HG12 ' A' ' 22' ' ' VAL . 19.4 m-85 . . . . . 0 N--CA 1.468 0.466 0 CA-C-O 121.125 0.488 . . . . 0.0 111.31 -177.676 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.61 HG12 HD23 ' A' ' 20' ' ' LEU . 21.2 pt . . . . . 0 C--O 1.217 -0.646 0 CA-C-O 120.815 0.341 . . . . 0.0 110.309 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 1.7 mtpm? -94.82 151.11 19.51 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-O 120.903 0.383 . . . . 0.0 110.269 -178.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.9 ptt180 -67.08 -23.95 65.91 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.043 0.449 . . . . 0.0 111.762 -177.569 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -103.13 3.15 35.54 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 122.341 1.067 . . . . 0.0 109.044 -176.765 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.478 ' OG1' ' HD3' ' A' ' 35' ' ' LYS . 1.8 m -95.87 138.26 21.73 Favored Pre-proline 0 N--CA 1.428 -1.57 0 CA-C-N 114.523 -1.217 . . . . 0.0 110.186 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.428 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 27.3 Cg_endo -58.46 122.37 11.56 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.777 2.318 . . . . 0.0 112.149 -178.81 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.533 HD11 HG21 ' A' ' 67' ' ' ILE . 1.0 OUTLIER -70.37 -16.17 62.94 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.328 0.585 . . . . 0.0 111.242 -179.318 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.485 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 4.2 p -50.68 -29.75 11.95 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.554 178.286 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.428 ' HE3' ' HG2' ' A' ' 39' ' ' PRO . 96.4 mttt -60.49 -47.93 83.99 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.21 0.528 . . . . 0.0 110.016 177.544 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.0 OUTLIER -69.6 -37.74 77.01 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.019 179.089 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 57.4 mtm -61.95 -46.78 87.81 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 120.941 0.401 . . . . 0.0 111.287 -179.205 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.407 ' HE2' ' HB3' ' A' ' 45' ' ' LYS . 30.7 mtpt -67.3 -38.1 84.43 Favored 'General case' 0 CA--C 1.511 -0.529 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.578 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.39 -34.66 77.16 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.174 0.512 . . . . 0.0 109.947 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -62.5 -56.54 17.13 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.771 177.652 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 25.8 p -65.42 -37.07 85.82 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 122.091 -0.38 . . . . 0.0 111.512 -176.641 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -70.72 -29.78 66.15 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -178.481 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 50' ' ' ARG . 10.2 ptm85 -89.77 -30.88 17.7 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 121.961 -0.462 . . . . 0.0 111.13 178.745 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -80.61 -22.53 40.53 Favored 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -178.348 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.68 40.07 6.07 Favored Glycine 0 N--CA 1.434 -1.483 0 C-N-CA 120.012 -1.089 . . . . 0.0 110.949 -177.603 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.417 HD13 ' HA ' ' A' ' 53' ' ' LEU . 3.5 mm? -126.21 166.27 17.39 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 178.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 72.0 m -119.54 153.31 35.58 Favored 'General case' 0 C--N 1.309 -1.169 0 O-C-N 122.188 -0.32 . . . . 0.0 110.66 178.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.3 mmt -61.52 -25.67 67.43 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.149 0.499 . . . . 0.0 112.08 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.2 -13.46 49.9 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.563 0.697 . . . . 0.0 110.409 176.698 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -94.3 -28.27 15.67 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.648 -0.706 . . . . 0.0 112.188 -177.911 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.0 pt -133.35 175.29 11.69 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 CA-C-O 121.206 0.527 . . . . 0.0 111.149 -177.699 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.425 ' HD3' ' HA ' ' A' ' 59' ' ' ARG . 14.9 mmt180 -149.95 144.32 25.79 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.803 178.319 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -102.37 141.54 35.04 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.009 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.461 ' HG2' ' O ' ' A' ' 65' ' ' GLN . 8.3 tmm_? -142.92 141.63 31.53 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.362 0.601 . . . . 0.0 111.381 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.472 ' HB2' HD11 ' A' ' 67' ' ' ILE . 85.9 t80 -144.56 147.49 33.25 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.492 178.849 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.5 t70 58.06 24.45 11.19 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-O 121.728 0.775 . . . . 0.0 110.34 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.401 ' HA2' ' HD3' ' A' ' 61' ' ' ARG . . . 76.55 6.66 84.78 Favored Glycine 0 N--CA 1.433 -1.514 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.93 -179.525 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.461 ' O ' ' HG2' ' A' ' 61' ' ' ARG . 3.8 pt20 -122.01 147.05 47.93 Favored Pre-proline 0 CA--C 1.536 0.425 0 O-C-N 122.224 -0.574 . . . . 0.0 110.48 179.128 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -66.69 138.44 49.26 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 122.492 2.128 . . . . 0.0 112.223 -178.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.533 HG21 HD11 ' A' ' 40' ' ' LEU . 45.2 mt -91.54 146.47 6.22 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-O 120.952 0.406 . . . . 0.0 110.099 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -114.42 165.9 12.25 Favored 'General case' 0 CA--C 1.492 -1.282 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.634 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.518 ' H ' ' CD ' ' A' ' 69' ' ' GLU . 0.4 OUTLIER -77.95 -19.81 53.89 Favored 'General case' 0 C--N 1.291 -1.97 0 CA-C-O 121.44 0.638 . . . . 0.0 109.693 178.659 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 36.2 p -92.38 4.04 54.22 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.893 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -98.96 159.82 14.69 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 121.899 -0.5 . . . . 0.0 110.568 -178.656 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -118.39 154.2 52.05 Favored Pre-proline 0 C--N 1.316 -0.864 0 O-C-N 122.24 -0.287 . . . . 0.0 111.664 177.533 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.17 -30.96 92.49 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.94 2.427 . . . . 0.0 112.276 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.17 -19.68 62.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.145 0.497 . . . . 0.0 111.129 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -67.84 -37.57 82.05 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.645 0.736 . . . . 0.0 110.152 -179.149 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.401 ' H ' HD12 ' A' ' 76' ' ' LEU . 0.5 OUTLIER -93.54 5.19 52.43 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.945 -178.725 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 43.31 40.97 2.81 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.615 1.166 . . . . 0.0 111.94 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 4.3 ptm -74.27 161.89 29.46 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.723 -178.576 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -110.2 164.14 12.93 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 116.325 -0.398 . . . . 0.0 109.964 -177.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -55.42 138.07 46.82 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.591 0.71 . . . . 0.0 111.999 176.516 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 77.95 24.92 0.68 Allowed 'General case' 0 CA--C 1.512 -0.518 0 C-N-CA 124.895 1.278 . . . . 0.0 111.835 177.684 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.469 ' OD1' HD12 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -61.62 154.07 26.1 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.303 176.523 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 30.8 m -110.44 108.89 19.06 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-O 121.411 0.624 . . . . 0.0 112.05 176.205 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.432 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 25.1 mm -80.49 137.8 20.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.175 177.612 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -101.35 124.33 46.86 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.144 0.497 . . . . 0.0 110.423 178.708 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.419 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 91.0 t -114.19 131.58 65.75 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.08 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.716 178.152 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.4 p90 -133.85 152.06 51.74 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 116.248 -0.433 . . . . 0.0 109.93 -175.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -76.91 112.12 13.18 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-O 121.358 0.599 . . . . 0.0 112.369 -176.414 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 78.2 mm-40 . . . . . 0 C--N 1.317 -0.811 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.572 177.142 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.575 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 55.4 p-80 . . . . . 0 N--CA 1.436 -1.127 0 CA-C-O 121.459 0.647 . . . . 0.0 111.485 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 39.7 pt -127.12 167.65 21.57 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.206 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.33 -178.23 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.504 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 23.7 t-20 -100.62 137.86 38.44 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.381 178.434 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.406 HD23 HG12 ' A' ' 34' ' ' ILE . 3.0 mm? -127.85 135.9 50.68 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 176.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -119.65 145.02 46.84 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-O 121.301 0.572 . . . . 0.0 110.12 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.635 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 6.7 p -123.66 134.35 66.66 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.937 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.955 -178.435 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -117.93 117.99 30.77 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-O 121.241 0.543 . . . . 0.0 110.081 -178.63 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.403 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -84.12 155.14 31.11 Favored Glycine 0 N--CA 1.426 -2.012 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.092 -179.45 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -15.31 9.31 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 178.014 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -93.48 -11.19 32.6 Favored 'General case' 0 C--N 1.319 -0.718 0 O-C-N 122.015 -0.428 . . . . 0.0 110.828 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.99 7.58 35.53 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.648 -0.786 . . . . 0.0 112.737 178.077 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 74.5 m -91.36 124.94 35.93 Favored 'General case' 0 C--N 1.313 -0.988 0 O-C-N 122.363 -0.493 . . . . 0.0 111.118 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.635 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.2 p -119.91 132.31 69.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 CA-C-O 121.292 0.568 . . . . 0.0 111.605 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.5 t -119.19 135.26 60.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.044 179.233 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -104.89 142.18 35.22 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.707 0.289 . . . . 0.0 110.696 179.111 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.5 ' HE1' HG12 ' A' ' 22' ' ' VAL . 16.2 m-85 . . . . . 0 N--CA 1.47 0.546 0 CA-C-O 121.179 0.514 . . . . 0.0 111.149 -178.615 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.406 HG12 HD23 ' A' ' 20' ' ' LEU . 24.7 pt . . . . . 0 CA--C 1.515 -0.391 0 CA-C-O 120.916 0.389 . . . . 0.0 110.347 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.575 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 44.6 mtpt -86.58 152.96 22.16 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-O 121.134 0.492 . . . . 0.0 110.887 179.728 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 28.1 ptt180 -64.49 -24.06 67.49 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.172 -0.467 . . . . 0.0 112.0 -178.056 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 55.7 t60 -104.22 -2.26 25.94 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 122.086 0.946 . . . . 0.0 108.817 -176.666 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.475 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.5 m -87.15 137.87 32.76 Favored Pre-proline 0 N--CA 1.427 -1.587 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.355 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -58.92 122.7 12.05 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.672 2.248 . . . . 0.0 112.469 -178.653 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.461 HD12 ' N ' ' A' ' 41' ' ' SER . 1.2 pp -68.0 -16.47 64.06 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.427 179.225 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.5 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 10.1 p -52.14 -30.31 25.95 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.247 0.619 . . . . 0.0 111.899 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -64.24 -42.66 96.42 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.675 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.469 ' C ' HD12 ' A' ' 43' ' ' LEU . 1.0 OUTLIER -70.83 -35.91 72.67 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.05 0.453 . . . . 0.0 110.233 178.519 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 44.0 mtm -63.32 -49.28 74.59 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.015 0.436 . . . . 0.0 110.765 -178.535 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.422 ' HD2' ' HE2' ' A' ' 55' ' ' MET . 12.4 mmmm -66.55 -37.71 85.56 Favored 'General case' 0 N--CA 1.441 -0.878 0 O-C-N 122.267 -0.271 . . . . 0.0 110.48 177.178 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.34 -43.41 88.26 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.378 0.608 . . . . 0.0 110.04 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.406 ' CD1' HG11 ' A' ' 22' ' ' VAL . 63.1 t80 -56.38 -55.08 37.96 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.619 177.575 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.659 ' SG ' HD11 ' A' ' 58' ' ' ILE . 33.2 m -63.08 -42.71 99.69 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.926 0.393 . . . . 0.0 111.174 -177.772 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.45 -35.95 81.56 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -177.71 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -84.98 -34.2 22.43 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.92 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -83.17 -13.57 55.21 Favored 'General case' 0 C--N 1.334 -0.096 0 N-CA-C 113.083 0.772 . . . . 0.0 113.083 -178.588 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.42 6.49 73.95 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.152 -1.023 . . . . 0.0 113.203 178.703 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -92.18 169.94 10.21 Favored 'General case' 0 C--N 1.32 -0.675 0 O-C-N 121.975 -0.721 . . . . 0.0 110.925 178.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 71.6 m -120.77 154.38 35.75 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.319 179.234 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.422 ' HE2' ' HD2' ' A' ' 45' ' ' LYS . 12.5 mmt -62.01 -28.19 69.4 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-O 121.375 0.607 . . . . 0.0 111.592 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.552 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.08 -14.85 45.91 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.438 0.637 . . . . 0.0 110.818 178.397 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -90.18 -31.64 16.97 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.586 -179.582 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.659 HD11 ' SG ' ' A' ' 48' ' ' CYS . 12.0 pt -128.84 175.95 9.16 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.151 0 CA-C-O 121.296 0.569 . . . . 0.0 111.678 -177.755 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.455 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 25.0 mmt180 -148.51 138.77 22.53 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.341 179.378 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 41.8 m-85 -96.71 139.6 32.54 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.308 179.49 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.444 ' HD2' ' HB2' ' A' ' 85' ' ' ASP . 0.2 OUTLIER -141.62 137.71 32.05 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-O 121.04 0.448 . . . . 0.0 111.063 -176.755 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.556 ' HB2' HD11 ' A' ' 67' ' ' ILE . 67.2 t80 -143.33 145.15 32.45 Favored 'General case' 0 C--O 1.214 -0.801 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 177.915 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 23.7 t70 54.02 23.75 4.24 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 121.895 0.855 . . . . 0.0 110.871 -177.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.437 ' HA2' ' NE ' ' A' ' 61' ' ' ARG . . . 85.08 -18.03 29.49 Favored Glycine 0 N--CA 1.434 -1.469 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.997 -178.667 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -96.11 149.94 36.59 Favored Pre-proline 0 C--N 1.318 -0.765 0 O-C-N 122.532 -0.393 . . . . 0.0 111.071 -179.355 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.92 141.98 37.97 Favored 'Trans proline' 0 C--O 1.235 0.344 0 C-N-CA 122.53 2.153 . . . . 0.0 111.751 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.556 HD11 ' HB2' ' A' ' 62' ' ' PHE . 23.9 mt -94.53 148.15 5.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 120.979 0.419 . . . . 0.0 110.19 -179.726 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -129.24 166.72 18.86 Favored 'General case' 0 CA--C 1.498 -1.042 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.729 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.5 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 12.6 pt-20 -75.16 -12.48 60.31 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 121.341 0.591 . . . . 0.0 110.479 178.661 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.8 t -91.71 -1.33 57.45 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 121.221 0.534 . . . . 0.0 111.171 -178.43 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -103.93 147.12 27.72 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 120.9 0.381 . . . . 0.0 111.022 177.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.56 153.72 42.73 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.46 179.533 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -60.7 -31.27 91.81 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.701 2.268 . . . . 0.0 112.551 -177.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.83 -20.78 62.52 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.79 -179.018 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -67.21 -37.22 83.27 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.153 0.502 . . . . 0.0 111.127 -178.869 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.465 ' H ' HD12 ' A' ' 76' ' ' LEU . 0.6 OUTLIER -94.51 11.24 31.54 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.564 -178.023 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 43.73 36.97 1.41 Allowed 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 124.147 0.979 . . . . 0.0 112.202 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.8 ptm -73.53 158.47 34.8 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.901 -178.411 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -109.33 165.43 11.63 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 120.916 0.389 . . . . 0.0 110.534 -178.058 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.504 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 10.3 p-10 -61.55 142.73 56.9 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.339 0.59 . . . . 0.0 111.196 175.79 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 72.83 17.33 4.36 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 124.42 1.088 . . . . 0.0 111.721 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -75.48 161.54 29.11 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 176.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 6.7 m -109.95 131.86 54.68 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -174.577 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 45.9 mm -97.62 134.01 37.33 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 175.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.444 ' HB2' ' HD2' ' A' ' 61' ' ' ARG . 43.3 m-20 -97.39 124.65 41.64 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-O 121.07 0.462 . . . . 0.0 110.967 179.474 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.455 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 87.3 t -115.61 139.09 43.78 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 CA-C-O 120.99 0.424 . . . . 0.0 110.329 177.339 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 9.7 p90 -134.9 155.87 49.94 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -88.63 116.38 26.84 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.541 0.686 . . . . 0.0 111.48 -175.802 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 75.0 mm-40 . . . . . 0 C--N 1.315 -0.896 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.524 178.082 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 5.9 p-80 . . . . . 0 N--CA 1.453 -0.283 0 CA-C-O 121.403 0.62 . . . . 0.0 111.409 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 29.2 pt -128.96 171.12 17.36 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.128 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.028 178.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -107.27 133.91 51.13 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 178.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -124.35 135.35 53.26 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 177.106 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.46 ' HG2' ' HG3' ' A' ' 31' ' ' GLN . 49.8 mtmt -121.95 144.42 48.88 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 121.155 0.503 . . . . 0.0 110.099 -179.279 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.622 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 2.5 p -121.62 127.45 75.58 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.527 -177.872 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -117.44 126.69 53.05 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.294 0.568 . . . . 0.0 110.09 -178.617 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -104.13 152.95 17.71 Favored Glycine 0 N--CA 1.429 -1.812 0 C-N-CA 120.439 -0.886 . . . . 0.0 111.548 -179.303 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.05 -16.2 1.03 Allowed 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 177.465 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -70.26 -22.8 62.84 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.507 0.67 . . . . 0.0 110.51 177.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 102.56 9.66 40.29 Favored Glycine 0 N--CA 1.448 -0.501 0 N-CA-C 111.338 -0.705 . . . . 0.0 111.338 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 39.9 t -101.89 157.15 17.06 Favored 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 122.492 0.317 . . . . 0.0 110.224 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.622 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 3.7 p -149.51 140.59 16.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.0 0.428 . . . . 0.0 110.616 -179.197 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.9 t -125.18 139.71 50.37 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.039 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.46 ' HG3' ' HG2' ' A' ' 21' ' ' LYS . 0.3 OUTLIER -108.63 144.55 36.22 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.951 0.405 . . . . 0.0 111.049 -179.46 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.549 ' HE1' HG12 ' A' ' 22' ' ' VAL . 14.1 m-85 . . . . . 0 N--CA 1.469 0.496 0 CA-C-O 121.171 0.51 . . . . 0.0 111.142 -178.528 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 37.8 pt . . . . . 0 CA--C 1.517 -0.313 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 3.9 mppt? -77.99 151.88 33.38 Favored 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.187 177.381 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.1 ptt180 -68.06 -14.37 62.92 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 121.378 0.609 . . . . 0.0 110.9 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 76.4 t60 -107.34 -1.62 21.44 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 122.289 1.042 . . . . 0.0 108.645 -178.222 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.53 ' OG1' ' HE2' ' A' ' 35' ' ' LYS . 1.3 m -86.63 139.34 33.41 Favored Pre-proline 0 N--CA 1.432 -1.362 0 CA-C-N 114.548 -1.205 . . . . 0.0 109.73 178.702 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -59.99 119.31 6.44 Favored 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 122.356 2.038 . . . . 0.0 112.397 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.599 HD11 HG21 ' A' ' 67' ' ' ILE . 1.7 pt? -67.82 -16.74 64.25 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.515 0.674 . . . . 0.0 110.58 179.296 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 14.4 p -52.25 -28.83 20.22 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.223 177.422 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.2 mtpt -62.25 -46.96 86.47 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 121.101 0.477 . . . . 0.0 109.739 178.647 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.8 pp -72.88 -37.52 67.28 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 120.881 0.372 . . . . 0.0 110.265 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 62.7 mtm -61.49 -43.78 98.25 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 120.922 0.391 . . . . 0.0 111.363 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.523 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 43.3 mttp -69.53 -37.63 77.2 Favored 'General case' 0 CA--C 1.514 -0.422 0 O-C-N 122.071 -0.393 . . . . 0.0 110.751 177.607 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.93 -35.49 80.85 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.146 0.498 . . . . 0.0 109.824 -179.661 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.412 ' CZ ' ' HG3' ' A' ' 51' ' ' GLN . 69.3 t80 -61.73 -54.74 38.48 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.602 178.359 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.629 ' SG ' HD11 ' A' ' 58' ' ' ILE . 19.5 m -58.77 -39.18 80.26 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.054 0.454 . . . . 0.0 110.447 -179.115 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.523 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 67.2 mt-10 -62.09 -49.33 76.38 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.115 0.483 . . . . 0.0 111.729 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -74.89 -36.63 62.24 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.087 0.402 . . . . 0.0 112.087 -176.394 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.412 ' HG3' ' CZ ' ' A' ' 47' ' ' TYR . 26.7 mm-40 -78.09 -21.19 50.86 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -178.747 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.405 ' C ' HD22 ' A' ' 53' ' ' LEU . . . 86.46 41.65 6.83 Favored Glycine 0 N--CA 1.431 -1.686 0 C-N-CA 119.905 -1.14 . . . . 0.0 111.271 -178.433 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.405 HD22 ' C ' ' A' ' 52' ' ' GLY . 3.6 mm? -127.64 170.38 12.74 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.47 ' HB2' ' OE1' ' A' ' 57' ' ' GLN . 50.0 m -124.71 157.56 35.36 Favored 'General case' 0 C--N 1.311 -1.088 0 O-C-N 122.303 -0.248 . . . . 0.0 110.491 177.766 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 12.1 mmt -60.73 -28.91 69.04 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-O 121.327 0.584 . . . . 0.0 111.784 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.554 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.36 -16.07 41.12 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.401 0.62 . . . . 0.0 110.634 178.694 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.47 ' OE1' ' HB2' ' A' ' 54' ' ' SER . 1.3 mp0 -90.82 -25.13 20.07 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.782 -177.96 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.629 HD11 ' SG ' ' A' ' 48' ' ' CYS . 12.7 pt -135.27 177.94 6.02 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.069 0 CA-C-O 120.933 0.397 . . . . 0.0 110.761 -178.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.433 ' CG ' ' HG3' ' A' ' 89' ' ' GLN . 15.0 mmt180 -150.54 139.61 21.08 Favored 'General case' 0 CA--C 1.501 -0.924 0 CA-C-O 121.341 0.591 . . . . 0.0 111.081 178.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -97.91 141.23 31.14 Favored 'General case' 0 N--CA 1.438 -1.033 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.685 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.446 ' HG2' ' N ' ' A' ' 62' ' ' PHE . 8.4 tmm_? -143.48 145.58 32.71 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 121.247 0.546 . . . . 0.0 110.94 -179.696 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.525 ' HB2' HD11 ' A' ' 67' ' ' ILE . 86.1 t80 -151.13 148.74 28.65 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.657 179.029 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 19.5 t70 58.4 22.08 9.09 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.753 0.787 . . . . 0.0 110.123 -178.085 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.0 4.44 88.73 Favored Glycine 0 N--CA 1.43 -1.765 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.662 -178.457 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -121.39 143.58 37.98 Favored Pre-proline 0 N--CA 1.444 -0.738 0 O-C-N 122.071 -0.664 . . . . 0.0 110.11 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -61.71 141.1 89.56 Favored 'Trans proline' 0 C--N 1.329 -0.457 0 C-N-CA 122.848 2.366 . . . . 0.0 112.091 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.599 HG21 HD11 ' A' ' 40' ' ' LEU . 41.2 mt -96.78 146.84 6.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 120.859 0.362 . . . . 0.0 110.146 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -114.5 163.01 15.96 Favored 'General case' 0 CA--C 1.5 -0.959 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 176.625 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -79.04 -11.22 59.99 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 120.106 -0.638 . . . . 0.0 110.597 179.005 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 35.0 p -84.76 -11.99 54.64 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.72 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.56 165.74 16.82 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -178.557 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -121.54 153.37 59.25 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.217 173.433 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.417 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 12.2 Cg_endo -57.38 -30.2 87.03 Favored 'Trans proline' 0 C--O 1.236 0.424 0 C-N-CA 122.779 2.319 . . . . 0.0 112.137 -179.488 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.27 -20.73 62.19 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.163 0.506 . . . . 0.0 111.64 -179.052 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -69.16 -39.1 78.99 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.318 0.58 . . . . 0.0 110.863 179.184 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.457 ' H ' HD12 ' A' ' 76' ' ' LEU . 1.1 mp -86.92 2.86 47.89 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.143 -178.283 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 57.02 31.08 19.28 Favored 'General case' 0 C--N 1.349 0.567 0 CA-C-O 121.51 0.671 . . . . 0.0 111.193 178.523 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.546 ' HE1' HD11 ' A' ' 84' ' ' ILE . 6.8 ptm -79.06 164.73 24.09 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.769 -178.408 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -121.89 172.69 8.0 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.578 -176.277 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -63.06 145.31 55.73 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-O 121.528 0.68 . . . . 0.0 111.835 177.082 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 71.16 16.33 6.3 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 114.57 -1.196 . . . . 0.0 111.492 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.4 ' OD1' ' CE1' ' A' ' 62' ' ' PHE . 11.2 t70 -70.79 153.95 42.29 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.156 175.536 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 19.7 m -112.99 134.99 54.25 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-O 121.454 0.645 . . . . 0.0 112.367 -177.58 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.546 HD11 ' HE1' ' A' ' 78' ' ' MET . 39.2 mm -98.48 145.28 10.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 123.372 0.669 . . . . 0.0 110.089 -179.581 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -100.27 117.04 33.65 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 122.316 0.246 . . . . 0.0 110.852 179.289 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 86.4 t -115.37 136.02 53.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-O 121.298 0.57 . . . . 0.0 111.285 177.048 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -134.05 153.18 51.97 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.061 -178.78 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -79.47 115.33 19.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.312 0.577 . . . . 0.0 111.623 -178.273 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.433 ' HG3' ' CG ' ' A' ' 59' ' ' ARG . 51.8 mm-40 . . . . . 0 C--N 1.314 -0.967 0 CA-C-O 121.485 0.659 . . . . 0.0 110.716 177.144 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.403 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 33.2 p-80 . . . . . 0 N--CA 1.444 -0.726 0 CA-C-O 121.13 0.491 . . . . 0.0 111.54 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 31.0 pt -130.29 170.85 18.54 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.908 -177.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -105.21 136.23 45.09 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -128.21 136.6 51.31 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 121.01 0.433 . . . . 0.0 109.879 178.178 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.462 ' O ' ' HA ' ' A' ' 83' ' ' THR . 52.2 mtmt -120.29 146.46 46.07 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.016 0.436 . . . . 0.0 109.911 179.666 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.616 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 3.8 p -124.56 132.6 71.1 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.615 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.832 -178.28 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -119.26 127.67 53.46 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 121.234 0.54 . . . . 0.0 110.36 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -103.0 147.39 16.89 Favored Glycine 0 N--CA 1.433 -1.556 0 C-N-CA 121.019 -0.61 . . . . 0.0 111.943 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.521 ' HG3' ' HA ' ' A' ' 87' ' ' PHE . 0.0 OUTLIER -51.93 -24.49 6.49 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 177.89 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -75.04 -18.17 60.37 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.218 0.532 . . . . 0.0 110.734 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 106.01 27.4 5.67 Favored Glycine 0 CA--C 1.499 -0.965 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.088 175.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.569 ' HB3' ' NE2' ' A' ' 51' ' ' GLN . 71.0 m -111.29 147.63 34.67 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 120.656 0.265 . . . . 0.0 110.491 179.389 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.616 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.4 p -145.81 132.33 14.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.188 0.518 . . . . 0.0 111.667 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 t -124.15 139.66 49.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -108.03 142.4 38.26 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.816 0.341 . . . . 0.0 110.771 179.741 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.513 ' HE1' HG12 ' A' ' 22' ' ' VAL . 20.8 m-85 . . . . . 0 N--CA 1.468 0.449 0 CA-C-O 121.37 0.605 . . . . 0.0 111.797 -177.566 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.403 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 29.1 pt . . . . . 0 CA--C 1.517 -0.325 0 CA-C-O 121.014 0.435 . . . . 0.0 111.063 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.403 ' HB2' ' HB ' ' A' ' 38' ' ' THR . 36.0 mtmm -74.72 147.15 41.64 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 178.766 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.9 ptt180 -71.24 -13.16 61.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.682 0.753 . . . . 0.0 110.243 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 -100.52 -5.64 26.64 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -178.074 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.403 ' HB ' ' HB2' ' A' ' 35' ' ' LYS . 1.0 OUTLIER -94.8 141.89 23.95 Favored Pre-proline 0 N--CA 1.445 -0.719 0 CA-C-N 114.763 -1.108 . . . . 0.0 109.73 179.758 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -63.09 128.92 24.14 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.257 1.971 . . . . 0.0 112.375 -179.2 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.533 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.1 pt? -69.26 -17.29 63.74 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.692 0.758 . . . . 0.0 110.446 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.416 ' N ' HD23 ' A' ' 40' ' ' LEU . 0.9 OUTLIER -51.73 -28.96 16.72 Favored 'General case' 0 C--N 1.31 -1.111 0 C-N-CA 124.43 1.092 . . . . 0.0 111.204 178.57 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 51.5 mtpt -63.38 -43.14 98.47 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.897 179.372 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.3 pp -73.04 -38.64 66.43 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 120.938 0.399 . . . . 0.0 109.985 178.629 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 59.7 mtm -60.74 -49.41 77.59 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 121.049 0.452 . . . . 0.0 111.108 -179.425 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.439 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 47.7 mtpt -68.67 -35.36 77.12 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.821 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.488 ' O ' ' HG2' ' A' ' 50' ' ' ARG . . . -63.86 -38.03 89.58 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.055 0.455 . . . . 0.0 110.004 178.346 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -57.02 -56.34 22.98 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.849 178.618 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.49 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 26.1 p -63.46 -37.62 87.99 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.869 0.366 . . . . 0.0 111.45 -177.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.439 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 44.8 mt-10 -67.61 -36.45 80.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.788 0.328 . . . . 0.0 111.732 -179.416 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.488 ' HG2' ' O ' ' A' ' 46' ' ' ALA . 14.2 ptm180 -85.23 -37.39 20.14 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 121.96 -0.462 . . . . 0.0 111.695 -179.382 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.569 ' NE2' ' HB3' ' A' ' 28' ' ' SER . 13.1 mm100 -77.67 -21.88 51.44 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -176.599 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 92.45 37.14 5.96 Favored Glycine 0 N--CA 1.439 -1.165 0 C-N-CA 120.281 -0.962 . . . . 0.0 111.173 -178.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.49 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 4.0 mm? -122.25 162.99 20.42 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -179.641 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.428 ' HB2' ' HB2' ' A' ' 57' ' ' GLN . 16.6 m -116.72 152.83 33.49 Favored 'General case' 0 C--N 1.312 -1.036 0 O-C-N 122.017 -0.427 . . . . 0.0 110.556 178.912 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 11.9 mmt -63.73 -25.9 68.41 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.542 0.687 . . . . 0.0 111.283 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.613 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.56 -16.79 38.25 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.325 0.583 . . . . 0.0 110.735 177.133 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.451 ' OE1' ' HG2' ' A' ' 56' ' ' ARG . 1.6 mp0 -93.31 -27.04 17.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.8 -179.357 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.6 pt -129.86 -179.12 2.92 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-O 121.062 0.458 . . . . 0.0 111.266 -179.49 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.452 ' HA ' ' HD3' ' A' ' 59' ' ' ARG . 8.3 mmt180 -158.17 143.29 16.57 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.851 177.609 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -100.74 145.55 28.35 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.621 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.2 ttt180 -142.48 148.08 37.11 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 120.884 0.373 . . . . 0.0 110.547 -178.026 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.524 ' HB2' HD11 ' A' ' 67' ' ' ILE . 73.8 t80 -152.72 143.69 23.01 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 178.292 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.0 t70 54.92 23.91 5.42 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.509 0.724 . . . . 0.0 111.244 -178.162 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.92 -23.34 20.91 Favored Glycine 0 N--CA 1.435 -1.427 0 C-N-CA 120.906 -0.664 . . . . 0.0 112.679 -178.643 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -94.18 150.4 38.3 Favored Pre-proline 0 C--N 1.315 -0.912 0 O-C-N 122.516 -0.402 . . . . 0.0 110.954 -178.734 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -72.47 143.32 38.36 Favored 'Trans proline' 0 N--CA 1.462 -0.326 0 C-N-CA 122.434 2.089 . . . . 0.0 111.575 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.524 HD11 ' HB2' ' A' ' 62' ' ' PHE . 38.4 mt -93.31 143.08 12.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-O 120.977 0.417 . . . . 0.0 110.296 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -114.07 157.5 22.47 Favored 'General case' 0 CA--C 1.499 -0.985 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 178.037 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -74.11 -12.04 60.48 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-O 121.24 0.543 . . . . 0.0 110.445 178.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.6 p -95.11 6.28 49.5 Favored 'General case' 0 N--CA 1.438 -1.033 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 178.206 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -100.13 162.12 13.17 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.974 0.416 . . . . 0.0 111.238 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -116.18 155.34 48.31 Favored Pre-proline 0 C--N 1.318 -0.765 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.149 176.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -61.12 -34.6 89.27 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.715 2.277 . . . . 0.0 111.779 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.72 -10.94 60.0 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.288 -179.219 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -77.05 -40.74 45.19 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 121.351 0.596 . . . . 0.0 109.758 179.607 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.47 12.22 8.9 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.197 -179.604 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 43.61 43.69 4.86 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.293 1.037 . . . . 0.0 112.134 178.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.2 ptm -86.81 164.89 16.4 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.461 -178.353 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -117.68 167.82 11.0 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.86 0.362 . . . . 0.0 110.399 -178.097 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -60.96 142.74 56.23 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.639 0.733 . . . . 0.0 112.171 177.236 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 73.82 16.51 3.74 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 124.856 1.263 . . . . 0.0 111.506 178.276 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -77.47 162.09 27.44 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 177.058 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' THR . . . . . 0.462 ' HA ' ' O ' ' A' ' 21' ' ' LYS . 37.1 m -116.34 139.01 50.86 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 121.661 0.743 . . . . 0.0 112.953 -175.854 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 44.6 mm -98.48 143.02 13.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.538 178.508 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -102.39 122.08 43.58 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.847 0.356 . . . . 0.0 110.702 178.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.473 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 76.7 t -115.0 137.86 47.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.717 0 CA-C-O 121.17 0.51 . . . . 0.0 110.932 178.546 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' PHE . . . . . 0.521 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 5.3 p90 -136.26 153.04 51.31 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.458 -179.555 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -80.98 113.56 19.27 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.354 0.597 . . . . 0.0 111.479 -177.189 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 75.9 mm-40 . . . . . 0 C--N 1.314 -0.973 0 CA-C-O 121.359 0.599 . . . . 0.0 110.083 176.974 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 15.9 p-80 . . . . . 0 N--CA 1.454 -0.24 0 CA-C-O 120.96 0.409 . . . . 0.0 110.922 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 44.3 pt -129.54 166.95 25.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 121.435 0.636 . . . . 0.0 111.656 -175.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.498 ' HA ' ' O ' ' A' ' 32' ' ' PHE . 16.5 t-20 -97.29 139.94 32.51 Favored 'General case' 0 CA--C 1.506 -0.712 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.872 178.601 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.402 HD13 ' O ' ' A' ' 19' ' ' ASN . 3.0 mm? -130.93 139.98 50.13 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 176.8 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 47.3 mtmt -125.38 145.28 50.12 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-O 121.07 0.462 . . . . 0.0 110.515 -179.554 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.662 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 2.5 p -126.23 131.79 71.17 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.638 -178.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -112.57 131.71 55.48 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-O 121.195 0.522 . . . . 0.0 110.884 -178.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -96.94 176.44 31.97 Favored Glycine 0 N--CA 1.438 -1.178 0 CA-C-N 116.24 -0.437 . . . . 0.0 112.483 -179.446 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.461 HE21 ' HB2' ' A' ' 88' ' ' GLN . 0.1 OUTLIER -69.39 -24.58 63.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.738 0.78 . . . . 0.0 110.739 -177.894 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -83.93 -4.76 58.95 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.86 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.53 3.57 64.61 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.515 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.5 t -77.58 156.02 31.14 Favored 'General case' 0 C--N 1.322 -0.63 0 O-C-N 122.357 -0.496 . . . . 0.0 109.692 178.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.662 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.5 p -149.3 136.61 13.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-O 121.01 0.433 . . . . 0.0 110.587 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.5 t -119.89 136.57 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.72 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 179.833 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -108.32 143.42 37.22 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.016 0.436 . . . . 0.0 110.785 -179.399 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.517 ' HE1' HG12 ' A' ' 22' ' ' VAL . 11.4 m-85 . . . . . 0 N--CA 1.467 0.424 0 CA-C-O 121.085 0.469 . . . . 0.0 110.952 -178.064 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 31.9 pt . . . . . 0 CA--C 1.518 -0.254 0 CA-C-O 120.853 0.359 . . . . 0.0 110.468 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 32.0 mtmm -75.27 146.85 40.73 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 120.833 0.349 . . . . 0.0 110.604 178.221 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.434 ' HA ' ' HG2' ' A' ' 73' ' ' PRO . 5.7 ppt_? -71.39 -11.1 60.72 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.435 0.636 . . . . 0.0 110.891 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -101.94 -4.07 26.76 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.441 ' HB ' ' O ' ' A' ' 35' ' ' LYS . 1.3 m -92.36 137.33 24.72 Favored Pre-proline 0 N--CA 1.44 -0.94 0 CA-C-N 114.441 -1.254 . . . . 0.0 109.918 178.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -60.45 130.61 34.44 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.599 2.2 . . . . 0.0 112.443 -179.286 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.469 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.2 pp -70.18 -17.34 63.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.154 -0.475 . . . . 0.0 112.011 -179.215 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.468 ' N ' HD12 ' A' ' 40' ' ' LEU . 3.8 p -53.49 -28.58 31.64 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.94 -179.645 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 29.5 mtpp -59.6 -47.38 85.79 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.281 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.8 pp -73.75 -36.28 65.11 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.797 -179.796 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 39.8 mtm -63.03 -49.41 74.7 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 121.068 0.461 . . . . 0.0 111.02 -178.157 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.446 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 42.9 mtpt -69.53 -33.32 72.62 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.919 0.39 . . . . 0.0 110.604 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.0 -36.53 84.29 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.302 0.572 . . . . 0.0 109.659 177.714 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -59.23 -54.31 48.34 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.762 177.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 24.2 p -65.18 -35.2 80.34 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 122.15 -0.344 . . . . 0.0 111.211 -177.773 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 45.0 mt-10 -65.49 -42.1 92.54 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 120.762 0.315 . . . . 0.0 111.359 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -80.08 -33.28 38.99 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 120.969 0.414 . . . . 0.0 111.723 -178.683 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.42 ' HB3' HD23 ' A' ' 53' ' ' LEU . 24.9 mm-40 -81.84 -22.13 37.19 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -177.141 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.43 ' C ' HD22 ' A' ' 53' ' ' LEU . . . 88.42 39.57 6.73 Favored Glycine 0 N--CA 1.437 -1.239 0 C-N-CA 119.858 -1.163 . . . . 0.0 111.113 -177.339 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.496 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 4.0 mm? -125.73 168.05 14.31 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.04 0.448 . . . . 0.0 110.104 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.5 m -125.26 158.65 33.6 Favored 'General case' 0 C--N 1.312 -1.025 0 O-C-N 122.142 -0.349 . . . . 0.0 110.72 177.432 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 18.2 mmt -64.99 -25.29 67.8 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-O 121.367 0.603 . . . . 0.0 111.69 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.442 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.97 -14.74 43.71 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.525 0.679 . . . . 0.0 110.819 176.379 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -94.33 -26.62 16.49 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.087 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.7 pt -132.46 179.02 4.79 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-O 121.071 0.462 . . . . 0.0 110.942 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.41 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 3.8 mmt85 -153.81 140.54 19.02 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.602 178.788 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -99.59 139.85 34.64 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.333 -179.337 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.11 136.08 24.73 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.249 0.547 . . . . 0.0 110.607 -177.733 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.584 ' HB2' HD11 ' A' ' 67' ' ' ILE . 85.7 t80 -141.29 146.86 37.31 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.001 -179.477 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 52.0 25.79 3.36 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.576 0.75 . . . . 0.0 111.82 -179.077 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.8 -11.67 68.1 Favored Glycine 0 N--CA 1.44 -1.098 0 C-N-CA 120.836 -0.697 . . . . 0.0 113.542 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -109.01 150.37 40.85 Favored Pre-proline 0 C--N 1.319 -0.733 0 O-C-N 122.118 -0.636 . . . . 0.0 111.075 -179.358 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -71.98 139.81 33.68 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 122.613 2.208 . . . . 0.0 111.724 179.197 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.584 HD11 ' HB2' ' A' ' 62' ' ' PHE . 21.0 mt -94.75 146.92 6.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-O 120.94 0.4 . . . . 0.0 110.325 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -117.36 162.34 18.08 Favored 'General case' 0 CA--C 1.497 -1.072 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 176.889 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.456 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 10.0 pt-20 -70.7 -16.16 62.77 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-O 121.473 0.654 . . . . 0.0 110.489 178.886 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 17.3 p -86.6 -13.93 44.29 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -177.408 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.06 160.42 19.3 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 121.508 0.67 . . . . 0.0 112.518 -177.556 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -113.16 154.99 45.03 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.644 178.0 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.434 ' HG2' ' HA ' ' A' ' 36' ' ' ARG . 19.2 Cg_endo -59.37 -29.57 90.52 Favored 'Trans proline' 0 CA--C 1.531 0.359 0 C-N-CA 123.005 2.47 . . . . 0.0 111.785 178.875 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -75.78 -19.04 59.29 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.202 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -68.6 -42.64 77.88 Favored 'General case' 0 CA--C 1.51 -0.588 0 CA-C-O 121.726 0.774 . . . . 0.0 109.831 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.418 ' H ' HD12 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -85.31 6.84 24.55 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.594 -179.792 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 43.39 43.22 4.2 Favored 'General case' 0 C--N 1.359 1.018 0 C-N-CA 124.381 1.073 . . . . 0.0 111.995 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.4 ptm -83.38 169.64 15.38 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.677 -178.059 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 12.5 pt-20 -117.2 168.3 10.43 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 110.097 -0.335 . . . . 0.0 110.097 -179.421 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -58.95 142.86 49.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.52 0.676 . . . . 0.0 111.842 175.761 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 73.62 16.02 3.97 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 124.674 1.189 . . . . 0.0 111.902 179.246 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.453 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 1.5 t0 -73.63 155.5 38.97 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.211 -0.596 . . . . 0.0 109.631 178.434 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 34.7 m -111.58 136.87 50.18 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.636 0.732 . . . . 0.0 112.746 -174.216 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 43.1 mm -99.52 138.61 23.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.765 178.369 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -98.22 120.44 38.63 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.817 0.342 . . . . 0.0 110.324 178.31 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.41 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 96.7 t -113.04 138.73 41.46 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.081 0 CA-C-O 121.064 0.459 . . . . 0.0 109.899 177.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 14.8 p90 -137.28 153.27 50.36 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.016 -179.059 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.461 ' HB2' HE21 ' A' ' 25' ' ' GLN . 4.4 tp60 -80.03 116.6 20.25 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.364 0.602 . . . . 0.0 112.039 -176.724 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 71.1 mm-40 . . . . . 0 C--N 1.323 -0.558 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.63 176.675 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.507 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 56.6 p-80 . . . . . 0 N--CA 1.445 -0.723 0 CA-C-O 120.966 0.413 . . . . 0.0 110.635 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 40.3 pt -131.19 169.39 21.79 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.078 0 CA-C-O 121.364 0.602 . . . . 0.0 110.885 -178.017 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -103.49 139.73 38.45 Favored 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 177.481 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.405 HD23 HG12 ' A' ' 34' ' ' ILE . 3.2 mm? -126.75 136.97 53.13 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 177.488 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.48 ' HG2' ' HG3' ' A' ' 31' ' ' GLN . 52.1 mtmt -124.12 139.08 54.28 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.269 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.733 HG22 HG13 ' A' ' 84' ' ' ILE . 61.0 t -124.65 130.58 73.4 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.387 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -175.952 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -115.56 135.82 53.7 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 -178.207 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -121.46 162.0 15.35 Favored Glycine 0 N--CA 1.445 -0.763 0 C-N-CA 120.449 -0.881 . . . . 0.0 112.871 -178.48 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.594 ' HG2' ' HA ' ' A' ' 87' ' ' PHE . 22.8 mm-40 -66.17 -11.73 51.3 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.503 0.668 . . . . 0.0 110.397 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -78.23 6.82 7.35 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.431 179.574 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 72.82 36.36 57.83 Favored Glycine 0 C--N 1.338 0.658 0 C-N-CA 120.696 -0.764 . . . . 0.0 113.405 178.481 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.4 t -143.24 160.92 39.57 Favored 'General case' 0 C--N 1.314 -0.948 0 O-C-N 122.14 -0.623 . . . . 0.0 111.35 -179.09 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.554 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.8 p -149.32 139.12 16.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.39 -179.027 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.516 HG11 ' HD3' ' A' ' 50' ' ' ARG . 7.9 t -124.31 142.46 41.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 O-C-N 122.119 -0.363 . . . . 0.0 110.43 -179.483 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.48 ' HG3' ' HG2' ' A' ' 21' ' ' LYS . 0.5 OUTLIER -107.98 141.15 40.07 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 120.916 0.389 . . . . 0.0 110.997 179.092 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 . . . . . 0 N--CA 1.47 0.556 0 CA-C-O 120.921 0.391 . . . . 0.0 111.111 -178.283 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.405 HG12 HD23 ' A' ' 20' ' ' LEU . 30.2 pt . . . . . 0 CA--C 1.514 -0.425 0 CA-C-O 121.086 0.469 . . . . 0.0 110.263 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.507 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 36.9 mtmm -75.73 139.57 41.95 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 177.237 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.426 ' HA ' ' HG2' ' A' ' 73' ' ' PRO . 8.1 ppt_? -69.32 -11.99 61.29 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.448 0.642 . . . . 0.0 110.608 179.383 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 15.2 t-160 -99.23 2.53 45.75 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 122.181 0.991 . . . . 0.0 108.503 179.607 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.429 ' HB ' ' HB2' ' A' ' 35' ' ' LYS . 0.9 OUTLIER -103.4 143.29 26.32 Favored Pre-proline 0 N--CA 1.447 -0.599 0 CA-C-N 114.805 -1.089 . . . . 0.0 109.831 178.635 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -60.83 130.08 31.59 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 122.691 2.26 . . . . 0.0 112.493 -179.159 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.557 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.3 pp -70.34 -16.25 62.96 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.09 -0.504 . . . . 0.0 112.014 -179.41 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.459 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 0.1 OUTLIER -51.45 -29.6 16.79 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 122.955 0.502 . . . . 0.0 111.847 179.994 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -61.09 -47.85 84.41 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.222 0.534 . . . . 0.0 110.317 179.028 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.4 pp -73.5 -32.31 64.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.821 -178.724 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 46.7 mtm -62.76 -50.28 71.67 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.006 0.432 . . . . 0.0 111.018 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.45 ' HA ' ' SG ' ' A' ' 48' ' ' CYS . 81.0 mttt -66.97 -33.95 76.7 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.104 178.484 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.72 -35.88 82.47 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.169 0.509 . . . . 0.0 109.936 179.146 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -62.61 -56.63 16.07 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.544 178.17 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.509 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 26.3 p -62.1 -36.25 81.16 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.728 0.299 . . . . 0.0 111.649 -177.326 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -64.23 -44.32 92.22 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 120.905 0.383 . . . . 0.0 111.605 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.516 ' HD3' HG11 ' A' ' 30' ' ' VAL . 14.0 ptm180 -80.57 -32.01 36.68 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.047 0.451 . . . . 0.0 111.464 -177.526 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -80.91 -23.32 39.03 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.114 0.483 . . . . 0.0 112.006 -178.305 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.59 36.07 8.18 Favored Glycine 0 C--N 1.306 -1.084 0 C-N-CA 120.321 -0.943 . . . . 0.0 111.483 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.509 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 3.8 mm? -119.86 160.52 22.49 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 178.934 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.409 ' HB2' ' OE1' ' A' ' 57' ' ' GLN . 67.3 m -114.33 157.69 22.46 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 122.162 -0.336 . . . . 0.0 110.227 179.138 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 16.7 mmt -64.66 -27.57 69.01 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.264 0.554 . . . . 0.0 111.208 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.49 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -86.24 -7.59 58.42 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.427 0.632 . . . . 0.0 110.29 177.021 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.409 ' OE1' ' HB2' ' A' ' 54' ' ' SER . 0.9 OUTLIER -97.84 -19.83 17.9 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.59 -178.989 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 14.8 pt -144.88 -177.39 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 CA-C-O 121.102 0.477 . . . . 0.0 111.241 -177.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.409 ' CG ' ' HG3' ' A' ' 89' ' ' GLN . 16.8 mmt180 -155.58 141.45 18.12 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.56 177.656 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -96.63 139.82 32.14 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 178.493 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -140.4 139.83 35.37 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.245 0.545 . . . . 0.0 110.905 -178.153 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.53 ' HB2' HD11 ' A' ' 67' ' ' ILE . 64.3 t80 -144.88 147.01 32.29 Favored 'General case' 0 C--O 1.21 -1.017 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.956 178.793 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.8 t70 57.0 23.45 8.36 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 121.633 0.73 . . . . 0.0 110.805 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.6 -2.69 86.95 Favored Glycine 0 N--CA 1.429 -1.791 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.816 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.407 ' HG2' ' O ' ' A' ' 62' ' ' PHE . 3.5 pt20 -115.14 148.74 41.3 Favored Pre-proline 0 C--N 1.323 -0.549 0 O-C-N 122.293 -0.534 . . . . 0.0 110.645 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -69.33 142.94 51.29 Favored 'Trans proline' 0 C--O 1.236 0.392 0 C-N-CA 122.323 2.015 . . . . 0.0 111.836 179.434 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.53 HD11 ' HB2' ' A' ' 62' ' ' PHE . 32.4 mt -96.4 146.24 7.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.972 0.415 . . . . 0.0 110.53 -179.422 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -126.21 170.32 11.95 Favored 'General case' 0 CA--C 1.504 -0.81 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 178.399 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.459 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 11.2 pt-20 -70.32 -19.04 63.1 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-O 120.982 0.42 . . . . 0.0 111.657 -179.663 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.3 t -90.93 3.67 54.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.193 0.521 . . . . 0.0 111.288 -178.61 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.7 142.09 28.41 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-O 121.423 0.63 . . . . 0.0 111.412 178.172 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.695 ' HB ' ' OE1' ' A' ' 75' ' ' GLN . 1.1 m -112.48 140.69 24.07 Favored Pre-proline 0 C--N 1.317 -0.82 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.487 ' HD2' HG22 ' A' ' 72' ' ' THR . 15.7 Cg_endo -54.23 -33.75 76.55 Favored 'Trans proline' 0 N--CA 1.481 0.76 0 C-N-CA 123.478 2.785 . . . . 0.0 113.244 -176.699 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.45 -27.12 64.97 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.0 0.429 . . . . 0.0 111.574 -178.523 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLN . . . . . 0.695 ' OE1' ' HB ' ' A' ' 72' ' ' THR . 5.9 mp0 -68.29 -32.61 72.88 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.053 0.454 . . . . 0.0 111.564 -178.855 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.503 HD22 ' HD2' ' A' ' 62' ' ' PHE . 0.8 OUTLIER -92.58 10.07 31.94 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.005 0.431 . . . . 0.0 110.045 179.9 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 43.62 41.16 3.32 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.598 1.159 . . . . 0.0 112.264 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 5.9 ptm -80.3 163.62 23.8 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.5 -178.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -107.48 165.96 11.02 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.129 -177.451 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -59.48 143.23 50.58 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 121.448 0.642 . . . . 0.0 110.802 171.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 69.55 19.15 7.55 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.032 -0.985 . . . . 0.0 111.67 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -62.49 149.27 43.28 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.186 176.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.0 m -102.05 122.09 43.44 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 121.597 0.713 . . . . 0.0 112.052 -177.855 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.733 HG13 HG22 ' A' ' 22' ' ' VAL . 14.0 mm -93.22 139.15 18.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.658 179.033 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -97.57 118.79 34.87 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 120.989 0.423 . . . . 0.0 110.687 179.248 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 43.5 t -114.06 133.11 61.1 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 CA-C-O 121.406 0.622 . . . . 0.0 110.114 176.729 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' PHE . . . . . 0.594 ' HA ' ' HG2' ' A' ' 25' ' ' GLN . 24.2 p90 -134.39 153.37 51.94 Favored 'General case' 0 C--N 1.3 -1.587 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.431 -178.355 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLN . . . . . 0.437 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 0.4 OUTLIER -62.27 157.9 18.5 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-O 121.12 0.486 . . . . 0.0 110.747 179.711 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.437 ' HG2' ' O ' ' A' ' 88' ' ' GLN . 35.0 mm-40 . . . . . 0 C--N 1.321 -0.646 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.696 -177.197 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 11.5 p-80 . . . . . 0 N--CA 1.447 -0.612 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 43.5 pt -128.01 167.47 23.01 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.072 0 CA-C-O 121.105 0.478 . . . . 0.0 111.036 -176.883 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.51 ' HA ' ' O ' ' A' ' 32' ' ' PHE . 45.1 t-20 -107.18 128.03 54.05 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.719 -0.475 . . . . 0.0 109.719 179.412 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -118.64 134.06 55.39 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 178.156 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.4 mtmp? -115.37 149.18 38.35 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-O 120.999 0.428 . . . . 0.0 109.979 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.701 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 2.7 p -125.15 129.01 73.3 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.011 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.693 -177.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -110.64 120.84 43.72 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.058 0.456 . . . . 0.0 109.836 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.52 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -92.88 156.07 22.81 Favored Glycine 0 N--CA 1.427 -1.946 0 C-N-CA 120.575 -0.822 . . . . 0.0 112.837 -178.673 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.56 -13.42 1.56 Allowed 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 178.562 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -90.3 -13.3 35.54 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.131 0.491 . . . . 0.0 110.728 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 104.94 6.56 39.82 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 121.01 -0.614 . . . . 0.0 112.225 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 40.1 t -89.83 155.53 19.1 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 120.821 0.343 . . . . 0.0 110.421 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.701 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.7 p -147.95 134.59 13.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 CA-C-O 121.096 0.474 . . . . 0.0 110.714 178.74 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.5 t -122.22 139.23 49.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -107.74 142.79 37.2 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 120.741 0.305 . . . . 0.0 110.907 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.529 ' HE1' HG12 ' A' ' 22' ' ' VAL . 10.1 m-85 . . . . . 0 N--CA 1.476 0.86 0 CA-C-O 121.318 0.58 . . . . 0.0 111.587 -178.422 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 39.9 pt . . . . . 0 CA--C 1.515 -0.381 0 CA-C-O 120.965 0.412 . . . . 0.0 110.594 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 28.9 mtmm -87.66 150.14 23.83 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 120.923 0.392 . . . . 0.0 110.421 178.274 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.402 ' O ' ' HG2' ' A' ' 73' ' ' PRO . 23.8 ptt180 -62.68 -24.33 67.58 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.488 0.661 . . . . 0.0 111.099 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 14.6 t60 -103.11 1.72 33.67 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.883 0.849 . . . . 0.0 109.594 -177.252 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.1 m -92.56 139.35 23.7 Favored Pre-proline 0 C--N 1.31 -1.123 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.878 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.76 128.64 19.32 Favored 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 121.934 1.756 . . . . 0.0 112.185 -177.065 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.529 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.0 OUTLIER -66.83 -16.86 64.57 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.01 -179.445 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.562 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 1.0 OUTLIER -52.14 -29.87 24.01 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.921 0.391 . . . . 0.0 111.882 179.607 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 35.3 mtpt -62.83 -44.58 95.75 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-O 120.996 0.427 . . . . 0.0 110.417 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.9 pp -73.47 -33.9 65.09 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 120.896 0.379 . . . . 0.0 110.29 178.71 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 47.8 mtm -62.12 -49.31 76.4 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 121.32 0.581 . . . . 0.0 110.411 -179.677 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -68.65 -35.3 77.07 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.073 178.896 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.13 -33.13 75.06 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.309 0.576 . . . . 0.0 109.826 178.098 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 62.3 t80 -63.72 -55.19 25.2 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.797 178.028 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.427 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 25.3 p -63.13 -35.82 81.56 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.803 0.335 . . . . 0.0 110.922 -178.082 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -61.75 -48.63 79.83 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 121.035 0.445 . . . . 0.0 111.422 178.486 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -76.72 -31.08 56.92 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.967 0.413 . . . . 0.0 111.383 -177.429 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -82.77 -21.96 34.47 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 -178.421 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 93.75 8.13 60.95 Favored Glycine 0 CA--C 1.523 0.561 0 C-N-CA 120.268 -0.968 . . . . 0.0 113.319 179.086 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.427 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 3.2 mm? -97.98 173.74 6.91 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 122.205 -0.585 . . . . 0.0 111.01 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 71.7 m -122.27 157.8 30.91 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 120.719 0.295 . . . . 0.0 111.154 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.7 mmt -63.7 -27.28 69.1 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.118 0.485 . . . . 0.0 112.247 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.73 -12.61 53.42 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.636 0.731 . . . . 0.0 109.944 177.531 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -93.66 -30.97 14.65 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.699 -177.721 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 9.6 pt -132.56 177.34 7.26 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-O 121.132 0.492 . . . . 0.0 111.5 -177.865 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.403 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 12.9 mmt180 -150.1 143.77 25.3 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.164 179.407 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -100.9 141.44 33.78 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.705 179.221 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -142.99 139.34 30.59 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-O 121.19 0.519 . . . . 0.0 111.118 -177.002 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.547 ' HB2' HD11 ' A' ' 67' ' ' ILE . 72.5 t80 -144.61 145.92 32.03 Favored 'General case' 0 C--O 1.214 -0.767 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.782 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 16.7 t70 57.43 23.44 9.04 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 121.885 0.85 . . . . 0.0 109.962 -178.357 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.77 -25.88 8.05 Favored Glycine 0 N--CA 1.426 -1.977 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.548 -178.464 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -90.25 149.26 40.95 Favored Pre-proline 0 C--N 1.323 -0.561 0 O-C-N 122.582 -0.363 . . . . 0.0 111.301 -177.427 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -71.7 141.58 37.98 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 122.206 1.938 . . . . 0.0 111.391 178.782 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.547 HD11 ' HB2' ' A' ' 62' ' ' PHE . 39.0 mt -91.9 149.27 4.18 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-O 120.964 0.411 . . . . 0.0 110.905 -177.657 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -115.53 175.57 5.46 Favored 'General case' 0 CA--C 1.502 -0.903 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 177.662 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.562 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 0.2 OUTLIER -77.5 -20.67 53.96 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-O 121.503 0.668 . . . . 0.0 110.223 179.423 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.8 t -95.22 8.59 42.6 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.843 0.83 . . . . 0.0 110.529 -178.346 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -78.49 134.97 37.26 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.0 178.006 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.27 137.42 21.52 Favored Pre-proline 0 C--N 1.311 -1.074 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.035 176.206 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.593 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 10.9 Cg_endo -55.81 -34.13 90.31 Favored 'Trans proline' 0 C--O 1.236 0.375 0 C-N-CA 123.027 2.485 . . . . 0.0 112.477 -177.622 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.25 -17.39 61.34 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.795 -179.142 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -77.6 -33.66 53.7 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.916 0.388 . . . . 0.0 110.98 -179.549 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -89.86 -2.85 58.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.24 0.543 . . . . 0.0 109.974 178.662 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 57.01 36.75 28.18 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.862 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.593 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.9 ptm -76.27 160.83 29.28 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.635 -178.688 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.491 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 12.3 pt-20 -112.51 166.11 11.62 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-O 120.854 0.359 . . . . 0.0 110.469 -177.285 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -62.76 148.27 47.26 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 121.343 0.592 . . . . 0.0 110.975 174.474 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 73.07 13.52 4.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.424 -179.613 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.491 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 2.2 t0 -74.66 158.66 33.23 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.798 -0.361 . . . . 0.0 110.154 178.494 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 39.6 m -116.01 136.59 52.89 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.783 0.801 . . . . 0.0 112.982 -176.126 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.429 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 44.5 mm -97.26 140.94 16.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.371 178.668 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -99.11 117.38 33.46 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.707 0.289 . . . . 0.0 110.28 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.52 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 73.0 t -113.52 136.11 50.95 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 CA-C-O 121.432 0.634 . . . . 0.0 110.671 178.902 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -137.34 155.26 49.63 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.075 -178.537 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 36.2 tp60 -80.83 111.91 17.72 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.187 0.517 . . . . 0.0 110.999 -176.602 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 64.4 mm-40 . . . . . 0 C--N 1.317 -0.831 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.744 179.241 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.498 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 43.9 p-80 . . . . . 0 N--CA 1.447 -0.612 0 CA-C-O 121.182 0.515 . . . . 0.0 111.753 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 31.5 pt -133.5 170.97 18.85 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.835 178.138 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -107.46 134.03 51.09 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.405 HD23 HG12 ' A' ' 34' ' ' ILE . 2.9 mm? -125.05 139.14 54.06 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 177.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 30' ' ' VAL . 52.3 mtmt -121.8 143.43 49.4 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.281 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.728 HG22 HG13 ' A' ' 84' ' ' ILE . 65.8 t -121.68 128.87 75.86 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -179.238 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -108.51 134.97 50.55 Favored 'General case' 0 C--O 1.245 0.835 0 CA-C-O 121.377 0.608 . . . . 0.0 111.092 -177.096 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -96.18 170.68 27.58 Favored Glycine 0 N--CA 1.428 -1.847 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.899 179.136 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.78 -25.46 63.81 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.207 0.527 . . . . 0.0 110.498 -176.568 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -84.66 -2.85 58.08 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.161 -178.049 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 94.9 7.61 59.75 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 120.197 -1.002 . . . . 0.0 113.515 179.404 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 37.0 t -85.45 155.25 21.33 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 177.982 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.496 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 5.3 p -150.82 143.05 16.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-O 121.164 0.507 . . . . 0.0 111.021 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.606 HG11 ' HD3' ' A' ' 50' ' ' ARG . 16.4 t -123.63 140.48 47.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 178.614 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -106.2 138.66 42.0 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 120.999 0.428 . . . . 0.0 110.356 179.104 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.403 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 16.4 m-85 . . . . . 0 C--N 1.324 -0.508 0 CA-C-O 121.047 0.451 . . . . 0.0 110.895 -177.671 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.541 HD13 HD23 ' A' ' 43' ' ' LEU . 20.9 pt . . . . . 0 CA--C 1.512 -0.498 0 CA-C-O 121.17 0.51 . . . . 0.0 110.777 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.533 ' HB2' ' OG1' ' A' ' 38' ' ' THR . 46.6 mtpt -81.83 148.25 28.94 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.267 179.108 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.9 ppt_? -69.01 -16.84 63.82 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.829 0.347 . . . . 0.0 111.397 -179.249 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 11.4 t-80 -100.95 -3.5 29.41 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 122.291 1.043 . . . . 0.0 108.52 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.533 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 2.4 m -90.81 137.28 26.96 Favored Pre-proline 0 N--CA 1.432 -1.334 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.429 -179.184 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_endo -61.6 129.15 26.83 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.39 2.06 . . . . 0.0 112.04 -179.626 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.734 HD13 ' SD ' ' A' ' 44' ' ' MET . 0.4 OUTLIER -69.36 -17.95 63.74 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.02 -0.537 . . . . 0.0 112.317 -178.868 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.571 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 7.8 p -50.93 -32.46 20.86 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 122.995 0.518 . . . . 0.0 111.658 179.01 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt -59.8 -48.34 82.08 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.446 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.6 pp -71.42 -33.78 69.72 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.234 0.54 . . . . 0.0 110.075 179.106 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.734 ' SD ' HD13 ' A' ' 40' ' ' LEU . 38.5 mtp -60.6 -49.28 78.18 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.183 0.516 . . . . 0.0 111.053 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 27.6 mmtp -67.23 -35.89 80.52 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.77 177.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.443 ' O ' ' HG2' ' A' ' 50' ' ' ARG . . . -63.68 -39.26 93.89 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 121.23 0.538 . . . . 0.0 110.186 179.326 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -57.81 -55.37 35.75 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.231 177.672 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.589 ' SG ' HD11 ' A' ' 58' ' ' ILE . 32.5 m -59.92 -41.26 91.37 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.104 -178.75 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -65.68 -39.91 91.79 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.265 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.606 ' HD3' HG11 ' A' ' 30' ' ' VAL . 14.6 ptm180 -82.08 -35.7 28.38 Favored 'General case' 0 C--N 1.329 -0.313 0 O-C-N 121.912 -0.492 . . . . 0.0 111.578 -178.822 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.425 ' HB3' HD23 ' A' ' 53' ' ' LEU . 24.9 mm-40 -77.67 -22.37 50.67 Favored 'General case' 0 CA--C 1.502 -0.896 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -179.19 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 84.48 42.8 7.21 Favored Glycine 0 N--CA 1.427 -1.957 0 C-N-CA 119.773 -1.203 . . . . 0.0 111.168 -177.515 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.425 HD23 ' HB3' ' A' ' 51' ' ' GLN . 4.0 mm? -122.8 164.17 18.86 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 178.687 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.8 m -113.58 150.25 33.31 Favored 'General case' 0 N--CA 1.44 -0.968 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 178.043 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 10.6 mmt -59.32 -29.16 67.44 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-O 121.3 0.571 . . . . 0.0 111.651 178.876 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.438 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -84.87 -13.58 50.5 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.511 0.672 . . . . 0.0 110.651 178.241 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -91.45 -19.07 23.24 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.77 -178.428 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.589 HD11 ' SG ' ' A' ' 48' ' ' CYS . 16.3 pt -139.41 -176.46 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.118 0.485 . . . . 0.0 111.026 -178.885 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.417 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 7.2 mmt180 -157.14 131.68 8.62 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.678 177.228 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -89.38 145.5 25.3 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.514 178.727 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.598 ' HD3' ' CA ' ' A' ' 64' ' ' GLY . 7.2 tmm_? -150.65 145.52 25.9 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-O 121.137 0.494 . . . . 0.0 110.596 -176.911 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.422 ' HB2' HD11 ' A' ' 67' ' ' ILE . 68.9 t80 -146.88 147.13 30.5 Favored 'General case' 0 C--O 1.216 -0.709 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.423 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 18.8 t70 55.83 23.75 6.75 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-O 121.753 0.787 . . . . 0.0 110.517 -177.199 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.598 ' CA ' ' HD3' ' A' ' 61' ' ' ARG . . . 83.9 -16.38 32.48 Favored Glycine 0 N--CA 1.428 -1.863 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.698 -179.182 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.575 ' O ' ' HG2' ' A' ' 61' ' ' ARG . 4.0 pt20 -97.1 148.0 33.76 Favored Pre-proline 0 CA--C 1.537 0.474 0 O-C-N 122.619 -0.342 . . . . 0.0 110.603 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -68.58 141.19 49.59 Favored 'Trans proline' 0 CA--C 1.53 0.325 0 C-N-CA 122.572 2.181 . . . . 0.0 112.337 -179.223 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.422 HD11 ' HB2' ' A' ' 62' ' ' PHE . 50.3 mt -90.25 146.78 5.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 179.46 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -116.45 164.67 14.21 Favored 'General case' 0 CA--C 1.498 -1.054 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.463 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.571 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 9.5 pt-20 -75.84 -18.0 59.61 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.679 0.752 . . . . 0.0 109.859 177.649 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 23.5 p -93.0 1.65 57.2 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.735 -176.957 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -101.56 159.64 15.13 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 121.817 -0.552 . . . . 0.0 111.103 -177.585 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -114.79 151.31 45.29 Favored Pre-proline 0 C--O 1.219 -0.509 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 178.88 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.86 -29.86 91.31 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.978 2.452 . . . . 0.0 112.116 -179.127 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.45 -17.84 61.74 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.214 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 50.8 tp60 -68.25 -41.51 81.04 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-O 121.64 0.733 . . . . 0.0 110.382 -178.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.424 ' H ' HD12 ' A' ' 76' ' ' LEU . 0.8 OUTLIER -86.75 2.93 47.05 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.862 -174.634 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 56.55 33.21 22.26 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-O 121.399 0.619 . . . . 0.0 111.044 178.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.414 ' HE1' HD11 ' A' ' 84' ' ' ILE . 6.9 ptm -77.96 156.77 30.03 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.097 -177.766 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.575 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 12.3 pt-20 -107.08 162.61 13.71 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.274 -177.79 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -58.72 138.49 57.04 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.146 0.498 . . . . 0.0 111.127 174.181 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 77.21 19.54 1.3 Allowed 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 124.665 1.186 . . . . 0.0 110.613 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.575 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 0.7 OUTLIER -70.54 152.1 44.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.145 177.985 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 31.5 m -106.85 121.49 44.51 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.527 0.679 . . . . 0.0 112.694 -176.367 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.728 HG13 HG22 ' A' ' 22' ' ' VAL . 18.3 mm -85.3 140.53 15.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.232 176.867 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -102.23 116.18 32.12 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 120.837 0.351 . . . . 0.0 110.926 -179.461 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.417 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 72.3 t -109.69 138.43 37.26 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.938 0 CA-C-O 120.963 0.411 . . . . 0.0 110.471 177.378 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.6 p90 -133.99 149.01 51.2 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 116.092 -0.503 . . . . 0.0 109.817 178.481 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -75.5 131.72 40.28 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.789 0.804 . . . . 0.0 112.168 -176.607 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 . . . . . 0 C--N 1.314 -0.942 0 CA-C-N 115.162 -0.926 . . . . 0.0 111.772 178.269 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.48 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 24.8 p-80 . . . . . 0 C--O 1.234 0.271 0 CA-C-O 120.982 0.42 . . . . 0.0 110.813 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 42.1 pt -129.65 171.21 17.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.277 0.56 . . . . 0.0 110.416 178.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.523 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 23.4 t-20 -110.5 135.72 50.73 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.099 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -124.65 143.57 50.66 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.894 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.436 ' HG2' ' HG3' ' A' ' 31' ' ' GLN . 54.6 mtmt -126.48 140.74 52.23 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-O 121.22 0.533 . . . . 0.0 109.826 179.262 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.749 HG22 HG13 ' A' ' 84' ' ' ILE . 60.1 t -122.99 131.96 72.31 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 -178.488 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.06 129.25 55.45 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 -178.623 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.454 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -105.66 156.95 16.41 Favored Glycine 0 N--CA 1.428 -1.872 0 C-N-CA 120.193 -1.003 . . . . 0.0 111.962 -179.388 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.24 -9.48 0.43 Allowed 'General case' 0 CA--C 1.55 0.96 0 N-CA-C 113.552 0.945 . . . . 0.0 113.552 178.952 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -82.48 -21.22 35.63 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.3 0.571 . . . . 0.0 110.208 178.857 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.51 3.52 40.6 Favored Glycine 0 CA--C 1.508 -0.394 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.7 t -91.03 152.66 20.57 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.18 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.514 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 3.2 p -148.35 137.02 15.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.161 0.505 . . . . 0.0 110.145 -178.869 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.418 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 3.8 t -125.99 141.72 44.82 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 O-C-N 122.108 -0.37 . . . . 0.0 110.516 -177.777 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.44 ' HB3' HD21 ' A' ' 19' ' ' ASN . 0.5 OUTLIER -106.07 141.71 36.98 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.195 179.166 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.449 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 20.1 m-85 . . . . . 0 C--N 1.323 -0.585 0 CA-C-O 121.172 0.51 . . . . 0.0 110.99 -177.909 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.435 HD13 HD23 ' A' ' 43' ' ' LEU . 33.7 pt . . . . . 0 CA--C 1.518 -0.272 0 CA-C-O 120.908 0.385 . . . . 0.0 110.177 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.524 ' HB2' ' OG1' ' A' ' 38' ' ' THR . 22.5 mtpp -85.89 151.23 23.94 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-O 121.131 0.491 . . . . 0.0 110.417 177.803 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -64.32 -25.1 67.89 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.072 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 19.5 t-160 -102.39 1.07 34.96 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.998 0.904 . . . . 0.0 109.25 -176.091 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.524 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.6 m -91.8 136.04 26.82 Favored Pre-proline 0 C--N 1.3 -1.575 0 CA-C-N 114.828 -1.078 . . . . 0.0 109.965 -179.26 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -58.23 125.85 19.74 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.597 2.198 . . . . 0.0 112.341 -179.067 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.583 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.3 pp -68.4 -16.8 64.05 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.039 -179.059 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.459 ' N ' HD12 ' A' ' 40' ' ' LEU . 26.2 t -51.19 -31.95 21.89 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 121.006 0.431 . . . . 0.0 111.125 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.3 mtpp -56.52 -50.49 71.68 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.305 0.574 . . . . 0.0 110.802 178.461 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.6 pp -71.5 -32.74 68.57 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.991 -179.082 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 49.5 mtm -64.0 -42.99 96.99 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.224 0.535 . . . . 0.0 110.731 -179.214 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.619 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 1.4 mmpt? -68.04 -38.94 83.09 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.54 177.491 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.19 -35.5 80.51 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-O 121.174 0.511 . . . . 0.0 110.068 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.523 ' CE2' ' HG3' ' A' ' 51' ' ' GLN . 64.4 t80 -61.79 -54.9 35.98 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.081 177.434 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.629 ' SG ' HD11 ' A' ' 58' ' ' ILE . 30.4 m -58.89 -39.04 80.27 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.127 0.489 . . . . 0.0 110.993 -179.146 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.619 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 73.6 mm-40 -59.84 -52.79 63.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.006 0.431 . . . . 0.0 111.399 178.627 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' ' 47' ' ' TYR . 9.6 ptp180 -71.17 -36.05 71.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.993 0.425 . . . . 0.0 111.965 -177.046 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.523 ' HG3' ' CE2' ' A' ' 47' ' ' TYR . 24.3 mm-40 -72.68 -16.95 61.68 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -179.157 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 74.9 38.04 42.56 Favored Glycine 0 N--CA 1.435 -1.381 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -174.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.617 HD23 HG21 ' A' ' 58' ' ' ILE . 3.7 mp -123.41 165.66 16.67 Favored 'General case' 0 N--CA 1.433 -1.292 0 C-N-CA 123.631 0.772 . . . . 0.0 109.376 -175.431 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.426 ' HB2' ' OE1' ' A' ' 57' ' ' GLN . 61.8 m -124.88 158.09 34.34 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-O 120.67 0.272 . . . . 0.0 111.082 178.362 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.8 mmt -61.56 -30.2 70.5 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-O 121.069 0.461 . . . . 0.0 111.998 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.57 -13.36 51.97 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.615 0.721 . . . . 0.0 110.491 177.724 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.426 ' OE1' ' HB2' ' A' ' 54' ' ' SER . 1.2 mp0 -89.95 -20.71 23.0 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.723 -178.61 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.629 HD11 ' SG ' ' A' ' 48' ' ' CYS . 13.5 pt -142.91 -177.2 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.306 0.574 . . . . 0.0 111.871 -177.701 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.7 mmt180 -157.26 140.83 15.78 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.861 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' PHE . . . . . 0.402 ' HB3' HD12 ' A' ' 67' ' ' ILE . 23.1 m-85 -97.36 145.58 26.01 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.886 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.429 ' NE ' ' HA2' ' A' ' 64' ' ' GLY . 1.2 tmt_? -143.32 138.84 29.79 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-O 121.068 0.461 . . . . 0.0 110.664 -177.857 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.566 ' HE1' ' OD1' ' A' ' 82' ' ' ASP . 80.6 t80 -143.36 147.42 34.65 Favored 'General case' 0 C--O 1.208 -1.089 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.994 179.46 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.0 t70 57.55 22.84 8.55 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 121.73 0.776 . . . . 0.0 110.665 179.115 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.429 ' HA2' ' NE ' ' A' ' 61' ' ' ARG . . . 80.27 2.74 89.47 Favored Glycine 0 N--CA 1.427 -1.95 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.706 -178.954 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 62' ' ' PHE . 13.3 pt20 -119.43 149.96 48.73 Favored Pre-proline 0 N--CA 1.442 -0.864 0 O-C-N 122.313 -0.522 . . . . 0.0 109.741 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 65' ' ' GLN . 14.2 Cg_exo -65.06 141.26 69.26 Favored 'Trans proline' 0 C--N 1.327 -0.56 0 C-N-CA 122.245 1.963 . . . . 0.0 111.654 178.269 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.539 HD11 ' HB2' ' A' ' 62' ' ' PHE . 44.2 mt -92.74 146.21 6.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 178.147 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -112.85 170.46 8.18 Favored 'General case' 0 CA--C 1.502 -0.87 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -75.92 -15.72 60.14 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.515 0.674 . . . . 0.0 109.772 176.169 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 18.9 p -93.86 3.92 54.68 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.313 179.525 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ASP . . . . . 0.479 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 22.4 m-20 -82.09 142.05 32.62 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.477 0.656 . . . . 0.0 111.951 -179.359 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -116.41 139.31 25.19 Favored Pre-proline 0 C--N 1.317 -0.843 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.408 174.391 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.428 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 13.5 Cg_endo -56.76 -33.3 93.86 Favored 'Trans proline' 0 C--O 1.237 0.439 0 C-N-CA 123.036 2.491 . . . . 0.0 113.131 -175.783 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.83 -27.93 66.28 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.688 -179.089 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -65.05 -37.9 89.06 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.926 0.393 . . . . 0.0 111.296 -179.429 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.476 HD22 ' HD2' ' A' ' 62' ' ' PHE . 0.5 OUTLIER -93.09 7.14 45.4 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 -179.855 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 43.35 40.21 2.5 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.636 1.174 . . . . 0.0 112.479 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.428 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 5.5 ptm -74.16 157.09 36.58 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.827 -178.409 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -103.39 159.85 15.21 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.013 -176.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.523 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 10.5 p-10 -57.69 141.92 46.84 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.245 0.545 . . . . 0.0 111.057 174.423 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' A' ' 80' ' ' ASP . 8.3 mt-10 74.77 19.1 2.58 Favored 'General case' 0 CA--C 1.506 -0.727 0 C-N-CA 124.337 1.055 . . . . 0.0 111.48 -179.373 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.566 ' OD1' ' HE1' ' A' ' 62' ' ' PHE . 16.4 t70 -64.16 150.05 46.51 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.685 177.146 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 23.2 m -104.07 113.9 27.76 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.413 0.625 . . . . 0.0 112.044 -179.334 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.749 HG13 HG22 ' A' ' 22' ' ' VAL . 17.3 mm -83.59 145.08 8.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.532 178.278 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -102.83 116.86 33.38 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.124 -179.451 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.454 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 71.3 t -113.06 134.85 54.4 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-O 121.321 0.582 . . . . 0.0 111.175 176.496 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 13.0 p90 -132.9 155.5 48.94 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.749 -179.712 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -75.55 132.1 40.47 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.49 0.662 . . . . 0.0 112.051 -176.693 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 . . . . . 0 C--N 1.323 -0.555 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.2 178.238 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 . . . . . 0 N--CA 1.446 -0.644 0 CA-C-O 121.044 0.449 . . . . 0.0 110.429 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 31.9 pt -130.95 170.72 19.13 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.066 0 CA-C-O 121.379 0.609 . . . . 0.0 110.994 -178.865 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -104.85 136.23 44.74 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.563 178.497 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -127.93 135.93 50.64 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 177.167 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -121.81 146.82 46.7 Favored 'General case' 0 C--N 1.308 -1.215 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 179.018 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.669 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 3.4 p -124.62 131.44 72.7 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.797 -176.921 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -112.06 132.03 55.07 Favored 'General case' 0 C--O 1.244 0.79 0 CA-C-O 121.151 0.5 . . . . 0.0 110.762 -178.801 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -102.92 174.12 23.09 Favored Glycine 0 N--CA 1.435 -1.391 0 C-N-CA 121.292 -0.48 . . . . 0.0 112.725 -179.063 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.418 ' CD ' ' H ' ' A' ' 25' ' ' GLN . 0.1 OUTLIER -66.92 -31.41 71.98 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.531 0.681 . . . . 0.0 110.782 -177.529 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -77.31 -10.65 59.57 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.984 -178.222 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 98.82 7.37 55.51 Favored Glycine 0 N--CA 1.443 -0.894 0 C-N-CA 120.448 -0.882 . . . . 0.0 112.578 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 18.7 t -83.46 154.24 24.03 Favored 'General case' 0 N--CA 1.444 -0.765 0 O-C-N 122.416 -0.461 . . . . 0.0 109.976 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.669 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.2 p -146.68 132.69 13.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.269 0.557 . . . . 0.0 111.074 179.564 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.0 t -117.12 135.16 58.4 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -105.35 142.75 34.56 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.754 0.311 . . . . 0.0 110.92 -179.568 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.478 ' HE1' HG12 ' A' ' 22' ' ' VAL . 11.5 m-85 . . . . . 0 N--CA 1.468 0.447 0 CA-C-O 121.109 0.48 . . . . 0.0 110.96 -179.568 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 35.5 pt . . . . . 0 CA--C 1.52 -0.178 0 CA-C-O 121.149 0.499 . . . . 0.0 111.32 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.477 ' HB2' ' OG1' ' A' ' 38' ' ' THR . 15.6 mtpp -75.48 153.79 37.35 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.042 178.335 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.9 ptt180 -67.14 -22.38 65.78 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.507 0.67 . . . . 0.0 110.492 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -103.76 2.31 32.78 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 122.205 1.002 . . . . 0.0 109.357 -176.115 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.477 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.2 m -89.97 134.47 31.76 Favored Pre-proline 0 C--N 1.302 -1.476 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.808 178.551 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -61.34 125.51 17.07 Favored 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 122.33 2.02 . . . . 0.0 112.27 -178.832 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.531 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.0 OUTLIER -65.92 -17.42 64.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.112 0.482 . . . . 0.0 111.899 -179.57 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.455 ' N ' HD12 ' A' ' 40' ' ' LEU . 5.9 p -55.68 -28.25 54.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.416 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -60.91 -45.55 94.21 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 116.25 -0.432 . . . . 0.0 109.946 179.33 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.5 pp -72.91 -36.73 67.33 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.014 0.435 . . . . 0.0 110.231 178.875 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 45.1 mtm -63.58 -49.59 72.78 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 120.996 0.426 . . . . 0.0 110.855 -178.344 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.46 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 92.5 mttt -66.25 -36.1 82.13 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-O 120.688 0.28 . . . . 0.0 110.866 178.905 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.54 -37.42 87.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.114 0.483 . . . . 0.0 109.981 178.715 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -58.73 -55.43 35.16 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.793 178.051 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.51 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 24.4 p -64.8 -35.47 81.19 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 122.141 -0.349 . . . . 0.0 111.325 -177.061 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 60.7 mt-10 -67.04 -40.75 87.22 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.795 0.331 . . . . 0.0 111.507 179.653 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -81.82 -32.26 31.32 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 120.935 0.398 . . . . 0.0 111.472 -178.694 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.7 mm-40 -82.04 -22.69 36.28 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -177.686 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 90.2 37.7 6.6 Favored Glycine 0 N--CA 1.437 -1.262 0 C-N-CA 120.114 -1.041 . . . . 0.0 111.174 -178.318 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.51 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 3.9 mm? -123.62 165.35 17.33 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 179.297 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.1 m -119.49 155.48 32.02 Favored 'General case' 0 C--N 1.312 -1.031 0 O-C-N 121.922 -0.486 . . . . 0.0 110.971 178.791 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 12.9 mmt -63.15 -26.04 68.63 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.448 0.642 . . . . 0.0 111.453 178.847 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.54 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.84 -12.65 50.24 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.553 0.692 . . . . 0.0 110.52 177.219 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -96.94 -27.23 14.74 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.748 -0.66 . . . . 0.0 112.178 -178.112 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.8 pt -132.59 176.12 9.8 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.041 0 CA-C-O 121.076 0.465 . . . . 0.0 110.485 -178.802 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.413 ' HD3' ' HA ' ' A' ' 59' ' ' ARG . 16.1 mmt180 -149.72 141.67 23.83 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.729 178.696 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -100.08 139.41 35.78 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.977 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.63 ' HG2' ' N ' ' A' ' 62' ' ' PHE . 1.5 ttm180 -137.83 150.63 47.33 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-O 121.179 0.514 . . . . 0.0 110.865 -178.87 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.63 ' N ' ' HG2' ' A' ' 61' ' ' ARG . 74.4 t80 -155.23 146.1 22.44 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.841 176.511 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.2 t70 57.45 24.6 10.4 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 121.637 0.732 . . . . 0.0 110.403 -178.484 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.95 0.18 84.62 Favored Glycine 0 N--CA 1.435 -1.417 0 C-N-CA 121.011 -0.614 . . . . 0.0 113.292 -179.291 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -115.87 146.52 37.12 Favored Pre-proline 0 C--N 1.319 -0.728 0 O-C-N 122.13 -0.629 . . . . 0.0 110.067 179.221 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.55 139.74 45.58 Favored 'Trans proline' 0 C--O 1.238 0.495 0 C-N-CA 122.053 1.836 . . . . 0.0 111.806 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.523 HD11 ' HB2' ' A' ' 62' ' ' PHE . 42.8 mt -91.72 146.43 6.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 120.929 0.395 . . . . 0.0 110.242 -178.631 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -109.53 157.74 18.7 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 177.222 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.435 ' OE2' HG23 ' A' ' 70' ' ' THR . 0.1 OUTLIER -68.65 -19.53 64.41 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-O 121.649 0.738 . . . . 0.0 110.579 178.061 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.435 HG23 ' OE2' ' A' ' 69' ' ' GLU . 1.0 OUTLIER -96.32 14.81 23.03 Favored 'General case' 0 N--CA 1.421 -1.905 0 CA-C-N 116.011 -0.54 . . . . 0.0 112.107 179.693 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -96.4 150.84 20.14 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 120.881 0.372 . . . . 0.0 110.31 -179.576 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.734 ' HB ' ' OE1' ' A' ' 75' ' ' GLN . 0.9 OUTLIER -117.61 141.39 28.85 Favored Pre-proline 0 CA--C 1.545 0.754 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 179.179 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.518 ' HD2' HG22 ' A' ' 72' ' ' THR . 12.2 Cg_endo -53.66 -34.26 73.03 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 123.545 2.83 . . . . 0.0 113.122 -177.246 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.81 -26.25 65.98 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.76 -178.212 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLN . . . . . 0.734 ' OE1' ' HB ' ' A' ' 72' ' ' THR . 6.3 mp0 -67.29 -38.83 85.65 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.936 0.398 . . . . 0.0 111.444 -179.332 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.1 mp -81.51 -10.48 59.47 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.513 -179.0 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 55.01 46.74 23.64 Favored 'General case' 0 C--N 1.347 0.474 0 CA-C-O 121.971 0.891 . . . . 0.0 109.785 -179.029 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 5.6 ptm -76.04 -141.22 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 114.703 -1.135 . . . . 0.0 112.048 -176.9 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.562 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 11.9 pt-20 -160.74 152.07 19.19 Favored 'General case' 0 CA--C 1.508 -0.641 0 O-C-N 121.673 -0.642 . . . . 0.0 109.367 -176.451 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -59.01 142.97 49.75 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.285 0.564 . . . . 0.0 111.163 173.815 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 71.56 15.63 6.03 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 124.14 0.976 . . . . 0.0 111.175 179.185 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.562 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 3.6 t0 -70.98 158.92 35.68 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.811 0.339 . . . . 0.0 110.131 179.261 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 27.3 m -108.31 126.51 52.92 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.616 0.722 . . . . 0.0 112.562 -176.428 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 44.7 mm -89.75 133.85 30.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.118 176.891 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -93.85 114.44 26.68 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 120.769 0.318 . . . . 0.0 110.605 -178.028 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 92.5 t -112.55 137.19 46.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-O 121.096 0.474 . . . . 0.0 110.533 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.7 p90 -139.64 154.1 47.46 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.109 -179.325 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -80.35 111.51 16.81 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.465 0.65 . . . . 0.0 111.691 -176.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 77.1 mm-40 . . . . . 0 C--N 1.313 -0.992 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.029 177.618 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 50.2 p-80 . . . . . 0 N--CA 1.447 -0.576 0 CA-C-O 121.369 0.605 . . . . 0.0 112.027 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 38.9 pt -132.2 170.53 19.71 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.653 178.434 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.486 HD21 ' HB3' ' A' ' 31' ' ' GLN . 16.6 t-20 -104.57 129.64 52.63 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 121.02 0.438 . . . . 0.0 110.797 -179.819 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.432 HD23 HG12 ' A' ' 34' ' ' ILE . 3.0 mm? -123.1 135.18 54.27 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 176.481 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.411 ' HG2' ' HG3' ' A' ' 31' ' ' GLN . 51.5 mtmt -119.86 141.69 49.34 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 -179.625 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.726 HG22 HG13 ' A' ' 84' ' ' ILE . 62.9 t -121.58 131.51 72.91 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 -177.785 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.25 125.71 50.67 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.152 0.501 . . . . 0.0 110.07 -178.231 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.428 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -103.23 156.29 17.97 Favored Glycine 0 N--CA 1.432 -1.576 0 C-N-CA 120.332 -0.937 . . . . 0.0 112.139 -179.92 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.08 -10.9 0.21 Allowed 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 178.912 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -78.31 -21.64 49.35 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.612 0.72 . . . . 0.0 109.854 178.714 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 98.72 24.23 11.08 Favored Glycine 0 N--CA 1.443 -0.84 0 N-CA-C 110.196 -1.161 . . . . 0.0 110.196 -177.84 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.5 t -117.54 131.44 56.7 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.084 -0.558 . . . . 0.0 110.186 -177.785 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.574 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 3.1 p -124.55 142.61 40.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-O 121.317 0.58 . . . . 0.0 110.912 179.26 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.8 t -125.19 140.91 46.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.486 ' HB3' HD21 ' A' ' 19' ' ' ASN . 0.5 OUTLIER -106.28 140.26 39.5 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 120.844 0.354 . . . . 0.0 110.944 -179.675 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 12.5 m-85 . . . . . 0 C--N 1.328 -0.358 0 CA-C-O 120.851 0.358 . . . . 0.0 110.439 -179.043 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.536 HD13 HD23 ' A' ' 43' ' ' LEU . 24.9 pt . . . . . 0 N--CA 1.464 0.26 0 CA-C-O 120.984 0.421 . . . . 0.0 111.314 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 10.6 mptt -80.82 153.73 27.54 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.023 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.5 ptt180 -71.46 -13.95 61.98 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.217 0.532 . . . . 0.0 111.21 -178.571 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -105.75 -5.41 19.92 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 122.16 0.981 . . . . 0.0 108.479 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.498 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.8 m -85.77 130.3 51.29 Favored Pre-proline 0 N--CA 1.427 -1.613 0 CA-C-N 114.594 -1.185 . . . . 0.0 109.776 -179.649 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -61.88 123.01 11.82 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.367 2.045 . . . . 0.0 112.198 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.622 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.3 pp -61.42 -16.56 47.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.707 179.221 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.459 ' N ' HD12 ' A' ' 40' ' ' LEU . 47.9 t -50.15 -35.29 25.42 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 123.34 0.656 . . . . 0.0 111.569 179.309 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -66.59 -42.77 86.43 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 120.985 -0.286 . . . . 0.0 110.902 -178.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.622 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.0 pp -69.98 -33.27 71.84 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.988 0.423 . . . . 0.0 109.991 178.396 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 48.1 mtm -65.75 -48.27 72.44 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.24 0.543 . . . . 0.0 110.731 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 10.8 mmmm -64.31 -38.12 89.9 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 121.002 0.43 . . . . 0.0 110.158 177.756 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.62 -40.59 97.47 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.196 178.35 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -58.26 -54.56 45.65 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.615 178.253 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.612 ' SG ' HD11 ' A' ' 58' ' ' ILE . 31.4 m -58.92 -44.16 91.25 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.881 0.372 . . . . 0.0 110.976 -178.617 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -62.01 -42.42 99.14 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.014 0.375 . . . . 0.0 112.014 -179.35 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -78.8 -36.9 42.07 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.177 0.513 . . . . 0.0 111.732 -177.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.439 ' CB ' HD23 ' A' ' 53' ' ' LEU . 24.9 mm-40 -79.09 -20.38 48.91 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 112.403 0.52 . . . . 0.0 112.403 -177.615 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.51 42.29 6.98 Favored Glycine 0 N--CA 1.429 -1.792 0 C-N-CA 119.926 -1.13 . . . . 0.0 110.856 -177.864 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.439 HD23 ' CB ' ' A' ' 51' ' ' GLN . 4.0 mm? -124.01 163.66 20.94 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.405 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.403 ' HB2' ' HB2' ' A' ' 57' ' ' GLN . 48.6 m -116.59 151.37 36.35 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 178.516 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 10.0 mmt -60.39 -28.01 67.89 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.321 0.581 . . . . 0.0 111.382 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.509 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -84.81 -17.33 38.48 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.529 0.681 . . . . 0.0 110.503 177.923 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.403 ' HB2' ' HB2' ' A' ' 54' ' ' SER . 1.0 OUTLIER -90.43 -22.96 21.17 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.215 -178.277 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.612 HD11 ' SG ' ' A' ' 48' ' ' CYS . 16.1 pt -136.49 177.84 5.73 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 CA-C-O 121.513 0.673 . . . . 0.0 111.944 -178.738 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.445 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 17.0 mmt-85 -151.82 140.01 20.3 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.344 178.126 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -96.18 142.7 28.04 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.249 179.035 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -142.42 144.99 33.34 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-O 121.112 0.482 . . . . 0.0 110.888 -176.822 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.507 ' HB2' HD11 ' A' ' 67' ' ' ILE . 73.1 t80 -150.72 146.1 26.22 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 178.847 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 22.7 t70 56.71 23.42 7.86 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 121.772 0.796 . . . . 0.0 110.836 -178.163 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.01 -19.81 28.41 Favored Glycine 0 N--CA 1.428 -1.84 0 C-N-CA 121.055 -0.593 . . . . 0.0 112.312 -178.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -97.21 149.5 35.78 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-O 120.833 0.349 . . . . 0.0 111.199 -178.189 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.56 142.68 36.81 Favored 'Trans proline' 0 C--O 1.237 0.474 0 C-N-CA 122.651 2.234 . . . . 0.0 112.285 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.507 HD11 ' HB2' ' A' ' 62' ' ' PHE . 23.7 mt -95.69 149.68 4.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.104 0.478 . . . . 0.0 110.16 -179.442 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -127.03 173.01 10.0 Favored 'General case' 0 CA--C 1.5 -0.947 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 178.954 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -75.31 -9.68 58.77 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.399 0.619 . . . . 0.0 110.041 177.62 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 22.1 p -92.22 -4.76 53.66 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.585 -179.084 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -95.76 143.57 26.88 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-O 121.608 0.718 . . . . 0.0 112.229 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.95 152.13 43.43 Favored Pre-proline 0 C--N 1.312 -1.055 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.377 177.354 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.477 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 18.8 Cg_endo -58.64 -29.62 89.79 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.538 2.159 . . . . 0.0 112.251 -177.958 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -77.27 -13.37 59.95 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.952 -178.282 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -76.39 -37.54 57.02 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.374 0.607 . . . . 0.0 110.545 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.464 ' H ' HD12 ' A' ' 76' ' ' LEU . 0.7 OUTLIER -91.15 9.68 30.07 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.99 -179.688 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 44.16 36.87 1.64 Allowed 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.253 1.021 . . . . 0.0 111.857 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.477 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 7.0 ptm -76.36 159.71 30.26 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.554 -178.485 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.559 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 7.4 pt-20 -115.03 167.92 10.38 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.446 -176.705 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.429 ' O ' ' HB2' ' A' ' 81' ' ' GLU . 6.8 p-10 -59.49 144.97 45.66 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-O 121.017 0.436 . . . . 0.0 111.202 175.221 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 80' ' ' ASP . 56.3 mm-40 74.39 14.74 3.6 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.181 0.992 . . . . 0.0 111.7 -179.58 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.559 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 0.6 OUTLIER -74.52 154.23 38.74 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.293 178.627 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 18.1 m -112.33 131.67 55.4 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.597 0.713 . . . . 0.0 112.919 -175.172 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.726 HG13 HG22 ' A' ' 22' ' ' VAL . 22.8 mm -94.92 142.78 12.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.838 178.208 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -101.84 116.14 32.06 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.935 0.398 . . . . 0.0 110.547 179.017 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.445 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 44.7 t -111.19 135.98 48.69 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.085 0 CA-C-O 121.302 0.572 . . . . 0.0 110.91 178.279 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.2 p90 -135.5 160.09 39.55 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.781 -179.103 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -88.47 120.87 30.25 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.411 0.624 . . . . 0.0 111.698 -176.13 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 . . . . . 0 C--N 1.319 -0.747 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.333 177.581 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.517 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 42.5 p-80 . . . . . 0 N--CA 1.436 -1.133 0 CA-C-O 121.363 0.602 . . . . 0.0 110.474 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.419 HD11 ' HB2' ' A' ' 73' ' ' PRO . 35.3 pt -123.33 168.46 15.82 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.563 0 CA-C-O 121.466 0.65 . . . . 0.0 111.211 -176.783 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -105.65 135.86 46.3 Favored 'General case' 0 C--N 1.307 -1.278 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 179.285 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -125.96 134.03 51.64 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.075 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -120.21 141.63 49.74 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.722 HG22 HG13 ' A' ' 84' ' ' ILE . 61.5 t -124.27 134.77 65.75 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.388 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 -176.663 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.72 130.13 55.65 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.035 0.445 . . . . 0.0 110.574 -177.775 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -102.6 174.1 23.41 Favored Glycine 0 N--CA 1.436 -1.341 0 N-CA-C 111.446 -0.662 . . . . 0.0 111.446 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -72.57 -18.73 61.59 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.353 0.597 . . . . 0.0 111.185 -177.691 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -71.11 -16.91 62.59 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.868 177.511 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 96.46 16.37 37.39 Favored Glycine 0 CA--C 1.496 -1.124 0 N-CA-C 110.836 -0.906 . . . . 0.0 110.836 179.11 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.1 m -106.68 132.11 53.05 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 115.257 -0.471 . . . . 0.0 111.032 -177.685 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.563 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.2 p -122.48 139.03 50.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 121.199 0.523 . . . . 0.0 111.292 178.492 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.411 HG11 ' HD3' ' A' ' 50' ' ' ARG . 6.2 t -118.99 137.48 52.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.303 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -104.79 140.49 38.02 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.904 0.383 . . . . 0.0 111.022 -179.063 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.448 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 15.1 m-85 . . . . . 0 N--CA 1.465 0.303 0 CA-C-O 121.01 0.433 . . . . 0.0 110.974 -178.775 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 36.8 pt . . . . . 0 N--CA 1.466 0.372 0 CA-C-O 120.762 0.315 . . . . 0.0 110.514 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.517 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 30.8 mtmm -78.26 154.14 31.24 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.808 0.337 . . . . 0.0 110.69 178.148 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -69.03 -18.13 63.99 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.084 0.468 . . . . 0.0 111.024 -179.26 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 -102.51 1.78 35.5 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.833 0.825 . . . . 0.0 109.045 -179.087 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 m -96.24 133.48 24.95 Favored Pre-proline 0 N--CA 1.437 -1.119 0 CA-C-N 114.959 -1.018 . . . . 0.0 109.569 179.138 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -65.97 134.88 38.76 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.517 2.145 . . . . 0.0 112.63 -177.545 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.606 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -68.55 -16.04 63.74 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -178.863 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.503 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 3.8 p -50.99 -31.31 17.61 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.8 mtpt -61.39 -47.88 83.82 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.241 0.543 . . . . 0.0 110.084 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.6 pp -73.93 -32.32 63.46 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.78 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 46.0 mtm -64.55 -45.47 86.97 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 121.19 0.519 . . . . 0.0 110.743 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? -69.86 -34.94 74.27 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.401 178.276 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.06 -37.38 87.22 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.308 0.575 . . . . 0.0 109.801 179.387 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -59.92 -55.55 32.71 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.907 177.227 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.68 ' SG ' HD11 ' A' ' 58' ' ' ILE . 33.1 m -60.46 -44.32 96.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.403 -178.098 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -66.4 -31.51 72.32 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -177.597 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.411 ' HD3' HG11 ' A' ' 30' ' ' VAL . 11.6 ptm180 -87.02 -36.68 18.07 Favored 'General case' 0 C--N 1.328 -0.352 0 O-C-N 121.853 -0.529 . . . . 0.0 111.095 178.793 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -77.79 -22.46 50.1 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-O 121.148 0.499 . . . . 0.0 112.041 -177.643 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.18 38.76 6.64 Favored Glycine 0 N--CA 1.434 -1.479 0 C-N-CA 120.386 -0.911 . . . . 0.0 111.523 -179.088 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -121.09 159.63 25.35 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.124 0.487 . . . . 0.0 110.32 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.473 ' HB2' ' HB2' ' A' ' 57' ' ' GLN . 51.1 m -108.8 148.21 30.89 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 178.201 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.9 mmt -58.35 -30.18 66.54 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-O 121.16 0.505 . . . . 0.0 111.626 179.019 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.458 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.68 -10.56 55.51 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.136 0.493 . . . . 0.0 111.662 178.35 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.473 ' HB2' ' HB2' ' A' ' 54' ' ' SER . 1.3 mp0 -98.24 -17.19 19.09 Favored 'General case' 0 CA--C 1.504 -0.809 0 CA-C-O 120.96 0.41 . . . . 0.0 111.497 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.68 HD11 ' SG ' ' A' ' 48' ' ' CYS . 17.0 pt -139.68 179.18 2.98 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 CA-C-O 120.937 0.398 . . . . 0.0 110.506 179.235 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.494 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 19.6 mmt-85 -154.43 144.74 22.07 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.097 0.475 . . . . 0.0 111.03 177.473 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -100.22 141.81 32.55 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.262 178.926 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -142.22 138.9 31.79 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-O 121.155 0.502 . . . . 0.0 110.701 -177.084 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.497 ' HB2' HD11 ' A' ' 67' ' ' ILE . 71.5 t80 -146.16 147.45 31.51 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 179.717 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 54.93 24.48 5.89 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.172 0.589 . . . . 0.0 111.524 -179.174 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.84 3.3 90.63 Favored Glycine 0 N--CA 1.442 -0.961 0 C-N-CA 120.652 -0.785 . . . . 0.0 113.177 179.335 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -121.88 151.49 57.91 Favored Pre-proline 0 C--N 1.317 -0.84 0 O-C-N 121.846 -0.797 . . . . 0.0 110.798 178.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.56 141.24 54.68 Favored 'Trans proline' 0 N--CA 1.459 -0.542 0 C-N-CA 122.259 1.973 . . . . 0.0 111.121 177.599 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.497 HD11 ' HB2' ' A' ' 62' ' ' PHE . 45.7 mt -90.63 145.01 7.94 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.94 0 CA-C-O 120.816 0.341 . . . . 0.0 110.102 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -111.92 157.53 20.55 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 178.034 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.503 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 16.9 pt-20 -71.01 -19.56 62.5 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 121.644 0.735 . . . . 0.0 110.019 179.257 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.2 p -91.27 5.97 47.08 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.878 -178.813 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -93.35 151.53 19.71 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-O 121.001 0.429 . . . . 0.0 110.365 -178.448 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.509 ' HB ' ' OE1' ' A' ' 75' ' ' GLN . 1.7 m -118.62 140.16 27.99 Favored Pre-proline 0 C--N 1.316 -0.867 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.556 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.519 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 12.4 Cg_endo -52.55 -32.28 52.87 Favored 'Trans proline' 0 C--N 1.355 0.872 0 C-N-CA 123.657 2.905 . . . . 0.0 113.146 -176.294 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.43 -20.82 64.67 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.098 -177.675 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLN . . . . . 0.509 ' OE1' ' HB ' ' A' ' 72' ' ' THR . 1.6 mp0 -73.4 -37.35 65.99 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.919 0.39 . . . . 0.0 111.096 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.437 ' H ' HD12 ' A' ' 76' ' ' LEU . 1.0 OUTLIER -88.43 -2.91 58.86 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.92 0.39 . . . . 0.0 110.541 -178.146 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 58.5 34.14 23.68 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.343 0.592 . . . . 0.0 110.884 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.519 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.7 ptm -75.35 160.07 30.71 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.74 -178.573 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -116.4 168.26 10.31 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.582 -175.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -60.95 141.16 57.5 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.774 0.797 . . . . 0.0 111.636 177.429 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 70.12 17.98 7.13 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.412 -1.267 . . . . 0.0 112.609 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -70.03 156.83 38.59 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 176.332 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 10.5 m -107.83 132.33 53.53 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -174.055 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.722 HG13 HG22 ' A' ' 22' ' ' VAL . 20.8 mm -97.08 142.67 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.555 178.465 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -100.42 117.96 35.67 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 120.637 0.256 . . . . 0.0 110.406 178.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.494 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 47.9 t -112.92 132.92 60.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 CA-C-O 121.124 0.487 . . . . 0.0 110.346 176.069 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 16.6 p90 -131.65 149.04 52.63 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.938 -178.985 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -73.92 111.34 8.98 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.242 0.544 . . . . 0.0 111.344 -178.559 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.466 ' H ' ' HA ' ' A' ' 58' ' ' ILE . 8.9 mm-40 . . . . . 0 C--N 1.314 -0.963 0 CA-C-O 121.357 0.599 . . . . 0.0 110.444 176.804 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 52.5 p-80 . . . . . 0 N--CA 1.445 -0.705 0 CA-C-O 121.39 0.614 . . . . 0.0 111.757 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.457 HG13 HD21 ' A' ' 20' ' ' LEU . 32.1 pt -130.87 170.75 19.03 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.297 -179.176 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.429 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 26.3 t-20 -107.12 125.09 50.62 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 116.272 -0.422 . . . . 0.0 109.862 179.181 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.468 HD23 HG12 ' A' ' 34' ' ' ILE . 2.7 mm? -114.72 141.66 47.53 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.824 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -128.37 142.24 51.18 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 -178.859 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.745 HG22 HG13 ' A' ' 84' ' ' ILE . 57.7 t -122.79 132.75 70.7 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.364 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 -178.049 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.47 124.58 47.96 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 -179.211 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.516 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -102.66 169.13 19.0 Favored Glycine 0 N--CA 1.431 -1.643 0 C-N-CA 120.086 -1.054 . . . . 0.0 112.737 -178.306 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -61.43 -5.6 1.82 Allowed 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.205 0.602 . . . . 0.0 112.514 178.835 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -86.36 -21.66 27.09 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.62 0.724 . . . . 0.0 109.683 178.505 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 104.73 -16.46 47.46 Favored Glycine 0 CA--C 1.491 -1.409 0 N-CA-C 109.957 -1.257 . . . . 0.0 109.957 -178.989 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.9 m -76.72 131.91 39.02 Favored 'General case' 0 N--CA 1.429 -1.516 0 CA-C-N 114.639 -0.781 . . . . 0.0 111.233 -178.395 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.504 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.1 p -122.17 140.81 44.92 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.896 178.892 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.466 HG11 ' HD3' ' A' ' 50' ' ' ARG . 10.9 t -121.99 138.46 52.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 -179.192 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -107.18 140.11 40.56 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.041 0.448 . . . . 0.0 111.139 -179.888 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.496 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 15.5 m-85 . . . . . 0 C--N 1.328 -0.344 0 CA-C-O 121.128 0.49 . . . . 0.0 110.727 -177.966 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.468 HG12 HD23 ' A' ' 20' ' ' LEU . 24.5 pt . . . . . 0 N--CA 1.465 0.309 0 CA-C-O 121.052 0.453 . . . . 0.0 110.933 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 7.1 mtmp? -80.92 144.87 31.6 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 120.81 0.338 . . . . 0.0 110.693 178.875 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -68.73 -14.12 62.82 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.186 0.517 . . . . 0.0 111.475 -177.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 -101.76 -3.27 28.4 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-O 122.247 1.022 . . . . 0.0 108.367 -178.603 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.463 ' HB ' ' O ' ' A' ' 35' ' ' LYS . 1.5 m -93.96 140.33 22.91 Favored Pre-proline 0 N--CA 1.437 -1.082 0 CA-C-N 114.244 -1.343 . . . . 0.0 110.796 -178.715 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.557 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 35.5 Cg_endo -59.71 126.11 19.64 Favored 'Trans proline' 0 C--O 1.238 0.478 0 C-N-CA 122.98 2.453 . . . . 0.0 112.29 -179.346 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.657 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.9 OUTLIER -69.92 -16.55 63.24 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.378 0.609 . . . . 0.0 111.346 179.579 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.474 ' N ' HD12 ' A' ' 40' ' ' LEU . 0.7 OUTLIER -50.53 -31.79 16.57 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 123.919 0.887 . . . . 0.0 111.742 -179.597 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.557 ' HE3' ' HG2' ' A' ' 39' ' ' PRO . 90.6 mttt -59.08 -50.63 73.34 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.431 0.634 . . . . 0.0 109.982 179.293 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.657 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.7 pp -70.17 -32.25 70.12 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.049 -178.845 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 45.2 mtm -64.71 -50.63 66.18 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 120.786 0.327 . . . . 0.0 111.305 -178.555 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.474 ' HA ' ' SG ' ' A' ' 48' ' ' CYS . 24.4 mmmt -65.61 -33.81 76.76 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 120.911 0.386 . . . . 0.0 110.469 178.104 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.77 -37.5 87.82 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.136 0.493 . . . . 0.0 109.979 178.505 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -60.08 -56.41 21.96 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.464 177.929 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.474 ' SG ' ' HA ' ' A' ' 45' ' ' LYS . 24.5 p -61.88 -35.63 78.89 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 111.814 0.301 . . . . 0.0 111.814 -178.167 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 48.3 mt-10 -66.72 -43.52 84.06 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 122.214 -0.303 . . . . 0.0 111.525 179.59 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.466 ' HD3' HG11 ' A' ' 30' ' ' VAL . 14.0 ptm180 -76.66 -37.28 56.52 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.117 0.484 . . . . 0.0 111.483 -178.653 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.505 ' HB3' HD23 ' A' ' 53' ' ' LEU . 21.1 mm-40 -74.29 -21.92 59.52 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 120.967 0.413 . . . . 0.0 111.914 -178.561 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.96 42.14 7.78 Favored Glycine 0 N--CA 1.428 -1.882 0 C-N-CA 119.767 -1.206 . . . . 0.0 110.995 -177.318 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.505 HD23 ' HB3' ' A' ' 51' ' ' GLN . 4.0 mm? -125.05 167.0 15.37 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 51.1 m -116.88 151.67 36.11 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 178.076 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.3 mmt -59.62 -28.12 66.93 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-O 121.197 0.522 . . . . 0.0 111.779 178.481 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.498 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -84.67 -13.87 50.2 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.58 0.705 . . . . 0.0 110.587 177.646 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -93.48 -17.2 23.7 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.026 -178.618 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 14.3 pt -141.49 179.66 2.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 121.176 0.512 . . . . 0.0 111.426 -179.163 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.469 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 6.1 mmt180 -155.23 140.23 17.35 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.689 177.725 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -97.83 143.02 28.87 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.732 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? -141.8 135.98 30.2 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.556 0.693 . . . . 0.0 111.402 -178.297 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.459 ' HB2' HD11 ' A' ' 67' ' ' ILE . 78.6 t80 -142.87 146.93 34.57 Favored 'General case' 0 N--CA 1.433 -1.302 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 177.343 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.4 ' C ' ' H ' ' A' ' 65' ' ' GLN . 13.0 t70 50.45 40.69 23.69 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 121.254 0.549 . . . . 0.0 109.906 -176.639 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 66.2 -20.9 0.17 Allowed Glycine 0 CA--C 1.532 1.152 0 N-CA-C 115.462 0.945 . . . . 0.0 115.462 -176.637 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.4 ' H ' ' C ' ' A' ' 63' ' ' ASP . 3.6 pt20 -92.81 147.11 33.43 Favored Pre-proline 0 C--N 1.316 -0.867 0 CA-C-N 117.516 0.658 . . . . 0.0 110.944 -177.597 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -69.68 142.51 48.46 Favored 'Trans proline' 0 N--CA 1.452 -0.919 0 C-N-CA 122.146 1.898 . . . . 0.0 110.912 179.34 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.459 HD11 ' HB2' ' A' ' 62' ' ' PHE . 34.4 mt -91.52 144.12 9.86 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.184 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 -178.727 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -121.42 162.7 19.97 Favored 'General case' 0 CA--C 1.499 -0.986 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -178.834 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -72.73 -13.75 61.4 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 121.244 0.545 . . . . 0.0 110.49 178.339 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 22.0 p -95.07 4.7 53.43 Favored 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 179.646 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -105.45 154.61 20.1 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.4 0.619 . . . . 0.0 112.01 178.719 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.46 155.49 48.52 Favored Pre-proline 0 C--N 1.319 -0.738 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.978 177.724 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.615 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 13.2 Cg_endo -57.28 -30.92 89.29 Favored 'Trans proline' 0 C--O 1.236 0.381 0 C-N-CA 122.835 2.357 . . . . 0.0 112.253 -179.329 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.95 -16.57 60.64 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.75 -178.683 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -73.2 -39.64 65.4 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.375 0.607 . . . . 0.0 110.314 178.621 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.456 HD13 ' SD ' ' A' ' 78' ' ' MET . 1.1 mp -86.05 -2.57 58.44 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.682 179.047 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 59.33 30.84 20.62 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.261 179.077 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.615 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 5.7 ptm -76.55 168.21 20.48 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.031 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -136.59 -178.62 5.25 Favored 'General case' 0 C--N 1.313 -1.004 0 O-C-N 122.167 -0.333 . . . . 0.0 110.65 -177.12 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.431 ' O ' ' HB2' ' A' ' 81' ' ' GLU . 8.0 p-10 -61.56 141.08 57.99 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.553 0.692 . . . . 0.0 112.121 179.174 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.431 ' HB2' ' O ' ' A' ' 80' ' ' ASP . 4.6 mm-40 80.31 15.93 0.73 Allowed 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.278 1.431 . . . . 0.0 111.531 178.798 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.412 ' OD2' HD12 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -62.24 146.11 51.76 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.857 176.897 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 17.6 m -114.17 111.73 22.04 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-O 121.822 0.82 . . . . 0.0 112.332 175.815 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.745 HG13 HG22 ' A' ' 22' ' ' VAL . 14.3 mm -80.82 144.39 10.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 114.955 -1.021 . . . . 0.0 109.741 179.283 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -107.43 123.48 48.46 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 120.962 0.411 . . . . 0.0 110.982 178.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.516 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 86.7 t -113.46 139.04 40.95 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-O 121.205 0.526 . . . . 0.0 110.998 177.954 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.6 p90 -133.61 150.12 51.6 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.052 179.34 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.0 tp60 -74.55 127.53 33.31 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.741 0.782 . . . . 0.0 112.102 -177.35 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.465 ' HG3' ' HG2' ' A' ' 59' ' ' ARG . 28.2 mm-40 . . . . . 0 C--N 1.315 -0.933 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.563 176.365 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.423 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 6.0 t-160 . . . . . 0 CA--C 1.493 -1.247 0 CA-C-O 122.139 0.971 . . . . 0.0 108.853 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 45.2 pt -121.52 170.55 11.48 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.215 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.952 -173.564 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -105.5 135.43 46.91 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.37 178.933 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.409 HD23 HG12 ' A' ' 34' ' ' ILE . 3.1 mm? -127.25 134.42 50.07 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 177.784 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -118.51 146.54 44.46 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-O 121.23 0.538 . . . . 0.0 110.14 179.579 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.571 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 4.8 p -125.09 128.93 73.32 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.897 0 CA-C-N 116.108 -0.497 . . . . 0.0 109.992 -179.705 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -119.52 131.34 55.54 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.223 0.535 . . . . 0.0 109.906 -178.475 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -107.08 158.02 15.3 Favored Glycine 0 N--CA 1.432 -1.615 0 C-N-CA 120.41 -0.9 . . . . 0.0 111.355 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.19 -18.71 6.3 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 177.84 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -69.26 -21.88 63.87 Favored 'General case' 0 C--O 1.224 -0.288 0 O-C-N 121.961 -0.462 . . . . 0.0 110.574 177.6 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 103.79 2.77 46.25 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.043 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.0 t -93.7 159.39 15.23 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 179.213 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.571 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.6 p -148.97 136.91 14.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.05 0.452 . . . . 0.0 110.662 -179.445 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.8 t -118.93 135.54 59.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -106.72 143.14 35.25 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.824 0.345 . . . . 0.0 110.733 -179.384 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.564 ' HE1' HG12 ' A' ' 22' ' ' VAL . 14.0 m-85 . . . . . 0 N--CA 1.467 0.392 0 CA-C-O 121.167 0.508 . . . . 0.0 110.83 -178.666 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.409 HG12 HD23 ' A' ' 20' ' ' LEU . 19.4 pt . . . . . 0 N--CA 1.457 -0.111 0 CA-C-O 121.1 0.476 . . . . 0.0 110.826 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.423 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 32.7 mtmm -83.51 150.33 26.06 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 176.87 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -71.73 -11.07 60.64 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.269 0.556 . . . . 0.0 111.082 -178.724 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 18.8 t60 -99.16 -2.01 37.93 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.535 0.683 . . . . 0.0 109.636 -178.223 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -99.33 148.17 34.29 Favored Pre-proline 0 N--CA 1.442 -0.864 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.006 -178.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -65.12 131.53 28.91 Favored 'Trans proline' 0 C--O 1.239 0.553 0 C-N-CA 122.582 2.188 . . . . 0.0 112.509 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.486 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.2 pp -70.28 -16.93 63.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.131 0.491 . . . . 0.0 111.628 179.444 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.486 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 9.0 p -53.16 -28.25 25.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.076 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.0 mtmt -66.1 -42.98 88.55 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 120.861 0.362 . . . . 0.0 110.907 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.7 pp -71.89 -34.3 69.05 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 121.17 0.509 . . . . 0.0 109.794 178.382 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 47.9 mtm -65.07 -46.62 80.39 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 120.997 0.427 . . . . 0.0 110.722 -179.011 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.488 ' HA ' ' SG ' ' A' ' 48' ' ' CYS . 80.8 mttt -66.76 -36.15 81.77 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 120.855 0.36 . . . . 0.0 110.796 177.956 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.463 ' O ' ' HG2' ' A' ' 50' ' ' ARG . . . -63.34 -37.88 88.98 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.232 0.539 . . . . 0.0 109.666 178.732 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -61.14 -56.4 21.28 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.945 178.239 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.488 ' SG ' ' HA ' ' A' ' 45' ' ' LYS . 24.3 p -62.52 -38.65 90.8 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.727 0.298 . . . . 0.0 111.436 -177.435 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -65.95 -37.4 85.93 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 -179.808 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ARG . . . . . 0.463 ' HG2' ' O ' ' A' ' 46' ' ' ALA . 14.7 ptm180 -83.26 -33.25 26.07 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 121.87 -0.519 . . . . 0.0 111.438 -179.656 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.405 ' HB3' HD23 ' A' ' 53' ' ' LEU . 15.8 mm100 -78.61 -21.85 47.89 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-O 120.998 0.428 . . . . 0.0 112.053 -178.945 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.71 39.83 7.46 Favored Glycine 0 N--CA 1.433 -1.531 0 C-N-CA 120.167 -1.016 . . . . 0.0 111.24 -178.638 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.405 HD23 ' HB3' ' A' ' 51' ' ' GLN . 3.4 mm? -126.37 168.2 14.48 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.013 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.6 m -120.61 157.22 30.01 Favored 'General case' 0 C--N 1.312 -1.041 0 O-C-N 122.264 -0.273 . . . . 0.0 110.647 179.038 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 15.5 mmt -63.13 -26.76 68.97 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.422 0.63 . . . . 0.0 111.457 179.485 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.493 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.53 -12.99 50.34 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 121.548 0.689 . . . . 0.0 110.437 177.74 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -96.48 -26.03 15.44 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.911 -178.017 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.3 pt -135.29 176.37 8.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 120.819 0.342 . . . . 0.0 110.714 -179.028 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.413 ' HD3' ' HA ' ' A' ' 59' ' ' ARG . 17.4 mmt180 -152.88 146.57 25.12 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.209 0.528 . . . . 0.0 111.07 179.018 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -104.6 143.25 33.32 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.439 -177.815 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.445 ' HG2' ' O ' ' A' ' 65' ' ' GLN . 7.7 tmm_? -143.03 141.31 31.29 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-O 121.172 0.511 . . . . 0.0 110.859 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.536 ' HB2' HD11 ' A' ' 67' ' ' ILE . 69.5 t80 -146.8 147.42 30.87 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 178.45 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 24.8 t70 58.59 23.19 10.62 Favored 'General case' 0 N--CA 1.483 1.182 0 CA-C-O 121.869 0.842 . . . . 0.0 110.728 -178.199 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.2 1.32 85.48 Favored Glycine 0 N--CA 1.428 -1.835 0 C-N-CA 120.939 -0.648 . . . . 0.0 112.849 -179.213 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.445 ' O ' ' HG2' ' A' ' 61' ' ' ARG . 12.0 pt20 -116.72 147.44 39.9 Favored Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 122.148 -0.619 . . . . 0.0 110.599 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -67.62 141.05 53.71 Favored 'Trans proline' 0 C--O 1.237 0.431 0 C-N-CA 122.602 2.202 . . . . 0.0 111.824 -179.329 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.536 HD11 ' HB2' ' A' ' 62' ' ' PHE . 24.1 mt -98.79 141.24 16.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-O 121.049 0.452 . . . . 0.0 110.088 -179.183 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -112.39 170.61 8.05 Favored 'General case' 0 CA--C 1.497 -1.08 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 177.201 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.486 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 8.9 pt-20 -73.76 -17.01 61.15 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.564 0.697 . . . . 0.0 110.119 177.85 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 17.6 p -82.96 -21.62 33.97 Favored 'General case' 0 N--CA 1.434 -1.225 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.707 -177.574 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.64 154.08 32.55 Favored 'General case' 0 N--CA 1.437 -1.11 0 N-CA-C 112.999 0.741 . . . . 0.0 112.999 -178.079 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.412 ' OG1' ' HG2' ' A' ' 75' ' ' GLN . 0.9 OUTLIER -115.31 154.22 47.5 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.892 175.5 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_endo -57.88 -29.3 85.85 Favored 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.981 2.454 . . . . 0.0 111.915 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.83 -20.24 60.51 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.673 -178.296 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLN . . . . . 0.412 ' HG2' ' OG1' ' A' ' 72' ' ' THR . 27.4 mm-40 -69.52 -37.06 76.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.363 0.602 . . . . 0.0 111.146 179.6 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.438 ' H ' HD12 ' A' ' 76' ' ' LEU . 1.1 mp -88.76 -2.15 58.45 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.204 -178.677 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 53.87 38.14 28.04 Favored 'General case' 0 C--N 1.345 0.388 0 CA-C-O 121.772 0.796 . . . . 0.0 110.985 179.351 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.1 ptm -77.79 169.49 18.2 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.631 -178.543 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -117.68 169.15 9.81 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -177.781 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -62.58 142.63 57.92 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 121.64 0.733 . . . . 0.0 111.439 176.481 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 74.71 16.77 3.03 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 124.847 1.259 . . . . 0.0 111.953 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.69 155.4 40.58 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.769 0.318 . . . . 0.0 110.276 176.365 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 84.3 m -111.0 132.15 54.45 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.696 0.76 . . . . 0.0 112.708 -175.543 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.429 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 41.5 mm -96.7 141.93 14.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.341 -0.845 . . . . 0.0 108.906 177.651 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -103.51 124.12 48.17 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 120.957 0.408 . . . . 0.0 110.919 179.233 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 99.0 t -115.28 136.16 52.94 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-O 121.264 0.555 . . . . 0.0 111.113 178.797 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.4 p90 -135.98 152.95 51.47 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.916 -179.446 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -80.04 113.91 18.57 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.339 0.59 . . . . 0.0 112.504 -176.555 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.401 ' HG3' ' CG ' ' A' ' 59' ' ' ARG . 15.0 mm100 . . . . . 0 C--N 1.318 -0.787 0 CA-C-O 121.359 0.599 . . . . 0.0 111.303 176.517 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' HIS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 55.8 p-80 . . . . . 0 N--CA 1.438 -1.065 0 CA-C-O 121.069 0.461 . . . . 0.0 111.042 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 36.5 pt -131.66 164.02 35.69 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-O 121.376 0.608 . . . . 0.0 111.037 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -96.11 136.92 35.93 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.377 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.487 HD23 HG12 ' A' ' 34' ' ' ILE . 3.0 mm? -129.75 139.66 51.25 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 176.837 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -125.03 144.98 50.12 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-O 121.213 0.53 . . . . 0.0 110.305 -179.354 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.604 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 5.2 p -122.72 132.06 72.02 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.532 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.551 -178.496 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.1 119.07 33.64 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.376 0.608 . . . . 0.0 110.151 -179.059 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -96.33 146.5 18.29 Favored Glycine 0 N--CA 1.428 -1.854 0 C-N-CA 120.836 -0.697 . . . . 0.0 111.493 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.486 ' HG3' ' O ' ' A' ' 86' ' ' VAL . 0.0 OUTLIER -53.29 -16.36 1.28 Allowed 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 178.866 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -71.91 -21.37 61.64 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.206 0.527 . . . . 0.0 110.394 177.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 103.71 27.22 6.45 Favored Glycine 0 N--CA 1.443 -0.855 0 N-CA-C 110.651 -0.98 . . . . 0.0 110.651 -178.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.1 p -122.01 131.84 54.21 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-O 120.977 0.418 . . . . 0.0 111.475 -178.296 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.604 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.4 p -124.08 137.1 58.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 121.161 0.505 . . . . 0.0 111.525 178.882 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.1 t -120.79 137.16 55.45 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 179.047 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -107.15 144.16 34.28 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.934 0.397 . . . . 0.0 111.265 -179.394 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.527 ' HE1' HG12 ' A' ' 22' ' ' VAL . 10.6 m-85 . . . . . 0 N--CA 1.466 0.358 0 CA-C-O 121.282 0.563 . . . . 0.0 110.982 -178.72 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.487 HG12 HD23 ' A' ' 20' ' ' LEU . 33.7 pt . . . . . 0 CA--C 1.516 -0.337 0 CA-C-O 120.829 0.347 . . . . 0.0 110.44 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.511 ' HB2' ' OG1' ' A' ' 38' ' ' THR . 0.0 OUTLIER -79.39 151.74 30.77 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.184 0.516 . . . . 0.0 110.919 179.584 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 36' ' ' ARG . 5.9 ptt180 -67.05 -18.0 65.15 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.384 0.611 . . . . 0.0 110.723 179.258 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 59.8 t60 -102.93 -3.5 26.06 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 122.186 0.993 . . . . 0.0 108.897 -177.615 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.511 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 2.3 m -90.16 136.01 29.26 Favored Pre-proline 0 C--N 1.306 -1.311 0 CA-C-N 114.502 -1.227 . . . . 0.0 110.473 -178.711 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.45 125.26 15.26 Favored 'Trans proline' 0 C--O 1.24 0.578 0 C-N-CA 122.447 2.098 . . . . 0.0 111.979 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.485 HD12 ' N ' ' A' ' 41' ' ' SER . 1.2 pp -62.61 -17.34 60.04 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.445 0.64 . . . . 0.0 111.303 179.247 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.485 ' N ' HD12 ' A' ' 40' ' ' LEU . 0.7 OUTLIER -51.42 -29.49 16.1 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 124.11 0.964 . . . . 0.0 111.37 179.312 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -62.85 -49.1 76.2 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.618 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.8 pp -68.83 -34.78 76.07 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 120.968 0.413 . . . . 0.0 110.058 179.57 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 48.1 mtm -61.36 -45.92 92.39 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 121.059 0.457 . . . . 0.0 110.447 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.688 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 7.9 mtpm? -69.28 -40.44 77.75 Favored 'General case' 0 C--O 1.212 -0.897 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.642 177.802 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.64 -40.17 82.66 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-O 121.444 0.64 . . . . 0.0 109.83 -179.23 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 58.8 t80 -56.89 -55.67 31.56 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.224 176.547 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.664 ' SG ' HD11 ' A' ' 58' ' ' ILE . 21.7 m -61.16 -39.94 91.98 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.87 0.367 . . . . 0.0 110.698 -179.231 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.688 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 69.2 mm-40 -58.75 -49.91 75.89 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 121.274 0.559 . . . . 0.0 111.098 178.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 -77.71 -36.83 50.61 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.805 -176.187 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.465 ' HB3' HD23 ' A' ' 53' ' ' LEU . 14.9 mm100 -76.25 -22.14 55.51 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -177.506 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.401 ' C ' HD22 ' A' ' 53' ' ' LEU . . . 85.22 42.52 7.0 Favored Glycine 0 N--CA 1.431 -1.659 0 C-N-CA 119.523 -1.323 . . . . 0.0 110.782 -176.518 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.465 HD23 ' HB3' ' A' ' 51' ' ' GLN . 4.1 mm? -125.16 164.15 20.89 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-O 121.149 0.5 . . . . 0.0 110.157 -179.847 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.8 m -117.0 154.15 31.41 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.0 mmt -63.88 -25.59 68.23 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-O 121.336 0.589 . . . . 0.0 111.093 179.022 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.85 -17.89 36.58 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.42 0.628 . . . . 0.0 110.772 177.554 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -88.78 -25.74 22.1 Favored 'General case' 0 CA--C 1.507 -0.697 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.352 -178.012 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.664 HD11 ' SG ' ' A' ' 48' ' ' CYS . 15.1 pt -136.08 -178.02 2.21 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.088 0 CA-C-O 121.022 0.439 . . . . 0.0 111.344 -179.204 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.438 ' HD3' ' HA ' ' A' ' 59' ' ' ARG . 19.3 mmt180 -157.89 146.9 19.46 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.505 177.222 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -102.77 146.34 28.39 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.151 -178.437 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 8.0 tmm_? -143.58 142.32 31.03 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.545 0.688 . . . . 0.0 111.326 -179.559 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.58 ' HB2' HD11 ' A' ' 67' ' ' ILE . 65.7 t80 -148.59 148.11 29.78 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.996 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 18.5 t70 57.59 22.7 8.47 Favored 'General case' 0 N--CA 1.484 1.273 0 CA-C-O 121.667 0.746 . . . . 0.0 110.978 -177.919 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.05 11.61 84.66 Favored Glycine 0 N--CA 1.43 -1.744 0 C-N-CA 120.477 -0.868 . . . . 0.0 112.627 -179.005 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -126.87 147.08 59.77 Favored Pre-proline 0 CA--C 1.534 0.338 0 O-C-N 122.222 -0.575 . . . . 0.0 109.891 178.546 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -66.21 143.34 70.65 Favored 'Trans proline' 0 CA--C 1.532 0.42 0 C-N-CA 122.314 2.01 . . . . 0.0 111.959 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.58 HD11 ' HB2' ' A' ' 62' ' ' PHE . 28.7 mt -97.7 148.84 5.43 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-O 120.95 0.405 . . . . 0.0 110.244 -178.484 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -125.79 169.96 12.08 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 178.93 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -77.19 -8.72 58.02 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-O 121.316 0.579 . . . . 0.0 110.311 177.905 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 41.0 p -91.12 -3.65 56.9 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.34 179.434 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -100.52 148.4 24.83 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.413 0.625 . . . . 0.0 112.173 -179.794 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -111.8 157.26 40.01 Favored Pre-proline 0 C--N 1.323 -0.559 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.766 178.137 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.583 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 18.0 Cg_endo -60.32 -31.24 92.59 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.733 2.289 . . . . 0.0 111.595 178.705 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -77.91 -11.02 59.86 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.555 -179.165 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -71.44 -48.37 49.95 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 121.638 0.732 . . . . 0.0 110.118 -179.465 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.498 ' H ' HD12 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -86.11 0.46 53.45 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.364 -178.169 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 51.98 44.17 29.71 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 121.731 0.777 . . . . 0.0 110.674 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.583 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.0 ptm -76.35 158.81 31.1 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.956 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -108.84 167.11 10.31 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-O 120.804 0.335 . . . . 0.0 110.577 -176.008 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -52.08 137.63 27.11 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.326 0.584 . . . . 0.0 111.443 174.517 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 67.65 23.76 8.66 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.083 -0.962 . . . . 0.0 112.482 178.084 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.98 150.41 47.72 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 175.307 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 28.8 m -106.31 126.75 52.62 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 121.558 0.694 . . . . 0.0 112.807 -174.646 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.439 HD11 ' HE1' ' A' ' 78' ' ' MET . 42.0 mm -93.06 140.93 15.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 176.814 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -106.36 123.33 47.9 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-O 121.054 0.454 . . . . 0.0 110.916 179.102 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.486 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 85.9 t -111.38 137.08 45.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.029 0.442 . . . . 0.0 111.193 179.682 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.2 p90 -134.3 152.87 52.05 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.855 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -77.31 118.56 19.91 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.516 0.674 . . . . 0.0 111.507 -178.106 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.434 ' HG3' ' CG ' ' A' ' 59' ' ' ARG . 55.5 mm-40 . . . . . 0 C--N 1.313 -0.998 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.075 178.017 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.9 tpt . . . . . 0 N--CA 1.479 0.975 0 CA-C-O 120.697 0.284 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.543 ' HA ' ' O ' ' A' ' 5' ' ' LYS . . . -78.38 -8.58 58.61 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 121.701 -0.624 . . . . 0.0 111.637 -178.025 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -83.24 -2.2 55.0 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.714 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -136.27 -29.52 0.98 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.162 0.506 . . . . 0.0 111.366 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.543 ' O ' ' HA ' ' A' ' 2' ' ' ALA . 59.2 tttp -136.95 129.93 17.37 Favored Pre-proline 0 C--N 1.314 -0.937 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -64.94 171.77 8.23 Favored 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.42 2.08 . . . . 0.0 111.758 177.101 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.518 ' HD2' ' H ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -70.55 -3.91 20.39 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.109 178.424 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -66.44 162.96 19.39 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 121.142 0.496 . . . . 0.0 110.897 -178.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -90.81 -67.45 1.18 Allowed Glycine 0 N--CA 1.437 -1.294 0 C-N-CA 120.415 -0.898 . . . . 0.0 111.912 -177.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 38.3 t -98.75 108.12 21.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 120.952 0.406 . . . . 0.0 111.277 -178.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.453 ' HD3' ' HA ' ' A' ' 11' ' ' LYS . 24.0 mmtp -150.58 143.95 24.98 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 121.029 0.442 . . . . 0.0 109.959 176.443 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.6 t -154.35 158.9 40.79 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.153 -177.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -132.97 75.61 1.63 Allowed 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.128 0.49 . . . . 0.0 110.214 178.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -87.2 12.14 12.41 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-O 121.6 0.714 . . . . 0.0 109.794 178.581 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 -61.87 170.82 1.89 Allowed 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.275 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -84.37 90.75 7.64 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-O 121.801 0.81 . . . . 0.0 109.191 -178.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.559 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 43.7 p-80 -109.8 134.44 52.03 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.465 -179.268 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 40.5 pt -119.26 162.14 17.75 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.838 0 CA-C-O 121.634 0.73 . . . . 0.0 111.375 -176.202 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.513 ' HA ' ' O ' ' A' ' 32' ' ' PHE . 23.7 t-20 -100.11 132.88 45.21 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.27 178.481 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -122.6 134.56 54.51 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-O 121.102 0.477 . . . . 0.0 109.793 177.523 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.412 ' HG2' ' HG3' ' A' ' 31' ' ' GLN . 48.3 mtmt -117.39 144.41 44.99 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.586 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.695 HG22 HG13 ' A' ' 84' ' ' ILE . 90.5 t -124.86 134.98 65.48 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.705 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -177.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -117.08 130.11 56.43 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.171 0.51 . . . . 0.0 110.819 -178.512 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -101.69 178.32 27.32 Favored Glycine 0 N--CA 1.43 -1.71 0 C-N-CA 121.036 -0.602 . . . . 0.0 111.896 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.472 ' CD ' ' H ' ' A' ' 25' ' ' GLN . 0.3 OUTLIER -60.52 -31.74 70.8 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.76 0.791 . . . . 0.0 110.592 -179.002 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -71.33 -16.0 62.42 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.285 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.31 5.95 69.27 Favored Glycine 0 N--CA 1.446 -0.684 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 -175.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 9.2 t -80.84 126.45 31.36 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.622 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 28.3 t -120.42 138.84 49.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-O 121.272 0.558 . . . . 0.0 110.878 -178.544 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.8 t -122.12 136.85 57.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 177.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.413 ' HB3' HD21 ' A' ' 19' ' ' ASN . 0.2 OUTLIER -104.74 143.82 32.58 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.742 0.306 . . . . 0.0 110.562 -179.586 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.513 ' O ' ' HA ' ' A' ' 19' ' ' ASN . 14.4 m-85 -137.32 151.52 48.72 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 120.808 0.337 . . . . 0.0 110.702 -179.138 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.458 HD13 HD23 ' A' ' 43' ' ' LEU . 36.6 pt -132.28 167.03 27.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 122.06 -0.4 . . . . 0.0 111.007 -178.038 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.559 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 0.0 OUTLIER -80.7 153.28 27.95 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 121.123 0.487 . . . . 0.0 110.641 178.456 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.5 ptt180 -63.43 -19.37 64.64 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.762 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 67.1 t60 -104.3 -3.55 24.07 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 122.161 0.981 . . . . 0.0 108.728 -176.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 m -86.68 132.32 42.81 Favored Pre-proline 0 N--CA 1.43 -1.441 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.96 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -59.91 122.07 10.83 Favored 'Trans proline' 0 C--O 1.239 0.565 0 C-N-CA 122.482 2.121 . . . . 0.0 112.413 -178.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.658 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.9 OUTLIER -63.37 -17.23 62.4 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.375 0.607 . . . . 0.0 111.102 179.075 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.491 ' N ' HD12 ' A' ' 40' ' ' LEU . 0.8 OUTLIER -50.69 -34.68 27.62 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 123.974 0.91 . . . . 0.0 111.211 179.193 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.3 mtpm? -59.15 -51.42 70.11 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.361 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.658 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.3 pp -68.72 -34.54 75.81 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.738 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 48.2 mtm -63.01 -51.18 67.8 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-O 121.152 0.501 . . . . 0.0 110.863 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -66.58 -34.59 78.22 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-O 121.021 0.438 . . . . 0.0 110.932 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.23 -36.52 84.36 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.08 0.467 . . . . 0.0 110.022 177.107 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -59.92 -55.63 31.68 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.672 178.111 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 26.5 p -65.12 -34.98 79.69 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 122.097 -0.377 . . . . 0.0 111.557 -177.098 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -65.89 -38.64 89.3 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.93 0.395 . . . . 0.0 111.751 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -85.27 -30.18 24.0 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.009 0.433 . . . . 0.0 111.165 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -82.66 -21.65 34.91 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -177.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 87.9 40.45 6.66 Favored Glycine 0 N--CA 1.437 -1.272 0 C-N-CA 119.882 -1.152 . . . . 0.0 111.198 -177.621 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.406 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 4.0 mm? -123.34 161.88 23.82 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.879 0.371 . . . . 0.0 110.262 179.374 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.459 ' HB2' ' HB2' ' A' ' 57' ' ' GLN . 48.3 m -114.79 150.07 35.99 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 110.346 -0.242 . . . . 0.0 110.346 178.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.2 mmt -64.44 -23.95 67.46 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.216 0.532 . . . . 0.0 111.508 178.488 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.425 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -84.41 -17.48 39.15 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.306 0.574 . . . . 0.0 110.368 176.922 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.459 ' HB2' ' HB2' ' A' ' 54' ' ' SER . 2.4 mp0 -93.31 -30.13 15.29 Favored 'General case' 0 CA--C 1.507 -0.696 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.896 -178.286 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.7 pt -128.57 178.35 5.06 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.249 0 CA-C-O 121.39 0.614 . . . . 0.0 111.862 -178.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.405 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 15.5 mmt180 -156.55 142.54 18.0 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.394 177.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -97.36 148.3 23.3 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -147.65 134.75 20.39 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-O 121.245 0.545 . . . . 0.0 111.087 -176.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.492 ' HB2' HD11 ' A' ' 67' ' ' ILE . 69.2 t80 -141.41 147.86 38.66 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.44 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 17.3 t70 55.94 23.52 6.71 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-O 121.826 0.822 . . . . 0.0 110.32 -176.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.58 -21.63 21.09 Favored Glycine 0 N--CA 1.423 -2.21 0 CA-C-N 115.7 -0.682 . . . . 0.0 112.638 -179.057 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -95.31 149.07 35.64 Favored Pre-proline 0 C--N 1.324 -0.54 0 O-C-N 122.518 -0.401 . . . . 0.0 111.502 -177.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -70.96 142.95 43.84 Favored 'Trans proline' 0 C--O 1.235 0.351 0 C-N-CA 122.776 2.317 . . . . 0.0 112.138 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.492 HD11 ' HB2' ' A' ' 62' ' ' PHE . 15.9 mt -99.0 147.28 7.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-O 120.983 0.421 . . . . 0.0 110.825 -179.36 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -128.24 172.95 10.56 Favored 'General case' 0 CA--C 1.507 -0.673 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.356 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -75.01 -8.08 55.5 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.235 0.541 . . . . 0.0 110.984 177.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 26.2 p -93.45 -4.17 51.77 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.276 0.56 . . . . 0.0 111.141 178.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -94.68 144.51 25.56 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.487 0.661 . . . . 0.0 112.006 179.652 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -117.46 149.41 44.72 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.686 177.119 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.403 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 17.8 Cg_endo -59.71 -31.32 94.0 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.939 2.426 . . . . 0.0 113.469 -175.057 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.28 -23.05 63.78 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -178.226 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 6.1 mp0 -69.86 -37.35 76.09 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.098 0.475 . . . . 0.0 111.125 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.439 ' H ' HD12 ' A' ' 76' ' ' LEU . 1.2 mp -86.48 -5.21 59.21 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 -178.754 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 55.96 44.48 25.57 Favored 'General case' 0 C--N 1.344 0.332 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.514 179.158 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.403 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 5.8 ptm -86.12 161.35 18.93 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.003 -177.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -112.18 164.94 12.61 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 -178.112 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.452 ' CB ' ' H ' ' A' ' 19' ' ' ASN . 6.2 p-10 -62.48 144.77 55.59 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.654 0.74 . . . . 0.0 112.137 176.565 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 73.82 17.9 3.47 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.282 -1.326 . . . . 0.0 112.109 179.477 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -78.19 164.42 24.95 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 120.303 -0.559 . . . . 0.0 109.731 176.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 21.0 m -114.21 138.15 50.84 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.611 0.72 . . . . 0.0 112.868 -175.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.695 HG13 HG22 ' A' ' 22' ' ' VAL . 19.7 mm -99.18 139.34 21.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.443 -0.798 . . . . 0.0 109.858 178.675 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -98.32 116.78 31.26 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.981 0.42 . . . . 0.0 110.76 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.405 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 73.4 t -111.03 137.87 41.68 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.12 0 CA-C-O 121.189 0.519 . . . . 0.0 110.133 177.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.8 p90 -136.52 156.7 48.22 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.858 -178.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -85.95 116.05 23.94 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.436 0.636 . . . . 0.0 111.443 -177.399 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -100.8 20.04 16.04 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.604 177.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -61.57 110.5 1.5 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.866 -178.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 85.7 m -151.49 112.76 4.33 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.004 0.431 . . . . 0.0 110.487 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 158.42 -130.08 2.45 Favored Glycine 0 N--CA 1.444 -0.827 0 C-N-CA 120.824 -0.703 . . . . 0.0 111.712 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.121 0 CA-C-O 118.461 -1.188 . . . . 0.0 111.396 179.083 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.7 ttt . . . . . 0 N--CA 1.48 1.026 0 CA-C-O 120.963 0.411 . . . . 0.0 111.814 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -133.05 90.36 2.74 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -97.81 -18.27 18.85 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -175.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.48 127.07 31.67 Favored 'General case' 0 C--N 1.318 -0.772 0 O-C-N 122.039 -0.413 . . . . 0.0 111.2 178.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt 70.31 101.61 0.04 OUTLIER Pre-proline 0 N--CA 1.467 0.378 0 C-N-CA 123.598 0.759 . . . . 0.0 111.729 178.784 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.503 ' HD2' ' HG3' ' A' ' 11' ' ' LYS . 56.6 Cg_endo -91.22 -158.81 0.07 OUTLIER 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 123.191 2.594 . . . . 0.0 111.155 178.218 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.423 ' HD2' ' N ' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -55.38 -18.25 6.36 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 176.185 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.423 ' N ' ' HD2' ' A' ' 7' ' ' LYS . 44.1 mt-10 -74.47 162.22 29.03 Favored 'General case' 0 C--O 1.234 0.279 0 O-C-N 122.065 -0.397 . . . . 0.0 110.339 177.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -84.4 -85.23 0.93 Allowed Glycine 0 N--CA 1.441 -0.984 0 C-N-CA 120.293 -0.956 . . . . 0.0 113.911 -174.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 46.9 t -81.57 97.47 3.69 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.012 0 CA-C-O 121.485 0.66 . . . . 0.0 111.794 -174.545 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.503 ' HG3' ' HD2' ' A' ' 6' ' ' PRO . 69.8 mmtt -120.35 98.66 6.16 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 121.391 0.615 . . . . 0.0 110.287 176.624 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 5.7 t -147.32 144.8 29.05 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.523 -178.698 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.06 14.26 20.44 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.49 0.662 . . . . 0.0 111.127 -177.48 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -74.67 -17.0 60.75 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.302 0.573 . . . . 0.0 109.937 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -92.21 4.35 53.42 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.683 0.754 . . . . 0.0 109.541 178.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.492 ' OD1' ' HG3' ' A' ' 36' ' ' ARG . 6.1 t70 -140.74 -165.06 1.86 Allowed 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 108.558 -0.905 . . . . 0.0 108.558 -179.293 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 0.3 OUTLIER 76.26 137.14 0.06 Allowed 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.261 1.424 . . . . 0.0 112.341 177.062 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.525 HG13 HD21 ' A' ' 20' ' ' LEU . 39.6 pt -131.95 171.03 18.71 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.212 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.159 -177.696 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.519 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 24.8 t-20 -102.52 126.96 49.76 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-O 120.881 0.372 . . . . 0.0 110.162 179.096 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.609 HD23 HG12 ' A' ' 34' ' ' ILE . 2.7 mm? -118.84 141.54 48.55 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 177.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.422 ' HE2' ' HA ' ' A' ' 81' ' ' GLU . 49.4 mtmt -128.78 141.25 51.37 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-O 121.725 0.774 . . . . 0.0 110.814 -178.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.624 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 3.6 p -120.8 127.61 75.96 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.943 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.262 -177.396 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -120.83 131.91 54.71 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-O 121.19 0.519 . . . . 0.0 110.052 -179.183 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -109.19 148.01 16.94 Favored Glycine 0 N--CA 1.426 -1.98 0 C-N-CA 120.519 -0.848 . . . . 0.0 111.241 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.51 ' HG3' ' O ' ' A' ' 86' ' ' VAL . 0.0 OUTLIER -53.56 -12.31 0.46 Allowed 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 179.261 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -73.55 -21.88 60.24 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.505 0.669 . . . . 0.0 110.219 176.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.86 30.15 4.66 Favored Glycine 0 CA--C 1.501 -0.812 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.398 176.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.0 p -124.25 157.93 33.69 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 120.857 0.36 . . . . 0.0 110.735 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.624 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.7 p -149.55 139.2 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-O 121.116 0.484 . . . . 0.0 111.266 -178.263 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.468 HG11 ' HD3' ' A' ' 50' ' ' ARG . 6.4 t -122.88 138.03 54.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.204 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -108.17 144.83 35.05 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.827 0.346 . . . . 0.0 110.553 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.548 ' HE1' HG12 ' A' ' 22' ' ' VAL . 7.0 m-85 -139.54 152.11 46.65 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.898 0.38 . . . . 0.0 110.567 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.609 HG12 HD23 ' A' ' 20' ' ' LEU . 21.2 pt -126.52 166.3 23.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.837 0.351 . . . . 0.0 110.514 -176.502 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 9.5 mptt -75.6 150.8 37.95 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.492 ' HG3' ' OD1' ' A' ' 16' ' ' ASP . 4.2 ppt_? -71.79 -12.91 61.53 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 121.194 0.521 . . . . 0.0 110.951 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -103.1 -4.44 24.5 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 122.115 0.96 . . . . 0.0 108.669 179.03 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.533 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.8 m -86.39 135.23 36.77 Favored Pre-proline 0 C--N 1.304 -1.386 0 CA-C-N 114.799 -1.092 . . . . 0.0 110.241 -178.699 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -59.48 124.21 15.01 Favored 'Trans proline' 0 C--O 1.236 0.399 0 C-N-CA 122.668 2.245 . . . . 0.0 112.326 -179.029 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.6 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.2 pp -66.13 -17.19 64.56 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.298 0.571 . . . . 0.0 111.688 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.478 ' N ' HD12 ' A' ' 40' ' ' LEU . 3.3 p -54.25 -29.34 46.4 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.895 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -64.24 -40.99 97.16 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.461 -179.172 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.0 pp -73.28 -33.66 65.36 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.055 0.455 . . . . 0.0 110.074 178.672 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 51.6 mtm -65.66 -49.81 67.25 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.941 -178.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.41 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 38.0 mttp -67.75 -35.4 78.66 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.624 178.714 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.22 -32.02 73.44 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.146 0.498 . . . . 0.0 109.988 178.073 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -64.11 -55.95 18.35 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.609 178.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 17.6 p -63.16 -36.11 82.54 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.841 0.353 . . . . 0.0 111.194 -177.451 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 43.9 mt-10 -67.12 -40.35 86.8 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.92 0.391 . . . . 0.0 111.711 -179.484 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.468 ' HD3' HG11 ' A' ' 30' ' ' VAL . 10.3 ptm180 -84.64 -31.28 24.3 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 122.02 -0.425 . . . . 0.0 111.84 -177.803 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.3 mm-40 -80.7 -22.53 40.27 Favored 'General case' 0 CA--C 1.508 -0.672 0 CA-C-O 121.006 0.431 . . . . 0.0 111.747 -178.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.401 ' C ' HD22 ' A' ' 53' ' ' LEU . . . 88.32 40.98 6.3 Favored Glycine 0 N--CA 1.431 -1.691 0 C-N-CA 120.153 -1.022 . . . . 0.0 111.249 -178.124 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.454 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 3.9 mm? -125.09 166.38 16.51 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.878 -0.415 . . . . 0.0 109.878 179.404 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 57.4 m -117.03 152.95 33.57 Favored 'General case' 0 C--N 1.316 -0.856 0 O-C-N 122.218 -0.301 . . . . 0.0 110.285 178.297 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 12.9 mmt -61.28 -27.44 68.47 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.213 0.53 . . . . 0.0 111.566 178.352 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.76 -12.34 53.92 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.518 0.675 . . . . 0.0 110.49 176.795 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -96.82 -16.87 20.57 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.159 -178.729 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.6 pt -140.37 176.75 4.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-O 121.204 0.526 . . . . 0.0 111.32 -179.26 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.553 ' CG ' ' HG3' ' A' ' 89' ' ' GLN . 3.3 mmt85 -151.53 140.15 20.7 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.914 178.539 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -101.39 138.77 37.96 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.415 -178.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 4.9 ttt180 -140.11 146.96 39.55 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.055 -178.137 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.532 ' HB2' HD11 ' A' ' 67' ' ' ILE . 78.3 t80 -152.57 143.82 23.22 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 178.253 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 54.71 24.87 5.92 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.351 0.596 . . . . 0.0 111.355 -178.193 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.38 -21.96 32.44 Favored Glycine 0 N--CA 1.443 -0.896 0 CA-C-N 116.161 -0.472 . . . . 0.0 113.141 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -98.84 151.59 37.47 Favored Pre-proline 0 C--N 1.321 -0.639 0 O-C-N 122.434 -0.45 . . . . 0.0 111.52 -177.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -71.27 139.61 35.47 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.499 2.132 . . . . 0.0 111.36 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.532 HD11 ' HB2' ' A' ' 62' ' ' PHE . 39.0 mt -89.58 147.22 5.35 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-O 120.839 0.352 . . . . 0.0 110.418 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -114.84 156.83 24.2 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.461 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 14.6 pt-20 -73.25 -12.08 60.73 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.547 0.689 . . . . 0.0 110.997 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 16.4 p -97.61 14.24 27.34 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.344 177.556 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -98.04 151.69 20.08 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.123 0.487 . . . . 0.0 110.817 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.452 ' CG2' ' HD2' ' A' ' 73' ' ' PRO . 1.6 m -113.57 141.02 25.26 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 178.7 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.484 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 16.2 Cg_endo -54.39 -34.03 79.33 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 123.01 2.474 . . . . 0.0 112.263 -178.72 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.69 -16.14 63.29 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.865 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 24.8 mm-40 -74.62 -37.49 62.8 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.093 0.473 . . . . 0.0 111.079 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.461 ' H ' HD12 ' A' ' 76' ' ' LEU . 1.0 OUTLIER -86.86 -1.24 57.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.222 -178.24 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 60.0 mm-40 58.4 33.56 23.23 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.562 0.696 . . . . 0.0 110.887 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.484 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.1 ptm -78.83 161.28 26.89 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.967 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -125.17 174.4 8.1 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 -178.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.519 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 7.0 p-10 -57.11 144.01 36.38 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 121.438 0.637 . . . . 0.0 112.08 177.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.422 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 58.2 mm-40 77.44 19.64 1.22 Allowed 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 124.901 1.28 . . . . 0.0 111.526 178.091 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.27 150.57 38.83 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.109 177.404 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 16.5 m -112.61 114.21 26.72 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 121.271 0.557 . . . . 0.0 112.053 175.223 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.499 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 28.9 mm -81.54 142.16 14.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.322 177.223 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -100.07 116.23 31.61 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-O 120.615 0.245 . . . . 0.0 111.102 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.51 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 67.6 t -114.71 135.66 53.86 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-O 121.041 0.448 . . . . 0.0 110.762 177.225 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.434 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 10.7 p90 -135.5 153.77 51.63 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.931 -179.248 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -77.35 120.92 23.04 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.456 0.646 . . . . 0.0 112.11 -175.875 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.553 ' HG3' ' CG ' ' A' ' 59' ' ' ARG . 30.3 mm-40 -110.43 19.14 19.09 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.686 177.329 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -51.09 -39.42 56.05 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.124 0.487 . . . . 0.0 110.8 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 86.4 m -87.36 112.26 21.93 Favored 'General case' 0 N--CA 1.437 -1.1 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 176.38 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 71.61 62.77 3.3 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 121.125 -0.56 . . . . 0.0 112.315 -177.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.177 0 CA-C-O 118.679 -1.067 . . . . 0.0 111.814 -179.186 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.6 ptt? . . . . . 0 N--CA 1.483 1.185 0 CA-C-O 120.871 0.367 . . . . 0.0 111.431 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -107.64 37.37 2.44 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.707 0.765 . . . . 0.0 109.658 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -68.42 -28.39 67.03 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.358 -177.229 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -64.92 -67.97 0.4 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.682 -178.363 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -160.2 154.11 19.46 Favored Pre-proline 0 C--N 1.311 -1.105 0 CA-C-N 116.651 -0.249 . . . . 0.0 110.879 -178.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -81.72 -166.02 0.37 Allowed 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.616 2.21 . . . . 0.0 112.073 176.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -123.5 20.19 9.56 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.48 0.657 . . . . 0.0 110.717 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -131.75 176.5 8.29 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.887 -177.427 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 86.9 -81.66 1.67 Allowed Glycine 0 N--CA 1.435 -1.377 0 N-CA-C 109.84 -1.304 . . . . 0.0 109.84 -178.313 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 58.1 t -136.29 122.46 30.21 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.58 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 177.269 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.489 ' C ' ' HD2' ' A' ' 11' ' ' LYS . 3.4 tmmm? -137.95 138.89 39.4 Favored 'General case' 0 N--CA 1.428 -1.542 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 -175.76 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.474 ' N ' ' HD2' ' A' ' 11' ' ' LYS . 0.5 OUTLIER -145.17 139.73 27.45 Favored 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 177.534 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -151.27 163.06 39.76 Favored 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 179.373 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -89.66 11.99 18.18 Favored 'General case' 0 C--N 1.317 -0.834 0 O-C-N 122.106 -0.371 . . . . 0.0 111.081 -174.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 63.4 25.89 14.73 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 -174.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -74.78 103.66 5.12 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 113.635 -1.621 . . . . 0.0 109.008 -179.424 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.591 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 38.8 p-80 -123.37 161.38 24.83 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.609 -173.074 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.483 HG13 HD21 ' A' ' 20' ' ' LEU . 29.7 pt -132.86 170.13 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.244 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.64 178.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.499 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 7.6 t30 -105.2 129.42 53.58 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 178.375 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.557 HD23 HG12 ' A' ' 34' ' ' ILE . 2.7 mm? -117.38 142.48 47.06 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -127.56 140.59 52.02 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-O 121.477 0.655 . . . . 0.0 110.155 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.618 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 2.7 p -120.89 126.12 74.85 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.035 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.808 -176.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -115.2 128.22 56.02 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.263 0.554 . . . . 0.0 110.154 -178.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.458 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -99.87 158.66 19.65 Favored Glycine 0 N--CA 1.43 -1.714 0 C-N-CA 120.335 -0.936 . . . . 0.0 111.312 179.421 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.67 -16.49 1.66 Allowed 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 177.668 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -77.38 -21.6 52.97 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.458 0.647 . . . . 0.0 110.844 178.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.01 -8.55 45.77 Favored Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.915 -0.659 . . . . 0.0 111.928 -178.096 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.9 t -78.85 153.99 30.17 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.319 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.618 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.7 p -149.75 140.57 16.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 120.875 0.369 . . . . 0.0 111.071 -177.404 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.55 HG11 ' HD3' ' A' ' 50' ' ' ARG . 4.7 t -123.2 139.59 49.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.483 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -108.82 142.34 39.54 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.842 0.353 . . . . 0.0 110.674 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.556 ' HE1' HG12 ' A' ' 22' ' ' VAL . 16.7 m-85 -136.4 154.05 50.92 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.289 0.566 . . . . 0.0 111.293 -177.704 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.557 HG12 HD23 ' A' ' 20' ' ' LEU . 27.2 pt -134.0 162.37 39.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 120.844 0.354 . . . . 0.0 110.097 -178.355 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.591 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 0.0 OUTLIER -77.34 150.01 35.22 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.553 179.843 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 3.4 ppt_? -70.41 -8.35 50.15 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.673 0.749 . . . . 0.0 110.211 179.362 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 30.1 t-80 -104.48 -8.22 19.25 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 -179.561 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.406 ' HB ' ' O ' ' A' ' 35' ' ' LYS . 1.2 m -87.16 137.9 32.72 Favored Pre-proline 0 N--CA 1.44 -0.956 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.108 179.525 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -60.7 126.48 19.9 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.374 2.05 . . . . 0.0 112.176 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.512 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.3 pp -67.21 -17.75 64.95 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -178.753 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.469 ' N ' HD12 ' A' ' 40' ' ' LEU . 2.8 p -55.89 -28.86 58.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.886 0.374 . . . . 0.0 111.831 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -60.29 -46.24 90.54 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 120.928 0.394 . . . . 0.0 110.375 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.8 pp -71.83 -35.65 69.95 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.043 0.449 . . . . 0.0 110.436 179.27 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 47.6 mtm -63.07 -46.01 89.46 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.18 0.514 . . . . 0.0 110.863 -178.37 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.5 mtpm? -69.84 -37.05 76.05 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.44 178.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.415 ' O ' ' HG2' ' A' ' 50' ' ' ARG . . . -62.27 -37.76 86.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.157 0.503 . . . . 0.0 109.945 178.821 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -58.42 -55.64 32.44 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.184 177.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.611 ' SG ' HD11 ' A' ' 58' ' ' ILE . 22.5 m -60.24 -44.93 94.81 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.339 0.59 . . . . 0.0 110.741 -177.83 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -67.32 -30.85 70.8 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 112.824 0.676 . . . . 0.0 112.824 -176.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.55 ' HD3' HG11 ' A' ' 30' ' ' VAL . 13.8 ptm180 -90.65 -34.06 15.58 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.823 -0.548 . . . . 0.0 111.551 179.141 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 21.4 mm-40 -78.52 -21.82 48.27 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 121.154 0.502 . . . . 0.0 111.924 -178.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.82 39.83 6.45 Favored Glycine 0 N--CA 1.432 -1.614 0 C-N-CA 119.947 -1.12 . . . . 0.0 110.933 -177.587 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -123.81 166.18 16.04 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.7 m -118.31 155.27 30.93 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 178.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.6 mmt -61.93 -28.16 69.34 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-O 121.451 0.644 . . . . 0.0 111.185 177.382 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.27 -17.89 38.19 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.44 0.638 . . . . 0.0 110.841 177.537 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.402 ' OE1' ' HB2' ' A' ' 90' ' ' GLN . 2.8 mp0 -88.58 -25.8 22.28 Favored 'General case' 0 CA--C 1.504 -0.807 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.815 -177.512 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.611 HD11 ' SG ' ' A' ' 48' ' ' CYS . 12.0 pt -133.27 178.65 5.32 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.157 0 CA-C-O 121.497 0.665 . . . . 0.0 112.532 -178.273 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 6.7 mmt180 -148.4 139.4 23.13 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.303 177.578 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -99.69 141.68 32.17 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.886 179.224 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -142.33 143.79 32.91 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-O 121.006 0.431 . . . . 0.0 110.937 -176.839 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.454 ' HB2' HD11 ' A' ' 67' ' ' ILE . 73.0 t80 -149.28 146.21 27.45 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.646 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 17.9 t70 56.82 22.83 7.39 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-O 121.778 0.799 . . . . 0.0 110.481 -178.273 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.19 -21.05 26.44 Favored Glycine 0 N--CA 1.429 -1.817 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.562 -179.051 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -95.72 156.46 37.34 Favored Pre-proline 0 C--N 1.329 -0.313 0 O-C-N 122.575 -0.368 . . . . 0.0 111.131 -178.486 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -77.17 142.04 21.24 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 122.496 2.131 . . . . 0.0 111.589 178.414 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.454 HD11 ' HB2' ' A' ' 62' ' ' PHE . 38.8 mt -90.04 153.41 3.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 120.949 0.404 . . . . 0.0 110.589 -178.432 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -116.38 162.82 16.95 Favored 'General case' 0 CA--C 1.498 -1.038 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 178.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.496 ' H ' ' CD ' ' A' ' 69' ' ' GLU . 0.8 OUTLIER -75.27 -18.82 59.99 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-O 121.39 0.614 . . . . 0.0 110.349 178.984 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 8.3 t -98.96 11.97 37.33 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.375 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -95.53 154.09 17.38 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-O 120.959 0.409 . . . . 0.0 110.596 -179.594 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -114.03 147.83 38.66 Favored Pre-proline 0 C--N 1.316 -0.891 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.249 178.575 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.547 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 18.6 Cg_endo -58.91 -28.65 88.1 Favored 'Trans proline' 0 C--O 1.238 0.514 0 C-N-CA 122.79 2.327 . . . . 0.0 112.018 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -77.91 -14.77 59.44 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.506 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -68.32 -42.35 79.5 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.653 0.74 . . . . 0.0 109.56 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.449 ' H ' HD12 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -91.05 -1.8 57.74 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.146 -179.472 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 56.94 34.75 25.37 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.277 179.384 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.547 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 4.7 ptm -68.92 159.8 31.99 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.012 0.434 . . . . 0.0 110.851 -178.357 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -115.98 166.53 11.89 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.173 -176.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.499 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 9.7 p-10 -61.1 141.37 57.47 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.39 0.614 . . . . 0.0 111.775 177.014 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 81.83 17.06 0.43 Allowed 'General case' 0 C--O 1.236 0.355 0 C-N-CA 125.419 1.487 . . . . 0.0 110.877 -179.267 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.41 ' OD1' HD12 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -61.52 148.73 41.12 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.523 178.496 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 29.4 m -111.07 110.52 21.1 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 121.419 0.628 . . . . 0.0 112.252 176.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.475 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 28.1 mm -79.45 139.37 18.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.523 177.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -98.12 113.86 25.88 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.915 0.388 . . . . 0.0 110.541 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.458 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 82.0 t -111.55 134.72 53.03 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 CA-C-O 121.292 0.568 . . . . 0.0 111.019 178.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -131.27 166.78 20.43 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.546 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.442 ' HG3' ' H ' ' A' ' 90' ' ' GLN . 5.0 tp60 -95.1 133.02 39.37 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.597 0.713 . . . . 0.0 111.93 -174.387 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 -110.14 14.07 22.98 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.717 177.124 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.442 ' H ' ' HG3' ' A' ' 88' ' ' GLN . 4.9 tp-100 -110.19 115.51 29.86 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.115 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.9 t -159.01 144.86 16.5 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.701 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 150.88 121.39 1.0 Allowed Glycine 0 N--CA 1.443 -0.895 0 N-CA-C 111.253 -0.739 . . . . 0.0 111.253 179.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.332 0 CA-C-O 118.192 -1.338 . . . . 0.0 110.967 -178.236 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ptt? . . . . . 0 N--CA 1.485 1.276 0 CA-C-O 121.207 0.527 . . . . 0.0 110.857 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -128.35 12.54 6.51 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.473 0.654 . . . . 0.0 109.661 177.151 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -95.45 -12.02 26.6 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 121.703 0.763 . . . . 0.0 109.273 -178.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -85.11 47.81 1.47 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.78 -179.299 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 49.4 mtpt 57.28 102.57 0.03 OUTLIER Pre-proline 0 CA--C 1.534 0.36 0 C-N-CA 123.593 0.757 . . . . 0.0 112.862 -177.56 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -81.33 -177.95 3.98 Favored 'Trans proline' 0 N--CA 1.453 -0.904 0 C-N-CA 122.598 2.199 . . . . 0.0 111.138 177.104 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.448 ' HG2' ' HG2' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -48.91 -35.58 15.24 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.928 0.394 . . . . 0.0 110.872 175.918 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.448 ' HG2' ' HG2' ' A' ' 7' ' ' LYS . 12.8 pt-20 -172.77 167.85 5.19 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 122.887 0.475 . . . . 0.0 110.046 175.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -74.73 -42.18 32.47 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 121.232 -0.509 . . . . 0.0 113.654 -177.102 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.0 p -77.35 127.32 38.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.569 0.7 . . . . 0.0 111.25 -178.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.5 mtmm -100.95 141.83 33.28 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.365 179.294 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.9 t -148.92 139.38 22.51 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.14 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -92.72 -71.59 0.64 Allowed 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -176.293 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 12.6 m120 59.42 19.78 8.11 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-O 121.185 0.517 . . . . 0.0 110.505 -176.606 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.8 p30 -132.61 176.27 8.59 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.055 0.455 . . . . 0.0 110.362 -177.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -111.84 106.18 14.84 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.838 0.828 . . . . 0.0 110.443 177.526 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.51 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 11.4 p-80 -120.54 154.25 35.59 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.682 -178.497 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.447 HG13 HD21 ' A' ' 20' ' ' LEU . 29.2 pt -127.53 170.91 16.62 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.122 0 CA-C-O 121.295 0.569 . . . . 0.0 110.725 -178.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.452 ' HA ' ' O ' ' A' ' 32' ' ' PHE . 6.7 t30 -107.28 122.5 46.67 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.838 179.47 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.447 HD21 HG13 ' A' ' 18' ' ' ILE . 2.8 mm? -113.16 139.58 48.64 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 178.558 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -125.01 141.29 52.22 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 -178.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.73 HG22 HG13 ' A' ' 84' ' ' ILE . 85.6 t -120.7 130.31 74.69 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.697 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.121 -177.118 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -116.37 123.81 48.53 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-O 121.293 0.568 . . . . 0.0 110.295 -179.464 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.505 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -96.13 158.72 21.84 Favored Glycine 0 N--CA 1.426 -2.001 0 C-N-CA 120.238 -0.982 . . . . 0.0 110.98 178.8 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.57 -16.42 0.92 Allowed 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 178.688 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -76.14 -22.13 55.8 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.387 0.613 . . . . 0.0 110.854 178.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 99.33 9.93 49.54 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 -177.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.4 t -96.45 125.05 40.67 Favored 'General case' 0 N--CA 1.44 -0.94 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.555 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 16.3 t -118.08 141.16 38.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 121.062 0.458 . . . . 0.0 110.953 -179.008 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.599 HG11 ' HD3' ' A' ' 50' ' ' ARG . 16.2 t -124.56 138.7 53.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 178.163 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -107.89 142.41 38.01 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.748 0.308 . . . . 0.0 110.591 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.504 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 15.9 m-85 -134.83 151.63 51.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.99 0.424 . . . . 0.0 110.687 -178.239 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.493 HD13 HD23 ' A' ' 43' ' ' LEU . 22.3 pt -132.75 167.52 26.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 O-C-N 122.139 -0.35 . . . . 0.0 110.48 -178.35 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.51 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 86.3 mttt -77.28 150.36 35.3 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 178.783 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.4 ptt180 -69.37 -18.47 63.78 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.302 0.573 . . . . 0.0 111.092 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 49.3 t-80 -103.33 -1.14 29.2 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 122.329 1.061 . . . . 0.0 108.867 -176.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.434 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.7 m -91.17 138.21 25.94 Favored Pre-proline 0 C--N 1.304 -1.381 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.46 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -58.0 120.06 7.71 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.676 2.251 . . . . 0.0 112.085 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.601 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.3 pt? -66.93 -15.95 64.02 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.21 0.529 . . . . 0.0 111.364 -179.022 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.533 ' HB2' ' O ' ' A' ' 69' ' ' GLU . 44.4 t -49.71 -32.87 14.41 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.219 177.5 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 39.2 mtmt -60.57 -47.48 86.02 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 120.978 0.418 . . . . 0.0 110.305 179.436 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.2 pp -72.67 -35.75 67.77 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.468 -179.456 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 63.3 mtm -62.61 -48.0 81.29 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 120.997 0.427 . . . . 0.0 110.831 179.343 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.441 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 47.9 mttp -66.72 -35.57 80.42 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.144 0.497 . . . . 0.0 110.344 177.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.83 -35.31 80.19 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.297 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -63.5 -54.38 37.18 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.788 178.797 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 22.5 p -64.01 -36.4 83.86 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 120.726 0.298 . . . . 0.0 111.314 -176.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 44.3 mt-10 -66.6 -42.05 87.51 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.749 0.309 . . . . 0.0 111.673 -179.172 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.599 ' HD3' HG11 ' A' ' 30' ' ' VAL . 9.9 ptm180 -79.21 -27.03 42.52 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.251 0.548 . . . . 0.0 110.77 -178.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 23.4 mm-40 -84.03 -20.64 32.39 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 94.29 7.04 61.01 Favored Glycine 0 N--CA 1.444 -0.803 0 C-N-CA 120.339 -0.934 . . . . 0.0 112.817 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -98.13 174.27 6.61 Favored 'General case' 0 C--N 1.321 -0.672 0 O-C-N 122.071 -0.664 . . . . 0.0 111.199 -179.281 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.403 ' HB2' ' OE1' ' A' ' 57' ' ' GLN . 16.8 m -125.1 158.84 32.86 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.617 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.0 mmt -62.87 -27.21 69.19 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.134 0.492 . . . . 0.0 111.954 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.501 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.18 -14.38 47.08 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.482 0.658 . . . . 0.0 110.527 177.485 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.403 ' OE1' ' HB2' ' A' ' 54' ' ' SER . 1.2 mp0 -92.1 -25.87 18.55 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.779 -178.889 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.409 HG22 ' NE2' ' A' ' 88' ' ' GLN . 12.8 pt -136.42 178.93 4.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.181 0.515 . . . . 0.0 111.442 -178.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.445 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 7.8 mmt180 -154.74 140.9 18.49 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.708 177.418 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -97.91 142.35 29.76 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.639 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.01 137.98 28.06 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-O 121.119 0.485 . . . . 0.0 111.029 -176.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.437 ' HB2' HD11 ' A' ' 67' ' ' ILE . 85.5 t80 -143.64 147.48 34.39 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.9 t70 59.43 21.2 9.58 Favored 'General case' 0 N--CA 1.482 1.16 0 CA-C-O 122.181 0.991 . . . . 0.0 109.701 -178.069 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.15 -20.36 21.65 Favored Glycine 0 N--CA 1.42 -2.394 0 CA-C-N 115.532 -0.758 . . . . 0.0 112.299 -178.56 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -95.6 149.53 36.21 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-O 121.124 0.488 . . . . 0.0 111.336 -177.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_exo -66.57 138.08 48.58 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.787 2.325 . . . . 0.0 111.823 177.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.545 HG21 HD11 ' A' ' 40' ' ' LEU . 53.2 mt -89.04 150.57 3.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 110.17 -0.307 . . . . 0.0 110.17 179.09 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -120.2 152.99 36.91 Favored 'General case' 0 CA--C 1.502 -0.897 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 177.865 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.533 ' O ' ' HB2' ' A' ' 41' ' ' SER . 7.3 pt-20 -72.59 -18.07 61.64 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-O 121.296 0.57 . . . . 0.0 111.569 -177.655 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.9 t -92.98 7.7 42.96 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-O 120.934 0.397 . . . . 0.0 111.383 -178.289 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -101.05 171.77 7.42 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.204 0.526 . . . . 0.0 111.335 -179.678 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.404 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.6 OUTLIER -124.29 149.8 62.08 Favored Pre-proline 0 C--N 1.319 -0.758 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.877 177.901 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.6 -31.39 92.17 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.056 2.504 . . . . 0.0 112.684 -178.338 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.63 -18.9 63.63 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.938 0.399 . . . . 0.0 111.346 -179.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.404 ' HB2' ' O ' ' A' ' 72' ' ' THR . 26.4 mm-40 -70.67 -37.85 73.69 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.212 0.529 . . . . 0.0 110.685 178.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.467 ' H ' HD12 ' A' ' 76' ' ' LEU . 0.9 OUTLIER -90.52 5.9 45.82 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 179.433 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 45.43 33.68 1.37 Allowed 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.004 1.322 . . . . 0.0 112.213 -179.013 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.1 ptm -69.6 160.89 30.71 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.366 -179.025 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -119.76 166.96 12.56 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.258 -176.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.451 ' O ' ' HB2' ' A' ' 81' ' ' GLU . 5.9 p-10 -59.84 145.61 44.96 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.119 0.485 . . . . 0.0 111.579 177.667 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.451 ' HB2' ' O ' ' A' ' 80' ' ' ASP . 3.4 mm-40 79.8 16.3 0.82 Allowed 'General case' 0 C--O 1.233 0.213 0 C-N-CA 124.862 1.265 . . . . 0.0 110.936 -178.845 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.414 ' OD2' HD12 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -63.84 147.97 50.52 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.161 177.956 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 11.7 m -110.87 110.33 20.88 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.43 0.633 . . . . 0.0 111.748 176.335 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.73 HG13 HG22 ' A' ' 22' ' ' VAL . 13.2 mm -80.02 139.67 17.89 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.216 178.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -96.79 113.07 24.59 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.887 0.375 . . . . 0.0 110.582 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.505 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 43.9 t -111.02 134.82 52.09 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 CA-C-O 121.55 0.69 . . . . 0.0 110.808 177.663 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.6 p90 -134.2 153.89 51.57 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.81 -178.329 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.409 ' NE2' HG22 ' A' ' 58' ' ' ILE . 4.9 tp60 -78.49 114.12 17.11 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.044 0.45 . . . . 0.0 110.824 -177.594 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 -106.36 18.93 21.28 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.479 0.657 . . . . 0.0 110.061 178.427 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -65.03 -25.36 67.8 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.591 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.9 t -108.09 129.88 55.13 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 121.062 0.458 . . . . 0.0 110.749 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -128.5 119.49 3.07 Favored Glycine 0 N--CA 1.444 -0.809 0 C-N-CA 120.824 -0.703 . . . . 0.0 111.36 178.495 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.136 0 CA-C-O 118.545 -1.142 . . . . 0.0 111.463 -179.328 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ttt . . . . . 0 N--CA 1.48 1.07 0 CA-C-O 120.993 0.425 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -95.3 66.63 2.9 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 176.494 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -84.44 -38.76 19.77 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.055 -175.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -89.92 105.85 18.08 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-O 120.981 0.419 . . . . 0.0 111.454 -176.715 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.0 ptpp? -65.72 148.63 98.09 Favored Pre-proline 0 C--N 1.326 -0.453 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 176.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_endo -60.11 -172.93 0.08 OUTLIER 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.522 2.148 . . . . 0.0 113.45 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.495 ' HD3' ' H ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -90.44 18.22 6.45 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.721 -178.725 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -97.73 81.11 2.86 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-O 121.058 0.456 . . . . 0.0 111.028 -178.733 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 175.16 84.13 0.06 OUTLIER Glycine 0 C--N 1.301 -1.372 0 C-N-CA 120.661 -0.78 . . . . 0.0 111.154 177.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 13.0 p -77.25 49.84 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 CA-C-O 123.135 1.445 . . . . 0.0 112.083 -178.42 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -128.37 107.59 9.88 Favored 'General case' 0 C--N 1.281 -2.393 0 N-CA-C 107.513 -1.291 . . . . 0.0 107.513 176.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 4.2 t -114.54 137.05 52.34 Favored 'General case' 0 N--CA 1.427 -1.605 0 O-C-N 121.608 -0.682 . . . . 0.0 109.987 -177.594 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -69.39 -8.81 49.89 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-O 121.246 0.545 . . . . 0.0 111.824 178.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -91.28 64.36 5.16 Favored 'General case' 0 C--N 1.316 -0.858 0 O-C-N 121.907 -0.496 . . . . 0.0 112.218 -177.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -160.24 138.46 10.09 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 122.127 -0.358 . . . . 0.0 110.937 177.312 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.458 ' O ' ' HA ' ' A' ' 35' ' ' LYS . 28.6 t70 61.06 35.23 18.86 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 121.537 0.684 . . . . 0.0 111.121 172.826 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 30.5 p-80 -122.2 151.4 41.06 Favored 'General case' 0 C--N 1.323 -0.586 0 O-C-N 121.327 -0.858 . . . . 0.0 112.613 -176.019 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 35.0 pt -133.19 170.74 19.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.94 179.344 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.483 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 11.2 m120 -97.29 138.57 34.55 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 178.091 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.495 HD23 HG12 ' A' ' 34' ' ' ILE . 3.2 mm? -130.14 138.26 50.56 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 174.846 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -126.25 142.4 51.54 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-O 121.175 0.512 . . . . 0.0 110.334 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.691 HG22 HG13 ' A' ' 84' ' ' ILE . 90.4 t -124.02 133.91 67.99 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.147 -177.388 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -111.46 129.13 56.13 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 121.211 0.529 . . . . 0.0 110.945 -177.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -100.47 167.28 20.05 Favored Glycine 0 N--CA 1.435 -1.397 0 C-N-CA 121.238 -0.505 . . . . 0.0 111.874 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.461 ' CD ' ' H ' ' A' ' 25' ' ' GLN . 0.1 OUTLIER -65.64 -30.19 70.86 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.44 0.638 . . . . 0.0 110.487 -177.075 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -73.67 -12.78 60.84 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.1 -178.518 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 102.3 0.61 50.69 Favored Glycine 0 C--O 1.227 -0.327 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.167 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.9 t -82.52 149.08 27.73 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 120.895 0.379 . . . . 0.0 110.202 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.554 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 47.5 t -142.7 135.28 26.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 -177.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.471 HG11 ' HD3' ' A' ' 50' ' ' ARG . 13.8 t -120.79 136.24 58.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.466 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -104.36 140.34 38.03 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.75 0.309 . . . . 0.0 110.266 178.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.404 ' O ' ' HA ' ' A' ' 19' ' ' ASN . 19.8 m-85 -130.3 157.29 42.94 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.016 0.436 . . . . 0.0 111.215 -178.406 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ALY . . . . . 0.439 ' HD2' ' ND2' ' A' ' 19' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.539 HD13 HD23 ' A' ' 43' ' ' LEU . 20.9 pt -134.43 165.46 31.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 120.945 0.402 . . . . 0.0 111.013 -176.827 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 23.8 mtpp -77.7 146.23 36.11 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.995 0.426 . . . . 0.0 110.632 178.692 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.414 ' HA ' ' HG2' ' A' ' 73' ' ' PRO . 1.4 ppt_? -71.8 -13.71 61.77 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.314 0.578 . . . . 0.0 111.025 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 32.0 t60 -98.91 -5.38 30.87 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.42 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.487 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.8 m -91.66 136.17 26.86 Favored Pre-proline 0 C--N 1.305 -1.341 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.321 -178.42 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.402 ' HB2' ' OG ' ' A' ' 41' ' ' SER . 19.4 Cg_endo -60.91 126.19 19.03 Favored 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 122.473 2.115 . . . . 0.0 111.83 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.569 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.2 pp -64.78 -16.55 63.19 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.777 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.54 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 4.0 p -51.8 -31.96 29.35 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 122.873 0.469 . . . . 0.0 111.679 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -61.67 -49.13 77.75 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.01 0.433 . . . . 0.0 110.342 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.6 pp -67.48 -35.08 78.46 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 121.053 0.454 . . . . 0.0 110.142 179.357 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 48.3 mtm -63.55 -49.3 73.98 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 121.087 0.47 . . . . 0.0 110.896 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.41 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 16.5 mtpp -67.54 -36.94 81.96 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.269 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.418 ' O ' ' HG2' ' A' ' 50' ' ' ARG . . . -62.03 -38.8 90.06 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.128 0.489 . . . . 0.0 109.851 178.356 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -58.74 -53.71 55.33 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.108 177.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 29.6 p -65.99 -36.51 83.48 Favored 'General case' 0 N--CA 1.453 -0.285 0 O-C-N 121.981 -0.449 . . . . 0.0 111.184 -177.193 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 45.2 mt-10 -66.11 -40.2 90.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.797 0.332 . . . . 0.0 111.547 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.471 ' HD3' HG11 ' A' ' 30' ' ' VAL . 13.9 ptm180 -80.29 -30.5 38.26 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.052 0.453 . . . . 0.0 111.117 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -83.97 -16.13 45.23 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -178.135 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 92.61 6.77 63.76 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 119.955 -1.117 . . . . 0.0 112.954 179.065 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -98.94 175.22 6.01 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.444 0.64 . . . . 0.0 111.197 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.432 ' HB2' ' OE1' ' A' ' 57' ' ' GLN . 68.7 m -126.06 159.89 31.58 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.652 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.6 mmt -66.43 -25.16 66.62 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.3 0.572 . . . . 0.0 111.428 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.46 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.32 -18.34 34.14 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.677 0.751 . . . . 0.0 110.285 176.448 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.558 ' HA ' ' HG2' ' A' ' 90' ' ' GLN . 1.3 mp0 -89.2 -28.15 20.17 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.812 -179.399 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 11.2 pt -136.46 177.29 6.44 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 CA-C-O 121.354 0.597 . . . . 0.0 112.007 -177.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.463 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 15.9 mmt180 -151.9 143.43 23.5 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.65 178.812 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -99.01 144.73 27.82 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.71 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.612 ' HG2' ' N ' ' A' ' 62' ' ' PHE . 0.8 OUTLIER -142.14 151.0 41.84 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-O 121.224 0.535 . . . . 0.0 111.211 -177.521 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.612 ' N ' ' HG2' ' A' ' 61' ' ' ARG . 66.7 t80 -155.77 146.81 22.38 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 177.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 22.5 t70 56.72 23.88 8.39 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-O 121.795 0.807 . . . . 0.0 110.251 -177.115 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.38 -16.41 29.75 Favored Glycine 0 N--CA 1.431 -1.638 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.945 -178.582 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -97.99 147.41 33.03 Favored Pre-proline 0 C--N 1.326 -0.44 0 O-C-N 122.414 -0.462 . . . . 0.0 110.716 -179.44 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.97 138.77 34.65 Favored 'Trans proline' 0 CA--C 1.533 0.465 0 C-N-CA 122.544 2.163 . . . . 0.0 112.091 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.455 HD11 ' HB2' ' A' ' 62' ' ' PHE . 31.6 mt -88.14 151.96 3.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 120.889 0.376 . . . . 0.0 110.285 -178.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -128.79 172.08 11.62 Favored 'General case' 0 CA--C 1.499 -1.003 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.54 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 7.1 pt-20 -78.77 -8.43 58.75 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 121.508 0.671 . . . . 0.0 110.064 177.197 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 23.5 p -93.29 -1.77 55.68 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.158 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -104.0 144.03 32.08 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.299 0.571 . . . . 0.0 112.277 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.533 ' OG1' ' HG2' ' A' ' 75' ' ' GLN . 0.6 OUTLIER -111.65 157.95 37.87 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.981 176.612 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.53 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 17.9 Cg_endo -58.59 -28.62 86.52 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.755 2.303 . . . . 0.0 112.16 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -78.87 -10.74 59.9 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.907 -178.244 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.533 ' HG2' ' OG1' ' A' ' 72' ' ' THR . 23.5 mm-40 -79.26 -38.88 34.42 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.1 0.476 . . . . 0.0 111.683 -178.729 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.563 ' H ' HD12 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -93.59 1.01 56.81 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 179.621 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 54.01 48.64 20.66 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.815 0.817 . . . . 0.0 110.705 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.53 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.4 ptm -82.42 152.96 25.93 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.283 -179.325 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.532 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 13.3 pt-20 -99.34 163.97 12.31 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.142 -177.274 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.483 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 7.3 p-10 -57.37 143.93 38.11 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 121.36 0.6 . . . . 0.0 110.737 173.481 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 68.07 20.98 8.9 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.821 -179.233 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.532 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 0.5 OUTLIER -69.56 155.39 40.56 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 120.414 -0.514 . . . . 0.0 109.976 179.218 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 24.4 m -102.1 119.93 39.61 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 -174.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.691 HG13 HG22 ' A' ' 22' ' ' VAL . 19.8 mm -90.5 136.53 23.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.292 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -100.67 118.59 37.11 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.064 0.459 . . . . 0.0 110.676 178.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.463 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 76.1 t -111.14 140.39 30.64 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.518 0 CA-C-O 121.051 0.453 . . . . 0.0 110.0 177.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.3 p90 -136.31 153.66 51.09 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 38.4 tp60 -83.46 117.48 23.1 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 121.144 0.497 . . . . 0.0 110.714 -176.576 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.482 ' HA ' ' OE1' ' A' ' 89' ' ' GLN . 11.6 mm-40 -90.43 20.86 4.22 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.437 0.637 . . . . 0.0 111.293 178.763 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.558 ' HG2' ' HA ' ' A' ' 57' ' ' GLN . 5.9 mm100 -106.53 107.88 19.11 Favored 'General case' 0 C--N 1.314 -0.977 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 177.406 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 20.6 m -87.96 99.19 11.96 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-O 121.212 0.529 . . . . 0.0 110.716 -178.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -171.87 167.44 40.46 Favored Glycine 0 N--CA 1.442 -0.953 0 C-N-CA 121.005 -0.617 . . . . 0.0 111.859 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.913 0 CA-C-O 118.575 -1.125 . . . . 0.0 111.782 179.515 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 pmm? . . . . . 0 N--CA 1.477 0.916 0 CA-C-O 120.994 0.426 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -98.07 2.2 48.48 Favored 'General case' 0 C--N 1.33 -0.255 0 O-C-N 122.015 -0.428 . . . . 0.0 111.804 -177.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -97.15 12.73 31.73 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 122.047 0.927 . . . . 0.0 110.0 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -72.85 86.2 1.26 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.884 178.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.426 ' HE2' ' HA ' ' A' ' 5' ' ' LYS . 6.8 mmpt? 44.58 73.34 0.98 Allowed Pre-proline 0 N--CA 1.472 0.675 0 C-N-CA 123.894 0.877 . . . . 0.0 112.283 -179.08 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.485 ' HB2' ' OE2' ' A' ' 8' ' ' GLU . 58.5 Cg_endo -75.82 169.37 22.36 Favored 'Trans proline' 0 N--CA 1.458 -0.584 0 C-N-CA 122.199 1.933 . . . . 0.0 112.202 179.733 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.422 ' H ' ' HG3' ' A' ' 7' ' ' LYS . 1.0 OUTLIER -67.01 -3.81 8.12 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 179.518 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.485 ' OE2' ' HB2' ' A' ' 6' ' ' PRO . 1.4 mp0 -74.16 158.67 33.75 Favored 'General case' 0 C--N 1.321 -0.636 0 O-C-N 121.988 -0.445 . . . . 0.0 110.512 178.342 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 113.67 -13.14 22.78 Favored Glycine 0 N--CA 1.444 -0.796 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 -178.163 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 59.2 t -76.35 152.01 6.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 178.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.72 114.61 3.4 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.126 0.489 . . . . 0.0 110.415 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -130.12 103.99 7.06 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-O 121.058 0.456 . . . . 0.0 111.059 -179.163 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -137.27 153.68 50.28 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.798 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 69.51 25.86 5.26 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-O 122.044 0.926 . . . . 0.0 109.166 176.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.0 p-10 -113.58 15.39 18.94 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.173 -176.414 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.4 t70 71.99 57.68 0.16 Allowed 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 121.717 0.77 . . . . 0.0 111.501 176.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 22.0 p-80 -126.79 158.6 36.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.233 177.538 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.412 HG13 HD21 ' A' ' 20' ' ' LEU . 42.8 pt -136.87 170.65 17.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.443 -179.571 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.405 ' C ' HD22 ' A' ' 20' ' ' LEU . 23.2 t-20 -105.51 134.2 49.01 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.179 179.065 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.61 HD23 HG12 ' A' ' 34' ' ' ILE . 2.7 mm? -126.41 145.07 50.62 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 177.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -129.86 144.24 51.21 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-O 121.297 0.57 . . . . 0.0 110.402 -178.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.64 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 4.7 p -125.01 132.25 71.54 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.874 -176.623 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -122.33 138.74 54.41 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.18 0.514 . . . . 0.0 110.662 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -112.98 160.4 13.14 Favored Glycine 0 N--CA 1.437 -1.275 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -62.71 -19.13 63.6 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.677 0.751 . . . . 0.0 110.02 -179.008 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -81.27 11.01 4.66 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.871 -177.748 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 71.45 39.52 61.25 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 119.893 -1.146 . . . . 0.0 113.186 179.05 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.5 t -132.06 147.37 52.44 Favored 'General case' 0 C--N 1.31 -1.114 0 O-C-N 122.038 -0.683 . . . . 0.0 110.287 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.64 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.5 p -146.72 137.16 17.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.124 0.488 . . . . 0.0 111.523 -178.327 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 t -123.85 138.05 54.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 178.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -107.8 140.73 40.45 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.819 0.342 . . . . 0.0 110.939 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.528 ' HE1' HG12 ' A' ' 22' ' ' VAL . 19.4 m-85 -133.65 160.43 37.53 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.125 0.488 . . . . 0.0 111.31 -177.676 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.61 HG12 HD23 ' A' ' 20' ' ' LEU . 21.2 pt -127.53 179.14 3.89 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.646 0 O-C-N 122.147 -0.346 . . . . 0.0 110.309 -178.209 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 1.7 mtpm? -94.82 151.11 19.51 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-O 120.903 0.383 . . . . 0.0 110.269 -178.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.9 ptt180 -67.08 -23.95 65.91 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.043 0.449 . . . . 0.0 111.762 -177.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -103.13 3.15 35.54 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 122.341 1.067 . . . . 0.0 109.044 -176.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.478 ' OG1' ' HD3' ' A' ' 35' ' ' LYS . 1.8 m -95.87 138.26 21.73 Favored Pre-proline 0 N--CA 1.428 -1.57 0 CA-C-N 114.523 -1.217 . . . . 0.0 110.186 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.428 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 27.3 Cg_endo -58.46 122.37 11.56 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.777 2.318 . . . . 0.0 112.149 -178.81 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.533 HD11 HG21 ' A' ' 67' ' ' ILE . 1.0 OUTLIER -70.37 -16.17 62.94 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.328 0.585 . . . . 0.0 111.242 -179.318 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.485 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 4.2 p -50.68 -29.75 11.95 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.554 178.286 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.428 ' HE3' ' HG2' ' A' ' 39' ' ' PRO . 96.4 mttt -60.49 -47.93 83.99 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.21 0.528 . . . . 0.0 110.016 177.544 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.0 OUTLIER -69.6 -37.74 77.01 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.019 179.089 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 57.4 mtm -61.95 -46.78 87.81 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 120.941 0.401 . . . . 0.0 111.287 -179.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.407 ' HE2' ' HB3' ' A' ' 45' ' ' LYS . 30.7 mtpt -67.3 -38.1 84.43 Favored 'General case' 0 CA--C 1.511 -0.529 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.578 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.39 -34.66 77.16 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.174 0.512 . . . . 0.0 109.947 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -62.5 -56.54 17.13 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.771 177.652 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 25.8 p -65.42 -37.07 85.82 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 122.091 -0.38 . . . . 0.0 111.512 -176.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -70.72 -29.78 66.15 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -178.481 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 50' ' ' ARG . 10.2 ptm85 -89.77 -30.88 17.7 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 121.961 -0.462 . . . . 0.0 111.13 178.745 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -80.61 -22.53 40.53 Favored 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -178.348 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.68 40.07 6.07 Favored Glycine 0 N--CA 1.434 -1.483 0 C-N-CA 120.012 -1.089 . . . . 0.0 110.949 -177.603 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.417 HD13 ' HA ' ' A' ' 53' ' ' LEU . 3.5 mm? -126.21 166.27 17.39 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 178.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 72.0 m -119.54 153.31 35.58 Favored 'General case' 0 C--N 1.309 -1.169 0 O-C-N 122.188 -0.32 . . . . 0.0 110.66 178.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.3 mmt -61.52 -25.67 67.43 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.149 0.499 . . . . 0.0 112.08 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.2 -13.46 49.9 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.563 0.697 . . . . 0.0 110.409 176.698 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.422 HE21 ' HG2' ' A' ' 90' ' ' GLN . 1.0 OUTLIER -94.3 -28.27 15.67 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.648 -0.706 . . . . 0.0 112.188 -177.911 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.0 pt -133.35 175.29 11.69 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 CA-C-O 121.206 0.527 . . . . 0.0 111.149 -177.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.425 ' HD3' ' HA ' ' A' ' 59' ' ' ARG . 14.9 mmt180 -149.95 144.32 25.79 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.803 178.319 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -102.37 141.54 35.04 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.009 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.461 ' HG2' ' O ' ' A' ' 65' ' ' GLN . 8.3 tmm_? -142.92 141.63 31.53 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.362 0.601 . . . . 0.0 111.381 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.472 ' HB2' HD11 ' A' ' 67' ' ' ILE . 85.9 t80 -144.56 147.49 33.25 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.492 178.849 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.5 t70 58.06 24.45 11.19 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-O 121.728 0.775 . . . . 0.0 110.34 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.401 ' HA2' ' HD3' ' A' ' 61' ' ' ARG . . . 76.55 6.66 84.78 Favored Glycine 0 N--CA 1.433 -1.514 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.93 -179.525 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.461 ' O ' ' HG2' ' A' ' 61' ' ' ARG . 3.8 pt20 -122.01 147.05 47.93 Favored Pre-proline 0 CA--C 1.536 0.425 0 O-C-N 122.224 -0.574 . . . . 0.0 110.48 179.128 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -66.69 138.44 49.26 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 122.492 2.128 . . . . 0.0 112.223 -178.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.533 HG21 HD11 ' A' ' 40' ' ' LEU . 45.2 mt -91.54 146.47 6.22 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-O 120.952 0.406 . . . . 0.0 110.099 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -114.42 165.9 12.25 Favored 'General case' 0 CA--C 1.492 -1.282 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.634 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.518 ' H ' ' CD ' ' A' ' 69' ' ' GLU . 0.4 OUTLIER -77.95 -19.81 53.89 Favored 'General case' 0 C--N 1.291 -1.97 0 CA-C-O 121.44 0.638 . . . . 0.0 109.693 178.659 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 36.2 p -92.38 4.04 54.22 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.893 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -98.96 159.82 14.69 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 121.899 -0.5 . . . . 0.0 110.568 -178.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -118.39 154.2 52.05 Favored Pre-proline 0 C--N 1.316 -0.864 0 O-C-N 122.24 -0.287 . . . . 0.0 111.664 177.533 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.17 -30.96 92.49 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.94 2.427 . . . . 0.0 112.276 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.17 -19.68 62.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.145 0.497 . . . . 0.0 111.129 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -67.84 -37.57 82.05 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.645 0.736 . . . . 0.0 110.152 -179.149 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.401 ' H ' HD12 ' A' ' 76' ' ' LEU . 0.5 OUTLIER -93.54 5.19 52.43 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.945 -178.725 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 43.31 40.97 2.81 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.615 1.166 . . . . 0.0 111.94 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 4.3 ptm -74.27 161.89 29.46 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.723 -178.576 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -110.2 164.14 12.93 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 116.325 -0.398 . . . . 0.0 109.964 -177.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -55.42 138.07 46.82 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.591 0.71 . . . . 0.0 111.999 176.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 77.95 24.92 0.68 Allowed 'General case' 0 CA--C 1.512 -0.518 0 C-N-CA 124.895 1.278 . . . . 0.0 111.835 177.684 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.469 ' OD1' HD12 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -61.62 154.07 26.1 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.303 176.523 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 30.8 m -110.44 108.89 19.06 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-O 121.411 0.624 . . . . 0.0 112.05 176.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.432 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 25.1 mm -80.49 137.8 20.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.175 177.612 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -101.35 124.33 46.86 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.144 0.497 . . . . 0.0 110.423 178.708 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.419 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 91.0 t -114.19 131.58 65.75 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.08 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.716 178.152 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.4 p90 -133.85 152.06 51.74 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 116.248 -0.433 . . . . 0.0 109.93 -175.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -76.91 112.12 13.18 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-O 121.358 0.599 . . . . 0.0 112.369 -176.414 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 78.2 mm-40 -111.27 24.77 12.45 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.572 177.142 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.422 ' HG2' HE21 ' A' ' 57' ' ' GLN . 20.9 tm0? -60.77 -47.66 85.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.991 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.3 m -99.18 140.65 33.04 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.802 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 177.57 -41.52 0.09 OUTLIER Glycine 0 N--CA 1.443 -0.879 0 C-N-CA 120.4 -0.905 . . . . 0.0 112.212 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.129 0 CA-C-O 118.965 -0.908 . . . . 0.0 111.256 -179.412 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.1 ptt? . . . . . 0 N--CA 1.477 0.885 0 CA-C-O 120.623 0.249 . . . . 0.0 111.131 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -86.39 13.31 8.43 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.442 0.639 . . . . 0.0 110.74 179.083 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -76.29 -9.05 58.34 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.621 0.724 . . . . 0.0 110.017 178.305 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -117.47 118.11 31.29 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.499 176.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -57.59 124.87 70.23 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-O 121.096 0.474 . . . . 0.0 111.708 -177.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.424 ' HB2' ' H ' ' A' ' 7' ' ' LYS . 72.4 Cg_endo -73.84 -149.37 0.03 OUTLIER 'Trans proline' 0 CA--C 1.539 0.766 0 C-N-CA 123.552 2.835 . . . . 0.0 112.392 -179.475 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.424 ' H ' ' HB2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -100.45 18.08 19.94 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 122.023 0.916 . . . . 0.0 109.796 179.424 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -141.09 173.76 11.17 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 114.962 -1.017 . . . . 0.0 108.884 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -137.11 -49.81 0.07 OUTLIER Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 119.585 -1.293 . . . . 0.0 113.884 -176.726 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 40.3 t -87.88 82.3 2.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.511 0.672 . . . . 0.0 111.498 -177.252 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.3 tttp -145.17 133.23 21.42 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.882 176.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 13.6 t -76.95 169.37 18.45 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.077 0.465 . . . . 0.0 110.709 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.493 ' C ' ' H ' ' A' ' 15' ' ' ASN . 30.0 mt-10 -108.68 125.91 52.41 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.094 0.473 . . . . 0.0 111.569 -177.492 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -67.78 32.99 0.03 OUTLIER 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.39 0.614 . . . . 0.0 111.854 172.401 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.493 ' H ' ' C ' ' A' ' 13' ' ' GLU . 50.9 m-20 -89.91 103.62 16.27 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-O 121.181 0.515 . . . . 0.0 110.204 179.04 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -75.77 99.38 4.4 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.461 0.648 . . . . 0.0 109.979 -178.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.575 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 55.4 p-80 -121.64 146.13 47.3 Favored 'General case' 0 N--CA 1.436 -1.127 0 CA-C-O 121.459 0.647 . . . . 0.0 111.485 -178.797 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 39.7 pt -127.12 167.65 21.57 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.206 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.33 -178.23 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.504 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 23.7 t-20 -100.62 137.86 38.44 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.381 178.434 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.406 HD23 HG12 ' A' ' 34' ' ' ILE . 3.0 mm? -127.85 135.9 50.68 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 176.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -119.65 145.02 46.84 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-O 121.301 0.572 . . . . 0.0 110.12 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.635 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 6.7 p -123.66 134.35 66.66 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.937 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.955 -178.435 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -117.93 117.99 30.77 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-O 121.241 0.543 . . . . 0.0 110.081 -178.63 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.403 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -84.12 155.14 31.11 Favored Glycine 0 N--CA 1.426 -2.012 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.092 -179.45 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -15.31 9.31 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 178.014 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -93.48 -11.19 32.6 Favored 'General case' 0 C--N 1.319 -0.718 0 O-C-N 122.015 -0.428 . . . . 0.0 110.828 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.99 7.58 35.53 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.648 -0.786 . . . . 0.0 112.737 178.077 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 74.5 m -91.36 124.94 35.93 Favored 'General case' 0 C--N 1.313 -0.988 0 O-C-N 122.363 -0.493 . . . . 0.0 111.118 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.635 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.2 p -119.91 132.31 69.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 CA-C-O 121.292 0.568 . . . . 0.0 111.605 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.5 t -119.19 135.26 60.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.044 179.233 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -104.89 142.18 35.22 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.707 0.289 . . . . 0.0 110.696 179.111 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.5 ' HE1' HG12 ' A' ' 22' ' ' VAL . 16.2 m-85 -134.93 162.55 32.1 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.179 0.514 . . . . 0.0 111.149 -178.615 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.406 HG12 HD23 ' A' ' 20' ' ' LEU . 24.7 pt -132.95 169.41 22.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-O 120.916 0.389 . . . . 0.0 110.347 -177.516 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.575 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 44.6 mtpt -86.58 152.96 22.16 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-O 121.134 0.492 . . . . 0.0 110.887 179.728 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 28.1 ptt180 -64.49 -24.06 67.49 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.172 -0.467 . . . . 0.0 112.0 -178.056 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 55.7 t60 -104.22 -2.26 25.94 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 122.086 0.946 . . . . 0.0 108.817 -176.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.475 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.5 m -87.15 137.87 32.76 Favored Pre-proline 0 N--CA 1.427 -1.587 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.355 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -58.92 122.7 12.05 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.672 2.248 . . . . 0.0 112.469 -178.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.461 HD12 ' N ' ' A' ' 41' ' ' SER . 1.2 pp -68.0 -16.47 64.06 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.427 179.225 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.5 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 10.1 p -52.14 -30.31 25.95 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.247 0.619 . . . . 0.0 111.899 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -64.24 -42.66 96.42 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.675 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.469 ' C ' HD12 ' A' ' 43' ' ' LEU . 1.0 OUTLIER -70.83 -35.91 72.67 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.05 0.453 . . . . 0.0 110.233 178.519 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 44.0 mtm -63.32 -49.28 74.59 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.015 0.436 . . . . 0.0 110.765 -178.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.422 ' HD2' ' HE2' ' A' ' 55' ' ' MET . 12.4 mmmm -66.55 -37.71 85.56 Favored 'General case' 0 N--CA 1.441 -0.878 0 O-C-N 122.267 -0.271 . . . . 0.0 110.48 177.178 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.34 -43.41 88.26 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.378 0.608 . . . . 0.0 110.04 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.406 ' CD1' HG11 ' A' ' 22' ' ' VAL . 63.1 t80 -56.38 -55.08 37.96 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.619 177.575 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.659 ' SG ' HD11 ' A' ' 58' ' ' ILE . 33.2 m -63.08 -42.71 99.69 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.926 0.393 . . . . 0.0 111.174 -177.772 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.45 -35.95 81.56 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -177.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -84.98 -34.2 22.43 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.92 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -83.17 -13.57 55.21 Favored 'General case' 0 C--N 1.334 -0.096 0 N-CA-C 113.083 0.772 . . . . 0.0 113.083 -178.588 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.42 6.49 73.95 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.152 -1.023 . . . . 0.0 113.203 178.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -92.18 169.94 10.21 Favored 'General case' 0 C--N 1.32 -0.675 0 O-C-N 121.975 -0.721 . . . . 0.0 110.925 178.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 71.6 m -120.77 154.38 35.75 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.319 179.234 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.422 ' HE2' ' HD2' ' A' ' 45' ' ' LYS . 12.5 mmt -62.01 -28.19 69.4 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-O 121.375 0.607 . . . . 0.0 111.592 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.552 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.08 -14.85 45.91 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.438 0.637 . . . . 0.0 110.818 178.397 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -90.18 -31.64 16.97 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.586 -179.582 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.659 HD11 ' SG ' ' A' ' 48' ' ' CYS . 12.0 pt -128.84 175.95 9.16 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.151 0 CA-C-O 121.296 0.569 . . . . 0.0 111.678 -177.755 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.455 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 25.0 mmt180 -148.51 138.77 22.53 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.341 179.378 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 41.8 m-85 -96.71 139.6 32.54 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.308 179.49 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.444 ' HD2' ' HB2' ' A' ' 85' ' ' ASP . 0.2 OUTLIER -141.62 137.71 32.05 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-O 121.04 0.448 . . . . 0.0 111.063 -176.755 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.556 ' HB2' HD11 ' A' ' 67' ' ' ILE . 67.2 t80 -143.33 145.15 32.45 Favored 'General case' 0 C--O 1.214 -0.801 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 177.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 23.7 t70 54.02 23.75 4.24 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 121.895 0.855 . . . . 0.0 110.871 -177.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.437 ' HA2' ' NE ' ' A' ' 61' ' ' ARG . . . 85.08 -18.03 29.49 Favored Glycine 0 N--CA 1.434 -1.469 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.997 -178.667 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -96.11 149.94 36.59 Favored Pre-proline 0 C--N 1.318 -0.765 0 O-C-N 122.532 -0.393 . . . . 0.0 111.071 -179.355 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.92 141.98 37.97 Favored 'Trans proline' 0 C--O 1.235 0.344 0 C-N-CA 122.53 2.153 . . . . 0.0 111.751 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.556 HD11 ' HB2' ' A' ' 62' ' ' PHE . 23.9 mt -94.53 148.15 5.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 120.979 0.419 . . . . 0.0 110.19 -179.726 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -129.24 166.72 18.86 Favored 'General case' 0 CA--C 1.498 -1.042 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.729 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.5 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 12.6 pt-20 -75.16 -12.48 60.31 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 121.341 0.591 . . . . 0.0 110.479 178.661 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.8 t -91.71 -1.33 57.45 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 121.221 0.534 . . . . 0.0 111.171 -178.43 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -103.93 147.12 27.72 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 120.9 0.381 . . . . 0.0 111.022 177.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.56 153.72 42.73 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.46 179.533 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -60.7 -31.27 91.81 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.701 2.268 . . . . 0.0 112.551 -177.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.83 -20.78 62.52 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.79 -179.018 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -67.21 -37.22 83.27 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.153 0.502 . . . . 0.0 111.127 -178.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.465 ' H ' HD12 ' A' ' 76' ' ' LEU . 0.6 OUTLIER -94.51 11.24 31.54 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.564 -178.023 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 43.73 36.97 1.41 Allowed 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 124.147 0.979 . . . . 0.0 112.202 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.8 ptm -73.53 158.47 34.8 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.901 -178.411 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -109.33 165.43 11.63 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 120.916 0.389 . . . . 0.0 110.534 -178.058 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.504 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 10.3 p-10 -61.55 142.73 56.9 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.339 0.59 . . . . 0.0 111.196 175.79 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 72.83 17.33 4.36 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 124.42 1.088 . . . . 0.0 111.721 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -75.48 161.54 29.11 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 176.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 6.7 m -109.95 131.86 54.68 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -174.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 45.9 mm -97.62 134.01 37.33 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 175.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.444 ' HB2' ' HD2' ' A' ' 61' ' ' ARG . 43.3 m-20 -97.39 124.65 41.64 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-O 121.07 0.462 . . . . 0.0 110.967 179.474 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.455 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 87.3 t -115.61 139.09 43.78 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 CA-C-O 120.99 0.424 . . . . 0.0 110.329 177.339 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 9.7 p90 -134.9 155.87 49.94 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -88.63 116.38 26.84 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.541 0.686 . . . . 0.0 111.48 -175.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 75.0 mm-40 -104.69 23.74 12.9 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.524 178.082 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -79.65 84.43 5.48 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.434 0.635 . . . . 0.0 110.621 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 17.5 m -99.57 86.48 3.36 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 121.239 0.543 . . . . 0.0 110.227 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 139.19 -146.13 17.64 Favored Glycine 0 N--CA 1.436 -1.318 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.727 -1.041 . . . . 0.0 112.229 179.516 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.3 ptt? . . . . . 0 N--CA 1.484 1.275 0 CA-C-O 121.103 0.478 . . . . 0.0 111.086 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.14 19.09 21.2 Favored 'General case' 0 CA--C 1.509 -0.604 0 CA-C-O 121.775 0.798 . . . . 0.0 109.438 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -71.52 -44.65 64.25 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.397 -178.421 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.0 mp0 -91.89 9.92 30.94 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.72 -179.621 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 54.8 tptt -146.02 78.75 11.3 Favored Pre-proline 0 N--CA 1.441 -0.907 0 CA-C-O 121.156 0.503 . . . . 0.0 109.876 -178.317 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -90.0 -172.8 0.62 Allowed 'Trans proline' 0 N--CA 1.446 -1.267 0 C-N-CA 122.916 2.411 . . . . 0.0 111.438 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -2.12 24.23 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.132 0.491 . . . . 0.0 111.528 179.567 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -68.04 167.44 13.91 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.892 -0.411 . . . . 0.0 109.892 178.003 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 153.4 29.18 0.04 OUTLIER Glycine 0 C--N 1.311 -0.847 0 C-N-CA 120.09 -1.053 . . . . 0.0 112.895 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.3 p -80.18 135.67 24.93 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.955 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 178.275 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 49.81 54.0 11.79 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.427 0.632 . . . . 0.0 110.213 -173.087 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.8 t -77.37 50.89 0.82 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 122.58 1.181 . . . . 0.0 111.232 -178.386 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.486 ' HG3' ' H ' ' A' ' 14' ' ' ASN . 8.9 pt-20 -174.6 -61.89 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.693 0 CA-C-N 114.128 -1.396 . . . . 0.0 108.746 -178.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.486 ' H ' ' HG3' ' A' ' 13' ' ' GLU . 5.2 m-20 -85.27 48.7 1.62 Allowed 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 175.776 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -81.01 -41.26 22.97 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.415 -0.812 . . . . 0.0 110.73 -176.087 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.7 t70 67.57 46.9 1.28 Allowed 'General case' 0 C--O 1.238 0.485 0 CA-C-O 121.68 0.753 . . . . 0.0 111.461 175.65 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 5.9 p-80 -117.98 152.18 36.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.403 0.62 . . . . 0.0 111.409 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 29.2 pt -128.96 171.12 17.36 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.128 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.028 178.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.451 ' HB2' ' NZ ' ' A' ' 33' ' ' ALY . 19.2 t-20 -107.27 133.91 51.13 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -124.35 135.35 53.26 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 177.106 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.46 ' HG2' ' HG3' ' A' ' 31' ' ' GLN . 49.8 mtmt -121.95 144.42 48.88 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 121.155 0.503 . . . . 0.0 110.099 -179.279 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.622 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 2.5 p -121.62 127.45 75.58 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.527 -177.872 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -117.44 126.69 53.05 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.294 0.568 . . . . 0.0 110.09 -178.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -104.13 152.95 17.71 Favored Glycine 0 N--CA 1.429 -1.812 0 C-N-CA 120.439 -0.886 . . . . 0.0 111.548 -179.303 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.05 -16.2 1.03 Allowed 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 177.465 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -70.26 -22.8 62.84 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.507 0.67 . . . . 0.0 110.51 177.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 102.56 9.66 40.29 Favored Glycine 0 N--CA 1.448 -0.501 0 N-CA-C 111.338 -0.705 . . . . 0.0 111.338 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 39.9 t -101.89 157.15 17.06 Favored 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 122.492 0.317 . . . . 0.0 110.224 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.622 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 3.7 p -149.51 140.59 16.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.0 0.428 . . . . 0.0 110.616 -179.197 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.9 t -125.18 139.71 50.37 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.039 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.46 ' HG3' ' HG2' ' A' ' 21' ' ' LYS . 0.3 OUTLIER -108.63 144.55 36.22 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.951 0.405 . . . . 0.0 111.049 -179.46 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.549 ' HE1' HG12 ' A' ' 22' ' ' VAL . 14.1 m-85 -140.42 153.49 46.32 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.171 0.51 . . . . 0.0 111.142 -178.528 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ALY . . . . . 0.451 ' NZ ' ' HB2' ' A' ' 19' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 37.8 pt -137.63 166.73 24.02 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 -177.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 3.9 mppt? -77.99 151.88 33.38 Favored 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.187 177.381 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.1 ptt180 -68.06 -14.37 62.92 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 121.378 0.609 . . . . 0.0 110.9 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 76.4 t60 -107.34 -1.62 21.44 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 122.289 1.042 . . . . 0.0 108.645 -178.222 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.53 ' OG1' ' HE2' ' A' ' 35' ' ' LYS . 1.3 m -86.63 139.34 33.41 Favored Pre-proline 0 N--CA 1.432 -1.362 0 CA-C-N 114.548 -1.205 . . . . 0.0 109.73 178.702 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -59.99 119.31 6.44 Favored 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 122.356 2.038 . . . . 0.0 112.397 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.599 HD11 HG21 ' A' ' 67' ' ' ILE . 1.7 pt? -67.82 -16.74 64.25 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.515 0.674 . . . . 0.0 110.58 179.296 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 14.4 p -52.25 -28.83 20.22 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.223 177.422 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.2 mtpt -62.25 -46.96 86.47 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 121.101 0.477 . . . . 0.0 109.739 178.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.8 pp -72.88 -37.52 67.28 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 120.881 0.372 . . . . 0.0 110.265 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 62.7 mtm -61.49 -43.78 98.25 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 120.922 0.391 . . . . 0.0 111.363 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.523 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 43.3 mttp -69.53 -37.63 77.2 Favored 'General case' 0 CA--C 1.514 -0.422 0 O-C-N 122.071 -0.393 . . . . 0.0 110.751 177.607 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.93 -35.49 80.85 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.146 0.498 . . . . 0.0 109.824 -179.661 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.412 ' CZ ' ' HG3' ' A' ' 51' ' ' GLN . 69.3 t80 -61.73 -54.74 38.48 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.602 178.359 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.629 ' SG ' HD11 ' A' ' 58' ' ' ILE . 19.5 m -58.77 -39.18 80.26 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.054 0.454 . . . . 0.0 110.447 -179.115 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.523 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 67.2 mt-10 -62.09 -49.33 76.38 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.115 0.483 . . . . 0.0 111.729 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -74.89 -36.63 62.24 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.087 0.402 . . . . 0.0 112.087 -176.394 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.412 ' HG3' ' CZ ' ' A' ' 47' ' ' TYR . 26.7 mm-40 -78.09 -21.19 50.86 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -178.747 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.405 ' C ' HD22 ' A' ' 53' ' ' LEU . . . 86.46 41.65 6.83 Favored Glycine 0 N--CA 1.431 -1.686 0 C-N-CA 119.905 -1.14 . . . . 0.0 111.271 -178.433 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.405 HD22 ' C ' ' A' ' 52' ' ' GLY . 3.6 mm? -127.64 170.38 12.74 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.47 ' HB2' ' OE1' ' A' ' 57' ' ' GLN . 50.0 m -124.71 157.56 35.36 Favored 'General case' 0 C--N 1.311 -1.088 0 O-C-N 122.303 -0.248 . . . . 0.0 110.491 177.766 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 12.1 mmt -60.73 -28.91 69.04 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-O 121.327 0.584 . . . . 0.0 111.784 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.554 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.36 -16.07 41.12 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.401 0.62 . . . . 0.0 110.634 178.694 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.47 ' OE1' ' HB2' ' A' ' 54' ' ' SER . 1.3 mp0 -90.82 -25.13 20.07 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.782 -177.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.629 HD11 ' SG ' ' A' ' 48' ' ' CYS . 12.7 pt -135.27 177.94 6.02 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.069 0 CA-C-O 120.933 0.397 . . . . 0.0 110.761 -178.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.433 ' CG ' ' HG3' ' A' ' 89' ' ' GLN . 15.0 mmt180 -150.54 139.61 21.08 Favored 'General case' 0 CA--C 1.501 -0.924 0 CA-C-O 121.341 0.591 . . . . 0.0 111.081 178.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -97.91 141.23 31.14 Favored 'General case' 0 N--CA 1.438 -1.033 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.685 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.446 ' HG2' ' N ' ' A' ' 62' ' ' PHE . 8.4 tmm_? -143.48 145.58 32.71 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 121.247 0.546 . . . . 0.0 110.94 -179.696 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.525 ' HB2' HD11 ' A' ' 67' ' ' ILE . 86.1 t80 -151.13 148.74 28.65 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.657 179.029 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 19.5 t70 58.4 22.08 9.09 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.753 0.787 . . . . 0.0 110.123 -178.085 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.0 4.44 88.73 Favored Glycine 0 N--CA 1.43 -1.765 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.662 -178.457 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -121.39 143.58 37.98 Favored Pre-proline 0 N--CA 1.444 -0.738 0 O-C-N 122.071 -0.664 . . . . 0.0 110.11 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -61.71 141.1 89.56 Favored 'Trans proline' 0 C--N 1.329 -0.457 0 C-N-CA 122.848 2.366 . . . . 0.0 112.091 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.599 HG21 HD11 ' A' ' 40' ' ' LEU . 41.2 mt -96.78 146.84 6.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 120.859 0.362 . . . . 0.0 110.146 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -114.5 163.01 15.96 Favored 'General case' 0 CA--C 1.5 -0.959 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 176.625 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -79.04 -11.22 59.99 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 120.106 -0.638 . . . . 0.0 110.597 179.005 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 35.0 p -84.76 -11.99 54.64 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.72 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.56 165.74 16.82 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -178.557 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -121.54 153.37 59.25 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.217 173.433 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.417 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 12.2 Cg_endo -57.38 -30.2 87.03 Favored 'Trans proline' 0 C--O 1.236 0.424 0 C-N-CA 122.779 2.319 . . . . 0.0 112.137 -179.488 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.27 -20.73 62.19 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.163 0.506 . . . . 0.0 111.64 -179.052 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -69.16 -39.1 78.99 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.318 0.58 . . . . 0.0 110.863 179.184 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.457 ' H ' HD12 ' A' ' 76' ' ' LEU . 1.1 mp -86.92 2.86 47.89 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.143 -178.283 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 57.02 31.08 19.28 Favored 'General case' 0 C--N 1.349 0.567 0 CA-C-O 121.51 0.671 . . . . 0.0 111.193 178.523 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.546 ' HE1' HD11 ' A' ' 84' ' ' ILE . 6.8 ptm -79.06 164.73 24.09 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.769 -178.408 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -121.89 172.69 8.0 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.578 -176.277 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -63.06 145.31 55.73 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-O 121.528 0.68 . . . . 0.0 111.835 177.082 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 71.16 16.33 6.3 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 114.57 -1.196 . . . . 0.0 111.492 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.4 ' OD1' ' CE1' ' A' ' 62' ' ' PHE . 11.2 t70 -70.79 153.95 42.29 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.156 175.536 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 19.7 m -112.99 134.99 54.25 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-O 121.454 0.645 . . . . 0.0 112.367 -177.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.546 HD11 ' HE1' ' A' ' 78' ' ' MET . 39.2 mm -98.48 145.28 10.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 123.372 0.669 . . . . 0.0 110.089 -179.581 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -100.27 117.04 33.65 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 122.316 0.246 . . . . 0.0 110.852 179.289 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 86.4 t -115.37 136.02 53.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-O 121.298 0.57 . . . . 0.0 111.285 177.048 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -134.05 153.18 51.97 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.061 -178.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.462 ' HG3' ' H ' ' A' ' 90' ' ' GLN . 5.3 tp60 -79.47 115.33 19.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.312 0.577 . . . . 0.0 111.623 -178.273 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.433 ' HG3' ' CG ' ' A' ' 59' ' ' ARG . 51.8 mm-40 -104.02 22.09 15.26 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-O 121.485 0.659 . . . . 0.0 110.716 177.144 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.462 ' H ' ' HG3' ' A' ' 88' ' ' GLN . 5.7 tp60 -94.79 138.66 32.31 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.521 179.027 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.4 p -78.51 154.83 30.15 Favored 'General case' 0 N--CA 1.434 -1.233 0 CA-C-O 121.05 0.452 . . . . 0.0 111.397 -179.395 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 71.87 71.79 1.01 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.014 -179.511 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.766 0 CA-C-O 118.66 -1.078 . . . . 0.0 112.231 178.737 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.7 ptp . . . . . 0 N--CA 1.476 0.874 0 CA-C-O 120.881 0.372 . . . . 0.0 110.782 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 55.95 65.33 1.47 Allowed 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.274 0.559 . . . . 0.0 112.273 178.686 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -100.61 -5.44 26.72 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.817 0.818 . . . . 0.0 109.079 177.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -109.3 31.13 5.98 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.152 -0.931 . . . . 0.0 108.733 178.566 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 51.7 tptt -103.75 127.89 28.49 Favored Pre-proline 0 C--N 1.319 -0.741 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.898 -175.226 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.504 ' HB2' ' OE1' ' A' ' 8' ' ' GLU . 95.4 Cg_endo -78.75 -167.07 0.45 Allowed 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.155 1.903 . . . . 0.0 111.737 178.334 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -121.5 4.03 10.18 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 121.729 0.776 . . . . 0.0 109.849 -179.458 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.504 ' OE1' ' HB2' ' A' ' 6' ' ' PRO . 2.5 mp0 -89.07 19.82 4.0 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.74 -178.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -83.25 61.67 4.74 Favored Glycine 0 C--N 1.308 -1.0 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.87 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 41.4 t -116.06 126.37 73.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 -179.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -59.12 97.99 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.603 0.716 . . . . 0.0 112.057 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.7 t -101.92 -165.15 1.16 Allowed 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.096 178.173 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -92.95 -165.55 1.36 Allowed 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.289 0.566 . . . . 0.0 110.48 179.478 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -95.91 18.16 13.84 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.541 0.686 . . . . 0.0 110.495 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.9 p30 -111.26 29.65 7.62 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.609 0.719 . . . . 0.0 110.403 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -87.58 -7.32 57.66 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.765 0.793 . . . . 0.0 110.695 -178.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.403 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 33.2 p-80 -124.58 159.31 30.96 Favored 'General case' 0 C--N 1.299 -1.605 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.54 -175.685 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 31.0 pt -130.29 170.85 18.54 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.908 -177.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -105.21 136.23 45.09 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -128.21 136.6 51.31 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 121.01 0.433 . . . . 0.0 109.879 178.178 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.462 ' O ' ' HA ' ' A' ' 83' ' ' THR . 52.2 mtmt -120.29 146.46 46.07 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.016 0.436 . . . . 0.0 109.911 179.666 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.616 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 3.8 p -124.56 132.6 71.1 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.615 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.832 -178.28 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -119.26 127.67 53.46 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 121.234 0.54 . . . . 0.0 110.36 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -103.0 147.39 16.89 Favored Glycine 0 N--CA 1.433 -1.556 0 C-N-CA 121.019 -0.61 . . . . 0.0 111.943 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.521 ' HG3' ' HA ' ' A' ' 87' ' ' PHE . 0.0 OUTLIER -51.93 -24.49 6.49 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 177.89 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -75.04 -18.17 60.37 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.218 0.532 . . . . 0.0 110.734 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 106.01 27.4 5.67 Favored Glycine 0 CA--C 1.499 -0.965 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.088 175.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.569 ' HB3' ' NE2' ' A' ' 51' ' ' GLN . 71.0 m -111.29 147.63 34.67 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 120.656 0.265 . . . . 0.0 110.491 179.389 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.616 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.4 p -145.81 132.33 14.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.188 0.518 . . . . 0.0 111.667 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 t -124.15 139.66 49.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -108.03 142.4 38.26 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.816 0.341 . . . . 0.0 110.771 179.741 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.513 ' HE1' HG12 ' A' ' 22' ' ' VAL . 20.8 m-85 -136.39 152.96 51.19 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.37 0.605 . . . . 0.0 111.797 -177.566 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.403 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 29.1 pt -133.49 162.77 39.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.014 0.435 . . . . 0.0 111.063 -176.416 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.403 ' HB2' ' HB ' ' A' ' 38' ' ' THR . 36.0 mtmm -74.72 147.15 41.64 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 178.766 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.9 ptt180 -71.24 -13.16 61.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.682 0.753 . . . . 0.0 110.243 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 -100.52 -5.64 26.64 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -178.074 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.403 ' HB ' ' HB2' ' A' ' 35' ' ' LYS . 1.0 OUTLIER -94.8 141.89 23.95 Favored Pre-proline 0 N--CA 1.445 -0.719 0 CA-C-N 114.763 -1.108 . . . . 0.0 109.73 179.758 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -63.09 128.92 24.14 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.257 1.971 . . . . 0.0 112.375 -179.2 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.533 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.1 pt? -69.26 -17.29 63.74 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.692 0.758 . . . . 0.0 110.446 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.416 ' N ' HD23 ' A' ' 40' ' ' LEU . 0.9 OUTLIER -51.73 -28.96 16.72 Favored 'General case' 0 C--N 1.31 -1.111 0 C-N-CA 124.43 1.092 . . . . 0.0 111.204 178.57 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 51.5 mtpt -63.38 -43.14 98.47 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.897 179.372 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.3 pp -73.04 -38.64 66.43 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 120.938 0.399 . . . . 0.0 109.985 178.629 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 59.7 mtm -60.74 -49.41 77.59 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 121.049 0.452 . . . . 0.0 111.108 -179.425 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.439 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 47.7 mtpt -68.67 -35.36 77.12 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.821 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.488 ' O ' ' HG2' ' A' ' 50' ' ' ARG . . . -63.86 -38.03 89.58 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.055 0.455 . . . . 0.0 110.004 178.346 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -57.02 -56.34 22.98 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.849 178.618 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.49 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 26.1 p -63.46 -37.62 87.99 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.869 0.366 . . . . 0.0 111.45 -177.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.439 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 44.8 mt-10 -67.61 -36.45 80.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.788 0.328 . . . . 0.0 111.732 -179.416 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.488 ' HG2' ' O ' ' A' ' 46' ' ' ALA . 14.2 ptm180 -85.23 -37.39 20.14 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 121.96 -0.462 . . . . 0.0 111.695 -179.382 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.569 ' NE2' ' HB3' ' A' ' 28' ' ' SER . 13.1 mm100 -77.67 -21.88 51.44 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -176.599 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 92.45 37.14 5.96 Favored Glycine 0 N--CA 1.439 -1.165 0 C-N-CA 120.281 -0.962 . . . . 0.0 111.173 -178.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.49 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 4.0 mm? -122.25 162.99 20.42 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -179.641 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.428 ' HB2' ' HB2' ' A' ' 57' ' ' GLN . 16.6 m -116.72 152.83 33.49 Favored 'General case' 0 C--N 1.312 -1.036 0 O-C-N 122.017 -0.427 . . . . 0.0 110.556 178.912 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 11.9 mmt -63.73 -25.9 68.41 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.542 0.687 . . . . 0.0 111.283 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.613 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.56 -16.79 38.25 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.325 0.583 . . . . 0.0 110.735 177.133 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.601 ' NE2' ' HG2' ' A' ' 56' ' ' ARG . 2.7 mp0 -93.31 -27.04 17.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.8 -179.357 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.6 pt -129.86 -179.12 2.92 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-O 121.062 0.458 . . . . 0.0 111.266 -179.49 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.452 ' HA ' ' HD3' ' A' ' 59' ' ' ARG . 8.3 mmt180 -158.17 143.29 16.57 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.851 177.609 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -100.74 145.55 28.35 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.621 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.2 ttt180 -142.48 148.08 37.11 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 120.884 0.373 . . . . 0.0 110.547 -178.026 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.524 ' HB2' HD11 ' A' ' 67' ' ' ILE . 73.8 t80 -152.72 143.69 23.01 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 178.292 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.0 t70 54.92 23.91 5.42 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.509 0.724 . . . . 0.0 111.244 -178.162 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.92 -23.34 20.91 Favored Glycine 0 N--CA 1.435 -1.427 0 C-N-CA 120.906 -0.664 . . . . 0.0 112.679 -178.643 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -94.18 150.4 38.3 Favored Pre-proline 0 C--N 1.315 -0.912 0 O-C-N 122.516 -0.402 . . . . 0.0 110.954 -178.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -72.47 143.32 38.36 Favored 'Trans proline' 0 N--CA 1.462 -0.326 0 C-N-CA 122.434 2.089 . . . . 0.0 111.575 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.524 HD11 ' HB2' ' A' ' 62' ' ' PHE . 38.4 mt -93.31 143.08 12.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-O 120.977 0.417 . . . . 0.0 110.296 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -114.07 157.5 22.47 Favored 'General case' 0 CA--C 1.499 -0.985 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 178.037 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -74.11 -12.04 60.48 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-O 121.24 0.543 . . . . 0.0 110.445 178.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.6 p -95.11 6.28 49.5 Favored 'General case' 0 N--CA 1.438 -1.033 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 178.206 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -100.13 162.12 13.17 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.974 0.416 . . . . 0.0 111.238 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -116.18 155.34 48.31 Favored Pre-proline 0 C--N 1.318 -0.765 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.149 176.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -61.12 -34.6 89.27 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.715 2.277 . . . . 0.0 111.779 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.72 -10.94 60.0 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.288 -179.219 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -77.05 -40.74 45.19 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 121.351 0.596 . . . . 0.0 109.758 179.607 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.47 12.22 8.9 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.197 -179.604 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 43.61 43.69 4.86 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.293 1.037 . . . . 0.0 112.134 178.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.2 ptm -86.81 164.89 16.4 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.461 -178.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -117.68 167.82 11.0 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.86 0.362 . . . . 0.0 110.399 -178.097 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -60.96 142.74 56.23 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.639 0.733 . . . . 0.0 112.171 177.236 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 73.82 16.51 3.74 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 124.856 1.263 . . . . 0.0 111.506 178.276 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -77.47 162.09 27.44 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 177.058 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' THR . . . . . 0.462 ' HA ' ' O ' ' A' ' 21' ' ' LYS . 37.1 m -116.34 139.01 50.86 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 121.661 0.743 . . . . 0.0 112.953 -175.854 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 44.6 mm -98.48 143.02 13.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.538 178.508 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -102.39 122.08 43.58 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.847 0.356 . . . . 0.0 110.702 178.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.473 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 76.7 t -115.0 137.86 47.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.717 0 CA-C-O 121.17 0.51 . . . . 0.0 110.932 178.546 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.521 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 5.3 p90 -136.26 153.04 51.31 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.458 -179.555 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -80.98 113.56 19.27 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.354 0.597 . . . . 0.0 111.479 -177.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 75.9 mm-40 -104.67 21.96 15.92 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-O 121.359 0.599 . . . . 0.0 110.083 176.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -61.96 138.49 58.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.05 -179.349 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 15.2 p -66.64 -44.53 81.69 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.171 0.51 . . . . 0.0 111.875 -178.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 104.61 -61.93 0.38 Allowed Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.5 -179.695 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.968 0 CA-C-O 118.79 -1.006 . . . . 0.0 111.604 177.974 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 ptm . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 120.957 0.408 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -114.29 17.62 17.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.908 0.861 . . . . 0.0 109.273 179.379 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -81.99 -7.32 59.6 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.083 -178.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -117.83 12.29 13.8 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.101 0.476 . . . . 0.0 110.51 178.631 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.402 ' HB3' ' HD2' ' A' ' 6' ' ' PRO . 38.7 mmtm -143.17 169.82 9.87 Favored Pre-proline 0 C--N 1.32 -0.686 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 -175.679 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.402 ' HD2' ' HB3' ' A' ' 5' ' ' LYS . 16.5 Cg_exo -65.9 175.85 4.23 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.344 2.029 . . . . 0.0 112.745 178.417 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.483 ' HD2' ' H ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -74.37 -5.82 44.56 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.312 179.156 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -67.74 133.48 49.34 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.179 0.514 . . . . 0.0 111.037 -178.074 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 125.49 -14.32 7.28 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.665 -177.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.1 p -81.18 110.12 16.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 121.464 0.649 . . . . 0.0 111.803 -179.143 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -120.75 99.28 6.44 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.067 178.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.0 t -121.93 141.97 50.75 Favored 'General case' 0 C--N 1.306 -1.284 0 O-C-N 122.022 -0.424 . . . . 0.0 109.967 178.566 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -50.35 147.3 4.46 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.385 0.612 . . . . 0.0 112.239 177.502 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -139.98 10.88 2.41 Favored 'General case' 0 CA--C 1.509 -0.628 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 175.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -105.74 110.74 23.14 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 113.043 0.757 . . . . 0.0 113.043 -171.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.0 t0 50.51 48.85 21.85 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 114.666 1.358 . . . . 0.0 114.666 169.075 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 32.9 p80 -122.37 148.1 45.48 Favored 'General case' 0 C--N 1.319 -0.732 0 O-C-N 121.714 -0.616 . . . . 0.0 110.922 175.742 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 44.3 pt -129.54 166.95 25.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 121.435 0.636 . . . . 0.0 111.656 -175.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.511 ' HB2' ' OH ' ' A' ' 33' ' ' ALY . 4.5 t30 -97.29 139.94 32.51 Favored 'General case' 0 CA--C 1.506 -0.712 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.872 178.601 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.402 HD13 ' O ' ' A' ' 19' ' ' ASN . 3.0 mm? -130.93 139.98 50.13 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 176.8 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 47.3 mtmt -125.38 145.28 50.12 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-O 121.07 0.462 . . . . 0.0 110.515 -179.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.662 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 2.5 p -126.23 131.79 71.17 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.638 -178.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -112.57 131.71 55.48 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-O 121.195 0.522 . . . . 0.0 110.884 -178.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -96.94 176.44 31.97 Favored Glycine 0 N--CA 1.438 -1.178 0 CA-C-N 116.24 -0.437 . . . . 0.0 112.483 -179.446 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.461 HE21 ' HB2' ' A' ' 88' ' ' GLN . 0.1 OUTLIER -69.39 -24.58 63.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.738 0.78 . . . . 0.0 110.739 -177.894 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -83.93 -4.76 58.95 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.86 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.53 3.57 64.61 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.515 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.5 t -77.58 156.02 31.14 Favored 'General case' 0 C--N 1.322 -0.63 0 O-C-N 122.357 -0.496 . . . . 0.0 109.692 178.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.662 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.5 p -149.3 136.61 13.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-O 121.01 0.433 . . . . 0.0 110.587 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.5 t -119.89 136.57 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.72 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 179.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -108.32 143.42 37.22 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.016 0.436 . . . . 0.0 110.785 -179.399 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.517 ' HE1' HG12 ' A' ' 22' ' ' VAL . 11.4 m-85 -139.4 154.5 47.83 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.085 0.469 . . . . 0.0 110.952 -178.064 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ALY . . . . . 0.511 ' OH ' ' HB2' ' A' ' 19' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 31.9 pt -134.48 165.12 32.33 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.007 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.468 -175.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 32.0 mtmm -75.27 146.85 40.73 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 120.833 0.349 . . . . 0.0 110.604 178.221 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.434 ' HA ' ' HG2' ' A' ' 73' ' ' PRO . 5.7 ppt_? -71.39 -11.1 60.72 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.435 0.636 . . . . 0.0 110.891 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -101.94 -4.07 26.76 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.441 ' HB ' ' O ' ' A' ' 35' ' ' LYS . 1.3 m -92.36 137.33 24.72 Favored Pre-proline 0 N--CA 1.44 -0.94 0 CA-C-N 114.441 -1.254 . . . . 0.0 109.918 178.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -60.45 130.61 34.44 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.599 2.2 . . . . 0.0 112.443 -179.286 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.469 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.2 pp -70.18 -17.34 63.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.154 -0.475 . . . . 0.0 112.011 -179.215 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.468 ' N ' HD12 ' A' ' 40' ' ' LEU . 3.8 p -53.49 -28.58 31.64 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.94 -179.645 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 29.5 mtpp -59.6 -47.38 85.79 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.281 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.8 pp -73.75 -36.28 65.11 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.797 -179.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 39.8 mtm -63.03 -49.41 74.7 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 121.068 0.461 . . . . 0.0 111.02 -178.157 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.446 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 42.9 mtpt -69.53 -33.32 72.62 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.919 0.39 . . . . 0.0 110.604 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.0 -36.53 84.29 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.302 0.572 . . . . 0.0 109.659 177.714 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -59.23 -54.31 48.34 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.762 177.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 24.2 p -65.18 -35.2 80.34 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 122.15 -0.344 . . . . 0.0 111.211 -177.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 45.0 mt-10 -65.49 -42.1 92.54 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 120.762 0.315 . . . . 0.0 111.359 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -80.08 -33.28 38.99 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 120.969 0.414 . . . . 0.0 111.723 -178.683 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.42 ' HB3' HD23 ' A' ' 53' ' ' LEU . 24.9 mm-40 -81.84 -22.13 37.19 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -177.141 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.43 ' C ' HD22 ' A' ' 53' ' ' LEU . . . 88.42 39.57 6.73 Favored Glycine 0 N--CA 1.437 -1.239 0 C-N-CA 119.858 -1.163 . . . . 0.0 111.113 -177.339 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.496 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 4.0 mm? -125.73 168.05 14.31 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.04 0.448 . . . . 0.0 110.104 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.5 m -125.26 158.65 33.6 Favored 'General case' 0 C--N 1.312 -1.025 0 O-C-N 122.142 -0.349 . . . . 0.0 110.72 177.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 18.2 mmt -64.99 -25.29 67.8 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-O 121.367 0.603 . . . . 0.0 111.69 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.442 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.97 -14.74 43.71 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.525 0.679 . . . . 0.0 110.819 176.379 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -94.33 -26.62 16.49 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.087 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.7 pt -132.46 179.02 4.79 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-O 121.071 0.462 . . . . 0.0 110.942 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.41 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 3.8 mmt85 -153.81 140.54 19.02 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.602 178.788 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -99.59 139.85 34.64 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.333 -179.337 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.11 136.08 24.73 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.249 0.547 . . . . 0.0 110.607 -177.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.584 ' HB2' HD11 ' A' ' 67' ' ' ILE . 85.7 t80 -141.29 146.86 37.31 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.001 -179.477 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 52.0 25.79 3.36 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.576 0.75 . . . . 0.0 111.82 -179.077 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.8 -11.67 68.1 Favored Glycine 0 N--CA 1.44 -1.098 0 C-N-CA 120.836 -0.697 . . . . 0.0 113.542 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -109.01 150.37 40.85 Favored Pre-proline 0 C--N 1.319 -0.733 0 O-C-N 122.118 -0.636 . . . . 0.0 111.075 -179.358 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -71.98 139.81 33.68 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 122.613 2.208 . . . . 0.0 111.724 179.197 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.584 HD11 ' HB2' ' A' ' 62' ' ' PHE . 21.0 mt -94.75 146.92 6.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-O 120.94 0.4 . . . . 0.0 110.325 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -117.36 162.34 18.08 Favored 'General case' 0 CA--C 1.497 -1.072 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 176.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.456 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 10.0 pt-20 -70.7 -16.16 62.77 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-O 121.473 0.654 . . . . 0.0 110.489 178.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 17.3 p -86.6 -13.93 44.29 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -177.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.06 160.42 19.3 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 121.508 0.67 . . . . 0.0 112.518 -177.556 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -113.16 154.99 45.03 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.644 178.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.434 ' HG2' ' HA ' ' A' ' 36' ' ' ARG . 19.2 Cg_endo -59.37 -29.57 90.52 Favored 'Trans proline' 0 CA--C 1.531 0.359 0 C-N-CA 123.005 2.47 . . . . 0.0 111.785 178.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -75.78 -19.04 59.29 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.202 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -68.6 -42.64 77.88 Favored 'General case' 0 CA--C 1.51 -0.588 0 CA-C-O 121.726 0.774 . . . . 0.0 109.831 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.418 ' H ' HD12 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -85.31 6.84 24.55 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.594 -179.792 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 43.39 43.22 4.2 Favored 'General case' 0 C--N 1.359 1.018 0 C-N-CA 124.381 1.073 . . . . 0.0 111.995 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.4 ptm -83.38 169.64 15.38 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.677 -178.059 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 12.5 pt-20 -117.2 168.3 10.43 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 110.097 -0.335 . . . . 0.0 110.097 -179.421 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -58.95 142.86 49.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.52 0.676 . . . . 0.0 111.842 175.761 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 73.62 16.02 3.97 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 124.674 1.189 . . . . 0.0 111.902 179.246 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.453 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 1.5 t0 -73.63 155.5 38.97 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.211 -0.596 . . . . 0.0 109.631 178.434 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 34.7 m -111.58 136.87 50.18 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.636 0.732 . . . . 0.0 112.746 -174.216 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 43.1 mm -99.52 138.61 23.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.765 178.369 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -98.22 120.44 38.63 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.817 0.342 . . . . 0.0 110.324 178.31 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.41 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 96.7 t -113.04 138.73 41.46 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.081 0 CA-C-O 121.064 0.459 . . . . 0.0 109.899 177.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 14.8 p90 -137.28 153.27 50.36 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.016 -179.059 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.461 ' HB2' HE21 ' A' ' 25' ' ' GLN . 4.4 tp60 -80.03 116.6 20.25 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.364 0.602 . . . . 0.0 112.039 -176.724 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 71.1 mm-40 -110.54 18.99 19.18 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.63 176.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.539 ' HG2' ' H ' ' A' ' 92' ' ' GLY . 54.5 tt0 -54.64 120.05 6.16 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.819 -179.107 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 7.7 t -97.25 33.16 2.02 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.798 0.809 . . . . 0.0 110.562 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLY . . . . . 0.539 ' H ' ' HG2' ' A' ' 90' ' ' GLN . . . -161.72 43.37 0.38 Allowed Glycine 0 N--CA 1.444 -0.783 0 N-CA-C 111.488 -0.645 . . . . 0.0 111.488 -178.007 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.248 0 CA-C-O 118.293 -1.282 . . . . 0.0 111.477 -179.162 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 ptt? . . . . . 0 N--CA 1.481 1.086 0 CA-C-O 120.831 0.348 . . . . 0.0 111.621 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.6 10.25 13.79 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.585 0.707 . . . . 0.0 110.53 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -81.69 -16.52 51.01 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.766 -179.609 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -67.2 97.53 0.54 Allowed 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.399 -178.712 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.1 tmtp? 63.36 83.48 0.2 Allowed Pre-proline 0 CA--C 1.538 0.505 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.874 177.67 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -84.57 -170.69 0.85 Allowed 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 122.844 2.363 . . . . 0.0 112.301 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.408 ' C ' ' HD2' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -97.05 3.85 51.66 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.291 0.567 . . . . 0.0 111.26 -179.297 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -136.76 175.52 9.53 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.928 -176.662 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.17 -55.87 0.96 Allowed Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.816 -0.707 . . . . 0.0 111.497 178.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.8 p -111.02 121.31 63.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.27 0.557 . . . . 0.0 110.405 178.434 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.64 126.01 30.24 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.594 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.2 t -141.31 136.75 31.86 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.322 0.582 . . . . 0.0 110.999 -178.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -116.07 106.67 14.01 Favored 'General case' 0 CA--C 1.5 -0.948 0 CA-C-O 121.555 0.693 . . . . 0.0 110.907 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -106.63 133.73 50.86 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-N 115.347 -0.842 . . . . 0.0 108.902 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -68.04 100.36 0.98 Allowed 'General case' 0 C--N 1.295 -1.774 0 CA-C-O 121.573 0.701 . . . . 0.0 111.381 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -78.09 94.94 4.77 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.945 -177.535 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.507 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 56.6 p-80 -122.37 154.53 37.56 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.635 -179.31 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 40.3 pt -131.19 169.39 21.79 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.078 0 CA-C-O 121.364 0.602 . . . . 0.0 110.885 -178.017 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -103.49 139.73 38.45 Favored 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 177.481 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.405 HD23 HG12 ' A' ' 34' ' ' ILE . 3.2 mm? -126.75 136.97 53.13 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 177.488 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.48 ' HG2' ' HG3' ' A' ' 31' ' ' GLN . 52.1 mtmt -124.12 139.08 54.28 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.269 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.733 HG22 HG13 ' A' ' 84' ' ' ILE . 61.0 t -124.65 130.58 73.4 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.387 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -175.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -115.56 135.82 53.7 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 -178.207 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -121.46 162.0 15.35 Favored Glycine 0 N--CA 1.445 -0.763 0 C-N-CA 120.449 -0.881 . . . . 0.0 112.871 -178.48 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.594 ' HG2' ' HA ' ' A' ' 87' ' ' PHE . 22.8 mm-40 -66.17 -11.73 51.3 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.503 0.668 . . . . 0.0 110.397 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -78.23 6.82 7.35 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.431 179.574 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 72.82 36.36 57.83 Favored Glycine 0 C--N 1.338 0.658 0 C-N-CA 120.696 -0.764 . . . . 0.0 113.405 178.481 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.4 t -143.24 160.92 39.57 Favored 'General case' 0 C--N 1.314 -0.948 0 O-C-N 122.14 -0.623 . . . . 0.0 111.35 -179.09 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.554 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.8 p -149.32 139.12 16.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.39 -179.027 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.516 HG11 ' HD3' ' A' ' 50' ' ' ARG . 7.9 t -124.31 142.46 41.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 O-C-N 122.119 -0.363 . . . . 0.0 110.43 -179.483 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.48 ' HG3' ' HG2' ' A' ' 21' ' ' LYS . 0.5 OUTLIER -107.98 141.15 40.07 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 120.916 0.389 . . . . 0.0 110.997 179.092 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -135.72 153.94 51.42 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.921 0.391 . . . . 0.0 111.111 -178.283 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.405 HG12 HD23 ' A' ' 20' ' ' LEU . 30.2 pt -137.23 166.52 25.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-O 121.086 0.469 . . . . 0.0 110.263 -178.701 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.507 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 36.9 mtmm -75.73 139.57 41.95 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 177.237 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.426 ' HA ' ' HG2' ' A' ' 73' ' ' PRO . 8.1 ppt_? -69.32 -11.99 61.29 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.448 0.642 . . . . 0.0 110.608 179.383 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 15.2 t-160 -99.23 2.53 45.75 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 122.181 0.991 . . . . 0.0 108.503 179.607 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.429 ' HB ' ' HB2' ' A' ' 35' ' ' LYS . 0.9 OUTLIER -103.4 143.29 26.32 Favored Pre-proline 0 N--CA 1.447 -0.599 0 CA-C-N 114.805 -1.089 . . . . 0.0 109.831 178.635 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -60.83 130.08 31.59 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 122.691 2.26 . . . . 0.0 112.493 -179.159 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.557 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.3 pp -70.34 -16.25 62.96 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.09 -0.504 . . . . 0.0 112.014 -179.41 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.459 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 0.1 OUTLIER -51.45 -29.6 16.79 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 122.955 0.502 . . . . 0.0 111.847 179.994 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -61.09 -47.85 84.41 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.222 0.534 . . . . 0.0 110.317 179.028 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.4 pp -73.5 -32.31 64.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.821 -178.724 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 46.7 mtm -62.76 -50.28 71.67 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.006 0.432 . . . . 0.0 111.018 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.45 ' HA ' ' SG ' ' A' ' 48' ' ' CYS . 81.0 mttt -66.97 -33.95 76.7 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.104 178.484 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.72 -35.88 82.47 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.169 0.509 . . . . 0.0 109.936 179.146 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -62.61 -56.63 16.07 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.544 178.17 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.509 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 26.3 p -62.1 -36.25 81.16 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.728 0.299 . . . . 0.0 111.649 -177.326 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -64.23 -44.32 92.22 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 120.905 0.383 . . . . 0.0 111.605 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.516 ' HD3' HG11 ' A' ' 30' ' ' VAL . 14.0 ptm180 -80.57 -32.01 36.68 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.047 0.451 . . . . 0.0 111.464 -177.526 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -80.91 -23.32 39.03 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.114 0.483 . . . . 0.0 112.006 -178.305 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.59 36.07 8.18 Favored Glycine 0 C--N 1.306 -1.084 0 C-N-CA 120.321 -0.943 . . . . 0.0 111.483 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.509 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 3.8 mm? -119.86 160.52 22.49 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 178.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.559 ' HB2' ' NE2' ' A' ' 57' ' ' GLN . 67.3 m -114.33 157.69 22.46 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 122.162 -0.336 . . . . 0.0 110.227 179.138 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 16.7 mmt -64.66 -27.57 69.01 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.264 0.554 . . . . 0.0 111.208 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.565 ' O ' ' HA ' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -86.24 -7.59 58.42 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.427 0.632 . . . . 0.0 110.29 177.021 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.559 ' NE2' ' HB2' ' A' ' 54' ' ' SER . 1.8 mp0 -97.84 -19.83 17.9 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.59 -178.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 14.8 pt -144.88 -177.39 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 CA-C-O 121.102 0.477 . . . . 0.0 111.241 -177.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.409 ' CG ' ' HG3' ' A' ' 89' ' ' GLN . 16.8 mmt180 -155.58 141.45 18.12 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.56 177.656 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -96.63 139.82 32.14 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 178.493 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -140.4 139.83 35.37 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.245 0.545 . . . . 0.0 110.905 -178.153 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.53 ' HB2' HD11 ' A' ' 67' ' ' ILE . 64.3 t80 -144.88 147.01 32.29 Favored 'General case' 0 C--O 1.21 -1.017 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.956 178.793 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.8 t70 57.0 23.45 8.36 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 121.633 0.73 . . . . 0.0 110.805 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.6 -2.69 86.95 Favored Glycine 0 N--CA 1.429 -1.791 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.816 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.407 ' HG2' ' O ' ' A' ' 62' ' ' PHE . 3.5 pt20 -115.14 148.74 41.3 Favored Pre-proline 0 C--N 1.323 -0.549 0 O-C-N 122.293 -0.534 . . . . 0.0 110.645 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -69.33 142.94 51.29 Favored 'Trans proline' 0 C--O 1.236 0.392 0 C-N-CA 122.323 2.015 . . . . 0.0 111.836 179.434 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.53 HD11 ' HB2' ' A' ' 62' ' ' PHE . 32.4 mt -96.4 146.24 7.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.972 0.415 . . . . 0.0 110.53 -179.422 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -126.21 170.32 11.95 Favored 'General case' 0 CA--C 1.504 -0.81 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 178.399 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.459 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 11.2 pt-20 -70.32 -19.04 63.1 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-O 120.982 0.42 . . . . 0.0 111.657 -179.663 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.3 t -90.93 3.67 54.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.193 0.521 . . . . 0.0 111.288 -178.61 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.7 142.09 28.41 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-O 121.423 0.63 . . . . 0.0 111.412 178.172 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.695 ' HB ' ' OE1' ' A' ' 75' ' ' GLN . 1.1 m -112.48 140.69 24.07 Favored Pre-proline 0 C--N 1.317 -0.82 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.487 ' HD2' HG22 ' A' ' 72' ' ' THR . 15.7 Cg_endo -54.23 -33.75 76.55 Favored 'Trans proline' 0 N--CA 1.481 0.76 0 C-N-CA 123.478 2.785 . . . . 0.0 113.244 -176.699 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.45 -27.12 64.97 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.0 0.429 . . . . 0.0 111.574 -178.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.695 ' OE1' ' HB ' ' A' ' 72' ' ' THR . 5.9 mp0 -68.29 -32.61 72.88 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.053 0.454 . . . . 0.0 111.564 -178.855 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.503 HD22 ' HD2' ' A' ' 62' ' ' PHE . 0.8 OUTLIER -92.58 10.07 31.94 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.005 0.431 . . . . 0.0 110.045 179.9 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 43.62 41.16 3.32 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.598 1.159 . . . . 0.0 112.264 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 5.9 ptm -80.3 163.62 23.8 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.5 -178.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -107.48 165.96 11.02 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.129 -177.451 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -59.48 143.23 50.58 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 121.448 0.642 . . . . 0.0 110.802 171.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 69.55 19.15 7.55 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.032 -0.985 . . . . 0.0 111.67 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -62.49 149.27 43.28 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.186 176.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.0 m -102.05 122.09 43.44 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 121.597 0.713 . . . . 0.0 112.052 -177.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.733 HG13 HG22 ' A' ' 22' ' ' VAL . 14.0 mm -93.22 139.15 18.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.658 179.033 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -97.57 118.79 34.87 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 120.989 0.423 . . . . 0.0 110.687 179.248 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 43.5 t -114.06 133.11 61.1 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 CA-C-O 121.406 0.622 . . . . 0.0 110.114 176.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.594 ' HA ' ' HG2' ' A' ' 25' ' ' GLN . 24.2 p90 -134.39 153.37 51.94 Favored 'General case' 0 C--N 1.3 -1.587 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.431 -178.355 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.437 ' O ' ' HG2' ' A' ' 89' ' ' GLN . 0.4 OUTLIER -62.27 157.9 18.5 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-O 121.12 0.486 . . . . 0.0 110.747 179.711 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.437 ' HG2' ' O ' ' A' ' 88' ' ' GLN . 35.0 mm-40 -163.07 17.4 0.08 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.696 -177.197 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.565 ' HA ' ' O ' ' A' ' 56' ' ' ARG . 0.6 OUTLIER -65.85 107.09 1.71 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.764 0.792 . . . . 0.0 111.337 -178.629 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 10.0 m -136.45 117.31 14.15 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.855 -179.128 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -177.18 155.52 18.18 Favored Glycine 0 N--CA 1.444 -0.817 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.038 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.125 0 CA-C-O 118.674 -1.07 . . . . 0.0 111.744 179.741 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.1 ttt . . . . . 0 N--CA 1.473 0.712 0 CA-C-O 121.076 0.465 . . . . 0.0 112.149 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -101.83 10.46 39.86 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -175.902 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -78.08 -27.06 48.43 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.049 0.452 . . . . 0.0 111.045 179.044 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -63.09 94.59 0.07 Allowed 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.133 0.492 . . . . 0.0 111.187 179.802 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -170.42 106.93 0.43 Allowed Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.051 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.405 ' HB2' ' HG2' ' A' ' 8' ' ' GLU . 1.2 Cg_endo -83.76 170.73 11.2 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 122.9 2.4 . . . . 0.0 113.372 -178.407 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.94 -27.88 2.41 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.967 173.182 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.405 ' HG2' ' HB2' ' A' ' 6' ' ' PRO . 6.9 pt-20 -91.51 149.72 21.55 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 120.935 0.397 . . . . 0.0 109.964 179.542 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -67.64 -53.88 21.9 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.955 -0.641 . . . . 0.0 112.362 -177.019 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 12.2 p -143.71 151.25 16.66 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 178.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.8 tptt -83.54 154.38 23.86 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 109.851 -0.425 . . . . 0.0 109.851 -177.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.2 t -150.21 164.7 35.01 Favored 'General case' 0 C--N 1.316 -0.865 0 O-C-N 122.139 -0.351 . . . . 0.0 110.453 179.33 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 67.02 74.82 0.32 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.674 0.79 . . . . 0.0 112.318 -178.869 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 70.7 85.01 0.14 Allowed 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.788 177.744 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -102.6 -154.52 0.49 Allowed 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.846 -178.082 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.48 ' O ' ' HG2' ' A' ' 36' ' ' ARG . 7.3 p-10 -75.41 10.17 1.78 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.094 0.473 . . . . 0.0 112.077 -178.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 11.5 p-80 -114.69 136.17 53.35 Favored 'General case' 0 C--N 1.311 -1.089 0 O-C-N 121.893 -0.505 . . . . 0.0 109.681 177.46 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 43.5 pt -128.01 167.47 23.01 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.072 0 CA-C-O 121.105 0.478 . . . . 0.0 111.036 -176.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.51 ' HA ' ' O ' ' A' ' 32' ' ' PHE . 45.1 t-20 -107.18 128.03 54.05 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.719 -0.475 . . . . 0.0 109.719 179.412 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -118.64 134.06 55.39 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 178.156 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.4 mtmp? -115.37 149.18 38.35 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-O 120.999 0.428 . . . . 0.0 109.979 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.701 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 2.7 p -125.15 129.01 73.3 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.011 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.693 -177.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -110.64 120.84 43.72 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.058 0.456 . . . . 0.0 109.836 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.52 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -92.88 156.07 22.81 Favored Glycine 0 N--CA 1.427 -1.946 0 C-N-CA 120.575 -0.822 . . . . 0.0 112.837 -178.673 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.56 -13.42 1.56 Allowed 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 178.562 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -90.3 -13.3 35.54 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.131 0.491 . . . . 0.0 110.728 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 104.94 6.56 39.82 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 121.01 -0.614 . . . . 0.0 112.225 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 40.1 t -89.83 155.53 19.1 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 120.821 0.343 . . . . 0.0 110.421 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.701 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.7 p -147.95 134.59 13.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 CA-C-O 121.096 0.474 . . . . 0.0 110.714 178.74 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.5 t -122.22 139.23 49.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -107.74 142.79 37.2 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 120.741 0.305 . . . . 0.0 110.907 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.529 ' HE1' HG12 ' A' ' 22' ' ' VAL . 10.1 m-85 -140.73 146.79 38.22 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-O 121.318 0.58 . . . . 0.0 111.587 -178.422 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 39.9 pt -131.89 173.84 14.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 120.965 0.412 . . . . 0.0 110.594 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 28.9 mtmm -87.66 150.14 23.83 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 120.923 0.392 . . . . 0.0 110.421 178.274 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.48 ' HG2' ' O ' ' A' ' 16' ' ' ASP . 23.8 ptt180 -62.68 -24.33 67.58 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.488 0.661 . . . . 0.0 111.099 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 14.6 t60 -103.11 1.72 33.67 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.883 0.849 . . . . 0.0 109.594 -177.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.1 m -92.56 139.35 23.7 Favored Pre-proline 0 C--N 1.31 -1.123 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.878 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.76 128.64 19.32 Favored 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 121.934 1.756 . . . . 0.0 112.185 -177.065 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.529 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.0 OUTLIER -66.83 -16.86 64.57 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.01 -179.445 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.562 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 1.0 OUTLIER -52.14 -29.87 24.01 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.921 0.391 . . . . 0.0 111.882 179.607 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 35.3 mtpt -62.83 -44.58 95.75 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-O 120.996 0.427 . . . . 0.0 110.417 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.9 pp -73.47 -33.9 65.09 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 120.896 0.379 . . . . 0.0 110.29 178.71 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 47.8 mtm -62.12 -49.31 76.4 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 121.32 0.581 . . . . 0.0 110.411 -179.677 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -68.65 -35.3 77.07 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.073 178.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.13 -33.13 75.06 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.309 0.576 . . . . 0.0 109.826 178.098 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 62.3 t80 -63.72 -55.19 25.2 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.797 178.028 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.427 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 25.3 p -63.13 -35.82 81.56 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.803 0.335 . . . . 0.0 110.922 -178.082 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -61.75 -48.63 79.83 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 121.035 0.445 . . . . 0.0 111.422 178.486 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -76.72 -31.08 56.92 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.967 0.413 . . . . 0.0 111.383 -177.429 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -82.77 -21.96 34.47 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 -178.421 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 93.75 8.13 60.95 Favored Glycine 0 CA--C 1.523 0.561 0 C-N-CA 120.268 -0.968 . . . . 0.0 113.319 179.086 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.427 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 3.2 mm? -97.98 173.74 6.91 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 122.205 -0.585 . . . . 0.0 111.01 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 71.7 m -122.27 157.8 30.91 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 120.719 0.295 . . . . 0.0 111.154 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.7 mmt -63.7 -27.28 69.1 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.118 0.485 . . . . 0.0 112.247 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.73 -12.61 53.42 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.636 0.731 . . . . 0.0 109.944 177.531 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -93.66 -30.97 14.65 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.699 -177.721 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 9.6 pt -132.56 177.34 7.26 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-O 121.132 0.492 . . . . 0.0 111.5 -177.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.403 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 12.9 mmt180 -150.1 143.77 25.3 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.164 179.407 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -100.9 141.44 33.78 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.705 179.221 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -142.99 139.34 30.59 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-O 121.19 0.519 . . . . 0.0 111.118 -177.002 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.547 ' HB2' HD11 ' A' ' 67' ' ' ILE . 72.5 t80 -144.61 145.92 32.03 Favored 'General case' 0 C--O 1.214 -0.767 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.782 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 16.7 t70 57.43 23.44 9.04 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 121.885 0.85 . . . . 0.0 109.962 -178.357 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.77 -25.88 8.05 Favored Glycine 0 N--CA 1.426 -1.977 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.548 -178.464 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -90.25 149.26 40.95 Favored Pre-proline 0 C--N 1.323 -0.561 0 O-C-N 122.582 -0.363 . . . . 0.0 111.301 -177.427 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -71.7 141.58 37.98 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 122.206 1.938 . . . . 0.0 111.391 178.782 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.547 HD11 ' HB2' ' A' ' 62' ' ' PHE . 39.0 mt -91.9 149.27 4.18 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-O 120.964 0.411 . . . . 0.0 110.905 -177.657 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -115.53 175.57 5.46 Favored 'General case' 0 CA--C 1.502 -0.903 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 177.662 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.562 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 0.2 OUTLIER -77.5 -20.67 53.96 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-O 121.503 0.668 . . . . 0.0 110.223 179.423 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.8 t -95.22 8.59 42.6 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.843 0.83 . . . . 0.0 110.529 -178.346 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -78.49 134.97 37.26 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.0 178.006 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.27 137.42 21.52 Favored Pre-proline 0 C--N 1.311 -1.074 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.035 176.206 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.593 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 10.9 Cg_endo -55.81 -34.13 90.31 Favored 'Trans proline' 0 C--O 1.236 0.375 0 C-N-CA 123.027 2.485 . . . . 0.0 112.477 -177.622 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.25 -17.39 61.34 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.795 -179.142 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -77.6 -33.66 53.7 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.916 0.388 . . . . 0.0 110.98 -179.549 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -89.86 -2.85 58.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.24 0.543 . . . . 0.0 109.974 178.662 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 57.01 36.75 28.18 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.862 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.593 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.9 ptm -76.27 160.83 29.28 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.635 -178.688 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.491 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 12.3 pt-20 -112.51 166.11 11.62 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-O 120.854 0.359 . . . . 0.0 110.469 -177.285 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -62.76 148.27 47.26 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 121.343 0.592 . . . . 0.0 110.975 174.474 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 73.07 13.52 4.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.424 -179.613 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.491 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 2.2 t0 -74.66 158.66 33.23 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.798 -0.361 . . . . 0.0 110.154 178.494 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 39.6 m -116.01 136.59 52.89 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.783 0.801 . . . . 0.0 112.982 -176.126 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.429 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 44.5 mm -97.26 140.94 16.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.371 178.668 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -99.11 117.38 33.46 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.707 0.289 . . . . 0.0 110.28 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.52 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 73.0 t -113.52 136.11 50.95 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 CA-C-O 121.432 0.634 . . . . 0.0 110.671 178.902 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -137.34 155.26 49.63 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.075 -178.537 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 36.2 tp60 -80.83 111.91 17.72 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.187 0.517 . . . . 0.0 110.999 -176.602 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 64.4 mm-40 -109.49 30.95 6.16 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.744 179.241 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -62.18 96.45 0.07 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.177 0.513 . . . . 0.0 110.329 178.212 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.4 p -144.02 149.09 36.15 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.296 -179.39 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 111.02 -33.57 5.81 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.749 -0.738 . . . . 0.0 111.793 -179.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.263 0 CA-C-O 118.59 -1.117 . . . . 0.0 111.333 179.013 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ptt? . . . . . 0 N--CA 1.476 0.859 0 CA-C-O 121.114 0.483 . . . . 0.0 111.403 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -124.42 25.72 7.56 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 122.135 0.969 . . . . 0.0 108.601 178.187 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -85.25 -0.05 53.44 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.915 -1.038 . . . . 0.0 112.004 -177.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.486 ' O ' ' HG2' ' A' ' 5' ' ' LYS . 36.7 mt-10 -113.84 98.27 6.91 Favored 'General case' 0 C--N 1.321 -0.636 0 O-C-N 122.298 -0.251 . . . . 0.0 110.499 177.624 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.486 ' HG2' ' O ' ' A' ' 4' ' ' GLU . 13.9 pttp 54.91 166.1 0.05 OUTLIER Pre-proline 0 N--CA 1.485 1.286 0 C-N-CA 124.773 1.229 . . . . 0.0 112.201 -178.602 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.411 ' HD2' ' HB2' ' A' ' 5' ' ' LYS . 86.9 Cg_endo -83.33 -177.23 3.15 Favored 'Trans proline' 0 C--O 1.241 0.631 0 C-N-CA 121.995 1.797 . . . . 0.0 111.356 176.358 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.505 ' HD2' ' HG3' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -98.44 -16.6 19.18 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.336 0.588 . . . . 0.0 110.863 178.539 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.505 ' HG3' ' HD2' ' A' ' 7' ' ' LYS . 0.8 OUTLIER -125.84 144.94 50.45 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.858 174.967 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -153.0 86.58 0.14 Allowed Glycine 0 N--CA 1.439 -1.138 0 C-N-CA 120.007 -1.092 . . . . 0.0 112.592 -177.078 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 46.3 t -67.12 131.91 32.57 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 177.22 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 25.6 tptp -65.76 106.76 1.59 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.478 0.656 . . . . 0.0 111.126 -177.617 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -140.03 -167.47 2.31 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.688 178.881 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -78.38 78.33 4.85 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 121.487 0.661 . . . . 0.0 109.461 176.404 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 53.5 m-20 -91.54 -25.02 19.43 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-O 121.223 0.535 . . . . 0.0 111.097 -176.556 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -103.25 126.21 50.3 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.142 0.496 . . . . 0.0 110.559 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -80.96 104.75 11.68 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 122.288 1.042 . . . . 0.0 109.448 -179.109 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.498 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 43.9 p-80 -121.11 163.03 19.03 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.753 -175.154 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 31.5 pt -133.5 170.97 18.85 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.835 178.138 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -107.46 134.03 51.09 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.405 HD23 HG12 ' A' ' 34' ' ' ILE . 2.9 mm? -125.05 139.14 54.06 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 177.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 30' ' ' VAL . 52.3 mtmt -121.8 143.43 49.4 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.281 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.728 HG22 HG13 ' A' ' 84' ' ' ILE . 65.8 t -121.68 128.87 75.86 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -179.238 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -108.51 134.97 50.55 Favored 'General case' 0 C--O 1.245 0.835 0 CA-C-O 121.377 0.608 . . . . 0.0 111.092 -177.096 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -96.18 170.68 27.58 Favored Glycine 0 N--CA 1.428 -1.847 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.899 179.136 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.78 -25.46 63.81 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.207 0.527 . . . . 0.0 110.498 -176.568 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -84.66 -2.85 58.08 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.161 -178.049 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 94.9 7.61 59.75 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 120.197 -1.002 . . . . 0.0 113.515 179.404 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 37.0 t -85.45 155.25 21.33 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 177.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.496 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 5.3 p -150.82 143.05 16.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-O 121.164 0.507 . . . . 0.0 111.021 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.606 HG11 ' HD3' ' A' ' 50' ' ' ARG . 16.4 t -123.63 140.48 47.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 178.614 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -106.2 138.66 42.0 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 120.999 0.428 . . . . 0.0 110.356 179.104 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.403 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 16.4 m-85 -132.3 153.03 51.1 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.047 0.451 . . . . 0.0 110.895 -177.671 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.541 HD13 HD23 ' A' ' 43' ' ' LEU . 20.9 pt -133.03 167.54 26.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-O 121.17 0.51 . . . . 0.0 110.777 -178.676 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.533 ' HB2' ' OG1' ' A' ' 38' ' ' THR . 46.6 mtpt -81.83 148.25 28.94 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.267 179.108 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.9 ppt_? -69.01 -16.84 63.82 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.829 0.347 . . . . 0.0 111.397 -179.249 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 11.4 t-80 -100.95 -3.5 29.41 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 122.291 1.043 . . . . 0.0 108.52 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.533 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 2.4 m -90.81 137.28 26.96 Favored Pre-proline 0 N--CA 1.432 -1.334 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.429 -179.184 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_endo -61.6 129.15 26.83 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.39 2.06 . . . . 0.0 112.04 -179.626 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.734 HD13 ' SD ' ' A' ' 44' ' ' MET . 0.4 OUTLIER -69.36 -17.95 63.74 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.02 -0.537 . . . . 0.0 112.317 -178.868 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.571 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 7.8 p -50.93 -32.46 20.86 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 122.995 0.518 . . . . 0.0 111.658 179.01 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt -59.8 -48.34 82.08 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.446 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.6 pp -71.42 -33.78 69.72 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.234 0.54 . . . . 0.0 110.075 179.106 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.734 ' SD ' HD13 ' A' ' 40' ' ' LEU . 38.5 mtp -60.6 -49.28 78.18 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.183 0.516 . . . . 0.0 111.053 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 27.6 mmtp -67.23 -35.89 80.52 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.77 177.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.443 ' O ' ' HG2' ' A' ' 50' ' ' ARG . . . -63.68 -39.26 93.89 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 121.23 0.538 . . . . 0.0 110.186 179.326 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -57.81 -55.37 35.75 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.231 177.672 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.589 ' SG ' HD11 ' A' ' 58' ' ' ILE . 32.5 m -59.92 -41.26 91.37 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.104 -178.75 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -65.68 -39.91 91.79 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.265 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.606 ' HD3' HG11 ' A' ' 30' ' ' VAL . 14.6 ptm180 -82.08 -35.7 28.38 Favored 'General case' 0 C--N 1.329 -0.313 0 O-C-N 121.912 -0.492 . . . . 0.0 111.578 -178.822 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.425 ' HB3' HD23 ' A' ' 53' ' ' LEU . 24.9 mm-40 -77.67 -22.37 50.67 Favored 'General case' 0 CA--C 1.502 -0.896 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -179.19 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 84.48 42.8 7.21 Favored Glycine 0 N--CA 1.427 -1.957 0 C-N-CA 119.773 -1.203 . . . . 0.0 111.168 -177.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.425 HD23 ' HB3' ' A' ' 51' ' ' GLN . 4.0 mm? -122.8 164.17 18.86 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 178.687 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.8 m -113.58 150.25 33.31 Favored 'General case' 0 N--CA 1.44 -0.968 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 178.043 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 10.6 mmt -59.32 -29.16 67.44 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-O 121.3 0.571 . . . . 0.0 111.651 178.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.438 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -84.87 -13.58 50.5 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.511 0.672 . . . . 0.0 110.651 178.241 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -91.45 -19.07 23.24 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.77 -178.428 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.589 HD11 ' SG ' ' A' ' 48' ' ' CYS . 16.3 pt -139.41 -176.46 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.118 0.485 . . . . 0.0 111.026 -178.885 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.417 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 7.2 mmt180 -157.14 131.68 8.62 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.678 177.228 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -89.38 145.5 25.3 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.514 178.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.598 ' HD3' ' CA ' ' A' ' 64' ' ' GLY . 7.2 tmm_? -150.65 145.52 25.9 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-O 121.137 0.494 . . . . 0.0 110.596 -176.911 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.422 ' HB2' HD11 ' A' ' 67' ' ' ILE . 68.9 t80 -146.88 147.13 30.5 Favored 'General case' 0 C--O 1.216 -0.709 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.423 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 18.8 t70 55.83 23.75 6.75 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-O 121.753 0.787 . . . . 0.0 110.517 -177.199 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.598 ' CA ' ' HD3' ' A' ' 61' ' ' ARG . . . 83.9 -16.38 32.48 Favored Glycine 0 N--CA 1.428 -1.863 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.698 -179.182 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.575 ' O ' ' HG2' ' A' ' 61' ' ' ARG . 4.0 pt20 -97.1 148.0 33.76 Favored Pre-proline 0 CA--C 1.537 0.474 0 O-C-N 122.619 -0.342 . . . . 0.0 110.603 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -68.58 141.19 49.59 Favored 'Trans proline' 0 CA--C 1.53 0.325 0 C-N-CA 122.572 2.181 . . . . 0.0 112.337 -179.223 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.422 HD11 ' HB2' ' A' ' 62' ' ' PHE . 50.3 mt -90.25 146.78 5.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 179.46 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -116.45 164.67 14.21 Favored 'General case' 0 CA--C 1.498 -1.054 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.463 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.571 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 9.5 pt-20 -75.84 -18.0 59.61 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.679 0.752 . . . . 0.0 109.859 177.649 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 23.5 p -93.0 1.65 57.2 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.735 -176.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -101.56 159.64 15.13 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 121.817 -0.552 . . . . 0.0 111.103 -177.585 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -114.79 151.31 45.29 Favored Pre-proline 0 C--O 1.219 -0.509 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 178.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.86 -29.86 91.31 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.978 2.452 . . . . 0.0 112.116 -179.127 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.45 -17.84 61.74 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.214 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 50.8 tp60 -68.25 -41.51 81.04 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-O 121.64 0.733 . . . . 0.0 110.382 -178.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.424 ' H ' HD12 ' A' ' 76' ' ' LEU . 0.8 OUTLIER -86.75 2.93 47.05 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.862 -174.634 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 56.55 33.21 22.26 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-O 121.399 0.619 . . . . 0.0 111.044 178.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.414 ' HE1' HD11 ' A' ' 84' ' ' ILE . 6.9 ptm -77.96 156.77 30.03 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.097 -177.766 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.575 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 12.3 pt-20 -107.08 162.61 13.71 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.274 -177.79 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -58.72 138.49 57.04 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.146 0.498 . . . . 0.0 111.127 174.181 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 77.21 19.54 1.3 Allowed 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 124.665 1.186 . . . . 0.0 110.613 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.575 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 0.7 OUTLIER -70.54 152.1 44.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.145 177.985 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 31.5 m -106.85 121.49 44.51 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.527 0.679 . . . . 0.0 112.694 -176.367 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.728 HG13 HG22 ' A' ' 22' ' ' VAL . 18.3 mm -85.3 140.53 15.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.232 176.867 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -102.23 116.18 32.12 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 120.837 0.351 . . . . 0.0 110.926 -179.461 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.417 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 72.3 t -109.69 138.43 37.26 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.938 0 CA-C-O 120.963 0.411 . . . . 0.0 110.471 177.378 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.6 p90 -133.99 149.01 51.2 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 116.092 -0.503 . . . . 0.0 109.817 178.481 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -75.5 131.72 40.28 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.789 0.804 . . . . 0.0 112.168 -176.607 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 -105.78 17.28 23.97 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.162 -0.926 . . . . 0.0 111.772 178.269 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.462 ' HA ' ' OE1' ' A' ' 90' ' ' GLN . 6.0 tp60 -131.22 125.75 33.73 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 -179.316 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 7.8 p -82.89 -47.76 11.47 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 -178.755 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -66.28 -60.45 6.32 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.947 -0.644 . . . . 0.0 112.373 -179.173 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.246 0 CA-C-O 118.793 -1.004 . . . . 0.0 112.05 179.232 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.1 ptt? . . . . . 0 N--CA 1.485 1.301 0 CA-C-O 121.025 0.44 . . . . 0.0 110.959 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -168.03 22.07 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.888 0.851 . . . . 0.0 109.059 -178.905 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -108.04 -31.55 7.91 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.164 -176.052 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -92.96 29.19 1.88 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.617 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.9 ptpp? -148.3 152.76 39.76 Favored Pre-proline 0 N--CA 1.435 -1.189 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 179.191 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_exo -70.14 -168.17 0.28 Allowed 'Trans proline' 0 CA--C 1.533 0.457 0 C-N-CA 122.618 2.212 . . . . 0.0 111.972 178.432 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.443 ' HD2' ' H ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -63.31 -4.1 2.37 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.832 177.811 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -62.63 97.06 0.09 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.057 0.456 . . . . 0.0 111.552 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 91.86 21.15 34.41 Favored Glycine 0 N--CA 1.446 -0.681 0 C-N-CA 120.851 -0.69 . . . . 0.0 113.017 178.244 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 12.6 p -72.63 131.16 35.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 O-C-N 122.315 -0.521 . . . . 0.0 110.618 179.036 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -159.1 147.02 17.73 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 120.751 0.31 . . . . 0.0 110.77 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.6 t -72.53 150.47 43.15 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 175.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -109.9 148.74 31.02 Favored 'General case' 0 CA--C 1.501 -0.918 0 CA-C-O 121.577 0.703 . . . . 0.0 112.074 -177.475 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -66.45 103.7 1.09 Allowed 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.58 178.34 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -121.64 -80.86 0.63 Allowed 'General case' 0 C--N 1.315 -0.918 0 CA-C-O 120.965 0.412 . . . . 0.0 111.535 -179.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -64.72 80.77 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.99 1.107 . . . . 0.0 113.99 -177.198 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.48 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 24.8 p-80 -119.85 143.07 48.1 Favored 'General case' 0 C--N 1.32 -0.703 0 O-C-N 121.967 -0.458 . . . . 0.0 110.813 175.92 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 42.1 pt -129.65 171.21 17.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.277 0.56 . . . . 0.0 110.416 178.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.523 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 23.4 t-20 -110.5 135.72 50.73 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.099 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -124.65 143.57 50.66 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.436 ' HG2' ' HG3' ' A' ' 31' ' ' GLN . 54.6 mtmt -126.48 140.74 52.23 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-O 121.22 0.533 . . . . 0.0 109.826 179.262 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.749 HG22 HG13 ' A' ' 84' ' ' ILE . 60.1 t -122.99 131.96 72.31 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 -178.488 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.06 129.25 55.45 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 -178.623 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.454 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -105.66 156.95 16.41 Favored Glycine 0 N--CA 1.428 -1.872 0 C-N-CA 120.193 -1.003 . . . . 0.0 111.962 -179.388 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.24 -9.48 0.43 Allowed 'General case' 0 CA--C 1.55 0.96 0 N-CA-C 113.552 0.945 . . . . 0.0 113.552 178.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -82.48 -21.22 35.63 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.3 0.571 . . . . 0.0 110.208 178.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.51 3.52 40.6 Favored Glycine 0 CA--C 1.508 -0.394 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.7 t -91.03 152.66 20.57 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.18 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.514 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 3.2 p -148.35 137.02 15.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.161 0.505 . . . . 0.0 110.145 -178.869 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.418 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 3.8 t -125.99 141.72 44.82 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 O-C-N 122.108 -0.37 . . . . 0.0 110.516 -177.777 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.44 ' HB3' HD21 ' A' ' 19' ' ' ASN . 0.5 OUTLIER -106.07 141.71 36.98 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.195 179.166 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.449 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 20.1 m-85 -134.4 153.03 52.13 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.172 0.51 . . . . 0.0 110.99 -177.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.435 HD13 HD23 ' A' ' 43' ' ' LEU . 33.7 pt -140.71 175.42 6.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.908 0.385 . . . . 0.0 110.177 -178.576 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.524 ' HB2' ' OG1' ' A' ' 38' ' ' THR . 22.5 mtpp -85.89 151.23 23.94 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-O 121.131 0.491 . . . . 0.0 110.417 177.803 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -64.32 -25.1 67.89 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.072 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 19.5 t-160 -102.39 1.07 34.96 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.998 0.904 . . . . 0.0 109.25 -176.091 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.524 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.6 m -91.8 136.04 26.82 Favored Pre-proline 0 C--N 1.3 -1.575 0 CA-C-N 114.828 -1.078 . . . . 0.0 109.965 -179.26 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -58.23 125.85 19.74 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.597 2.198 . . . . 0.0 112.341 -179.067 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.583 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.3 pp -68.4 -16.8 64.05 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.039 -179.059 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.459 ' N ' HD12 ' A' ' 40' ' ' LEU . 26.2 t -51.19 -31.95 21.89 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 121.006 0.431 . . . . 0.0 111.125 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.3 mtpp -56.52 -50.49 71.68 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.305 0.574 . . . . 0.0 110.802 178.461 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.6 pp -71.5 -32.74 68.57 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.991 -179.082 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 49.5 mtm -64.0 -42.99 96.99 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.224 0.535 . . . . 0.0 110.731 -179.214 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.619 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 1.4 mmpt? -68.04 -38.94 83.09 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.54 177.491 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.19 -35.5 80.51 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-O 121.174 0.511 . . . . 0.0 110.068 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.523 ' CE2' ' HG3' ' A' ' 51' ' ' GLN . 64.4 t80 -61.79 -54.9 35.98 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.081 177.434 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.629 ' SG ' HD11 ' A' ' 58' ' ' ILE . 30.4 m -58.89 -39.04 80.27 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.127 0.489 . . . . 0.0 110.993 -179.146 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.619 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 73.6 mm-40 -59.84 -52.79 63.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.006 0.431 . . . . 0.0 111.399 178.627 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' ' 47' ' ' TYR . 9.6 ptp180 -71.17 -36.05 71.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.993 0.425 . . . . 0.0 111.965 -177.046 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.523 ' HG3' ' CE2' ' A' ' 47' ' ' TYR . 24.3 mm-40 -72.68 -16.95 61.68 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -179.157 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 74.9 38.04 42.56 Favored Glycine 0 N--CA 1.435 -1.381 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -174.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.617 HD23 HG21 ' A' ' 58' ' ' ILE . 3.7 mp -123.41 165.66 16.67 Favored 'General case' 0 N--CA 1.433 -1.292 0 C-N-CA 123.631 0.772 . . . . 0.0 109.376 -175.431 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.426 ' HB2' ' OE1' ' A' ' 57' ' ' GLN . 61.8 m -124.88 158.09 34.34 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-O 120.67 0.272 . . . . 0.0 111.082 178.362 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.8 mmt -61.56 -30.2 70.5 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-O 121.069 0.461 . . . . 0.0 111.998 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.57 -13.36 51.97 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.615 0.721 . . . . 0.0 110.491 177.724 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.52 HE21 ' HB3' ' A' ' 90' ' ' GLN . 1.2 mp0 -89.95 -20.71 23.0 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.723 -178.61 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.629 HD11 ' SG ' ' A' ' 48' ' ' CYS . 13.5 pt -142.91 -177.2 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.306 0.574 . . . . 0.0 111.871 -177.701 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.7 mmt180 -157.26 140.83 15.78 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.861 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.402 ' HB3' HD12 ' A' ' 67' ' ' ILE . 23.1 m-85 -97.36 145.58 26.01 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.886 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.429 ' NE ' ' HA2' ' A' ' 64' ' ' GLY . 1.2 tmt_? -143.32 138.84 29.79 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-O 121.068 0.461 . . . . 0.0 110.664 -177.857 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.566 ' HE1' ' OD1' ' A' ' 82' ' ' ASP . 80.6 t80 -143.36 147.42 34.65 Favored 'General case' 0 C--O 1.208 -1.089 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.994 179.46 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.0 t70 57.55 22.84 8.55 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 121.73 0.776 . . . . 0.0 110.665 179.115 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.429 ' HA2' ' NE ' ' A' ' 61' ' ' ARG . . . 80.27 2.74 89.47 Favored Glycine 0 N--CA 1.427 -1.95 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.706 -178.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 62' ' ' PHE . 13.3 pt20 -119.43 149.96 48.73 Favored Pre-proline 0 N--CA 1.442 -0.864 0 O-C-N 122.313 -0.522 . . . . 0.0 109.741 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 65' ' ' GLN . 14.2 Cg_exo -65.06 141.26 69.26 Favored 'Trans proline' 0 C--N 1.327 -0.56 0 C-N-CA 122.245 1.963 . . . . 0.0 111.654 178.269 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.539 HD11 ' HB2' ' A' ' 62' ' ' PHE . 44.2 mt -92.74 146.21 6.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 178.147 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -112.85 170.46 8.18 Favored 'General case' 0 CA--C 1.502 -0.87 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -75.92 -15.72 60.14 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.515 0.674 . . . . 0.0 109.772 176.169 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 18.9 p -93.86 3.92 54.68 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.313 179.525 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.479 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 22.4 m-20 -82.09 142.05 32.62 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.477 0.656 . . . . 0.0 111.951 -179.359 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -116.41 139.31 25.19 Favored Pre-proline 0 C--N 1.317 -0.843 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.408 174.391 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.428 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 13.5 Cg_endo -56.76 -33.3 93.86 Favored 'Trans proline' 0 C--O 1.237 0.439 0 C-N-CA 123.036 2.491 . . . . 0.0 113.131 -175.783 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.83 -27.93 66.28 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.688 -179.089 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -65.05 -37.9 89.06 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.926 0.393 . . . . 0.0 111.296 -179.429 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.476 HD22 ' HD2' ' A' ' 62' ' ' PHE . 0.5 OUTLIER -93.09 7.14 45.4 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 -179.855 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 43.35 40.21 2.5 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.636 1.174 . . . . 0.0 112.479 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.428 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 5.5 ptm -74.16 157.09 36.58 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.827 -178.409 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -103.39 159.85 15.21 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.013 -176.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.523 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 10.5 p-10 -57.69 141.92 46.84 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.245 0.545 . . . . 0.0 111.057 174.423 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' A' ' 80' ' ' ASP . 8.3 mt-10 74.77 19.1 2.58 Favored 'General case' 0 CA--C 1.506 -0.727 0 C-N-CA 124.337 1.055 . . . . 0.0 111.48 -179.373 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.566 ' OD1' ' HE1' ' A' ' 62' ' ' PHE . 16.4 t70 -64.16 150.05 46.51 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.685 177.146 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 23.2 m -104.07 113.9 27.76 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.413 0.625 . . . . 0.0 112.044 -179.334 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.749 HG13 HG22 ' A' ' 22' ' ' VAL . 17.3 mm -83.59 145.08 8.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.532 178.278 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -102.83 116.86 33.38 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.124 -179.451 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.454 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 71.3 t -113.06 134.85 54.4 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-O 121.321 0.582 . . . . 0.0 111.175 176.496 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 13.0 p90 -132.9 155.5 48.94 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.749 -179.712 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.57 ' HG3' ' HG3' ' A' ' 90' ' ' GLN . 4.4 tp60 -75.55 132.1 40.47 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.49 0.662 . . . . 0.0 112.051 -176.693 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -114.82 11.08 16.63 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.2 178.238 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.57 ' HG3' ' HG3' ' A' ' 88' ' ' GLN . 0.0 OUTLIER -105.81 153.15 22.3 Favored 'General case' 0 C--N 1.317 -0.838 0 O-C-N 121.826 -0.546 . . . . 0.0 111.187 -178.203 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 36.0 m -149.11 97.31 2.67 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 121.198 0.523 . . . . 0.0 110.123 178.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -175.39 75.04 0.08 OUTLIER Glycine 0 N--CA 1.441 -0.981 0 N-CA-C 110.966 -0.854 . . . . 0.0 110.966 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.249 0 CA-C-O 118.351 -1.25 . . . . 0.0 111.386 -177.818 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.1 ttp . . . . . 0 N--CA 1.473 0.693 0 CA-C-O 120.844 0.354 . . . . 0.0 111.332 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -88.71 10.92 19.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.0 0.428 . . . . 0.0 112.02 -177.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -86.01 41.09 0.9 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 122.001 0.905 . . . . 0.0 109.959 179.325 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.414 ' H ' ' HG3' ' A' ' 4' ' ' GLU . 27.2 mt-10 -58.09 116.03 3.28 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.039 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -78.07 133.58 64.9 Favored Pre-proline 0 C--N 1.318 -0.779 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.219 -179.304 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.411 ' O ' ' N ' ' A' ' 8' ' ' GLU . 18.2 Cg_endo -66.43 143.29 69.05 Favored 'Trans proline' 0 CA--C 1.507 -0.849 0 C-N-CA 122.637 2.225 . . . . 0.0 113.296 -177.256 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.565 ' HD2' ' H ' ' A' ' 8' ' ' GLU . 0.9 OUTLIER -6.04 -46.15 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 116.724 2.12 . . . . 0.0 116.724 173.187 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.565 ' H ' ' HD2' ' A' ' 7' ' ' LYS . 45.4 mt-10 -85.5 52.3 2.42 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 121.192 -0.942 . . . . 0.0 109.89 178.866 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -147.05 70.49 0.35 Allowed Glycine 0 N--CA 1.441 -0.994 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.002 -178.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.9 p -114.2 22.67 5.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-O 122.575 1.179 . . . . 0.0 109.358 178.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -74.03 88.18 1.88 Allowed 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 114.891 -1.049 . . . . 0.0 111.684 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 13.4 t -139.21 3.35 2.16 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.537 177.671 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -155.3 159.43 39.99 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.872 -178.201 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -136.78 43.97 2.38 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 74.66 16.55 3.11 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-O 122.532 1.158 . . . . 0.0 109.192 -176.178 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -69.42 93.0 0.63 Allowed 'General case' 0 C--O 1.236 0.361 0 CA-C-N 114.632 -1.167 . . . . 0.0 110.749 -176.32 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -121.14 154.12 36.61 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.429 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 31.9 pt -130.95 170.72 19.13 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.066 0 CA-C-O 121.379 0.609 . . . . 0.0 110.994 -178.865 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -104.85 136.23 44.74 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.563 178.497 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -127.93 135.93 50.64 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 177.167 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -121.81 146.82 46.7 Favored 'General case' 0 C--N 1.308 -1.215 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 179.018 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.669 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 3.4 p -124.62 131.44 72.7 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.797 -176.921 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -112.06 132.03 55.07 Favored 'General case' 0 C--O 1.244 0.79 0 CA-C-O 121.151 0.5 . . . . 0.0 110.762 -178.801 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -102.92 174.12 23.09 Favored Glycine 0 N--CA 1.435 -1.391 0 C-N-CA 121.292 -0.48 . . . . 0.0 112.725 -179.063 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.418 ' CD ' ' H ' ' A' ' 25' ' ' GLN . 0.1 OUTLIER -66.92 -31.41 71.98 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.531 0.681 . . . . 0.0 110.782 -177.529 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -77.31 -10.65 59.57 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.984 -178.222 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 98.82 7.37 55.51 Favored Glycine 0 N--CA 1.443 -0.894 0 C-N-CA 120.448 -0.882 . . . . 0.0 112.578 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 18.7 t -83.46 154.24 24.03 Favored 'General case' 0 N--CA 1.444 -0.765 0 O-C-N 122.416 -0.461 . . . . 0.0 109.976 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.669 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.2 p -146.68 132.69 13.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.269 0.557 . . . . 0.0 111.074 179.564 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.0 t -117.12 135.16 58.4 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -105.35 142.75 34.56 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.754 0.311 . . . . 0.0 110.92 -179.568 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.478 ' HE1' HG12 ' A' ' 22' ' ' VAL . 11.5 m-85 -138.44 156.46 47.54 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.109 0.48 . . . . 0.0 110.96 -179.568 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 35.5 pt -131.94 165.19 32.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.149 0.499 . . . . 0.0 111.32 -177.314 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.477 ' HB2' ' OG1' ' A' ' 38' ' ' THR . 15.6 mtpp -75.48 153.79 37.35 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.042 178.335 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.9 ptt180 -67.14 -22.38 65.78 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.507 0.67 . . . . 0.0 110.492 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -103.76 2.31 32.78 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 122.205 1.002 . . . . 0.0 109.357 -176.115 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.477 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.2 m -89.97 134.47 31.76 Favored Pre-proline 0 C--N 1.302 -1.476 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.808 178.551 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -61.34 125.51 17.07 Favored 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 122.33 2.02 . . . . 0.0 112.27 -178.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.531 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.0 OUTLIER -65.92 -17.42 64.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.112 0.482 . . . . 0.0 111.899 -179.57 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.455 ' N ' HD12 ' A' ' 40' ' ' LEU . 5.9 p -55.68 -28.25 54.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.416 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -60.91 -45.55 94.21 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 116.25 -0.432 . . . . 0.0 109.946 179.33 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.5 pp -72.91 -36.73 67.33 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.014 0.435 . . . . 0.0 110.231 178.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 45.1 mtm -63.58 -49.59 72.78 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 120.996 0.426 . . . . 0.0 110.855 -178.344 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.46 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 92.5 mttt -66.25 -36.1 82.13 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-O 120.688 0.28 . . . . 0.0 110.866 178.905 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.54 -37.42 87.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.114 0.483 . . . . 0.0 109.981 178.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -58.73 -55.43 35.16 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.793 178.051 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.51 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 24.4 p -64.8 -35.47 81.19 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 122.141 -0.349 . . . . 0.0 111.325 -177.061 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 60.7 mt-10 -67.04 -40.75 87.22 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.795 0.331 . . . . 0.0 111.507 179.653 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -81.82 -32.26 31.32 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 120.935 0.398 . . . . 0.0 111.472 -178.694 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.7 mm-40 -82.04 -22.69 36.28 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -177.686 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 90.2 37.7 6.6 Favored Glycine 0 N--CA 1.437 -1.262 0 C-N-CA 120.114 -1.041 . . . . 0.0 111.174 -178.318 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.51 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 3.9 mm? -123.62 165.35 17.33 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 179.297 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.1 m -119.49 155.48 32.02 Favored 'General case' 0 C--N 1.312 -1.031 0 O-C-N 121.922 -0.486 . . . . 0.0 110.971 178.791 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 12.9 mmt -63.15 -26.04 68.63 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.448 0.642 . . . . 0.0 111.453 178.847 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.54 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.84 -12.65 50.24 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.553 0.692 . . . . 0.0 110.52 177.219 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -96.94 -27.23 14.74 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.748 -0.66 . . . . 0.0 112.178 -178.112 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.8 pt -132.59 176.12 9.8 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.041 0 CA-C-O 121.076 0.465 . . . . 0.0 110.485 -178.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.413 ' HD3' ' HA ' ' A' ' 59' ' ' ARG . 16.1 mmt180 -149.72 141.67 23.83 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.729 178.696 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -100.08 139.41 35.78 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.977 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.63 ' HG2' ' N ' ' A' ' 62' ' ' PHE . 1.5 ttm180 -137.83 150.63 47.33 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-O 121.179 0.514 . . . . 0.0 110.865 -178.87 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.63 ' N ' ' HG2' ' A' ' 61' ' ' ARG . 74.4 t80 -155.23 146.1 22.44 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.841 176.511 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.2 t70 57.45 24.6 10.4 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 121.637 0.732 . . . . 0.0 110.403 -178.484 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.95 0.18 84.62 Favored Glycine 0 N--CA 1.435 -1.417 0 C-N-CA 121.011 -0.614 . . . . 0.0 113.292 -179.291 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -115.87 146.52 37.12 Favored Pre-proline 0 C--N 1.319 -0.728 0 O-C-N 122.13 -0.629 . . . . 0.0 110.067 179.221 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.55 139.74 45.58 Favored 'Trans proline' 0 C--O 1.238 0.495 0 C-N-CA 122.053 1.836 . . . . 0.0 111.806 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.523 HD11 ' HB2' ' A' ' 62' ' ' PHE . 42.8 mt -91.72 146.43 6.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 120.929 0.395 . . . . 0.0 110.242 -178.631 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -109.53 157.74 18.7 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 177.222 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.435 ' OE2' HG23 ' A' ' 70' ' ' THR . 0.1 OUTLIER -68.65 -19.53 64.41 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-O 121.649 0.738 . . . . 0.0 110.579 178.061 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.435 HG23 ' OE2' ' A' ' 69' ' ' GLU . 1.0 OUTLIER -96.32 14.81 23.03 Favored 'General case' 0 N--CA 1.421 -1.905 0 CA-C-N 116.011 -0.54 . . . . 0.0 112.107 179.693 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -96.4 150.84 20.14 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 120.881 0.372 . . . . 0.0 110.31 -179.576 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.734 ' HB ' ' OE1' ' A' ' 75' ' ' GLN . 0.9 OUTLIER -117.61 141.39 28.85 Favored Pre-proline 0 CA--C 1.545 0.754 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 179.179 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.518 ' HD2' HG22 ' A' ' 72' ' ' THR . 12.2 Cg_endo -53.66 -34.26 73.03 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 123.545 2.83 . . . . 0.0 113.122 -177.246 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.81 -26.25 65.98 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.76 -178.212 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.734 ' OE1' ' HB ' ' A' ' 72' ' ' THR . 6.3 mp0 -67.29 -38.83 85.65 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.936 0.398 . . . . 0.0 111.444 -179.332 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.1 mp -81.51 -10.48 59.47 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.513 -179.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 55.01 46.74 23.64 Favored 'General case' 0 C--N 1.347 0.474 0 CA-C-O 121.971 0.891 . . . . 0.0 109.785 -179.029 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 5.6 ptm -76.04 -141.22 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 114.703 -1.135 . . . . 0.0 112.048 -176.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.562 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 11.9 pt-20 -160.74 152.07 19.19 Favored 'General case' 0 CA--C 1.508 -0.641 0 O-C-N 121.673 -0.642 . . . . 0.0 109.367 -176.451 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -59.01 142.97 49.75 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.285 0.564 . . . . 0.0 111.163 173.815 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 71.56 15.63 6.03 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 124.14 0.976 . . . . 0.0 111.175 179.185 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.562 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 3.6 t0 -70.98 158.92 35.68 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.811 0.339 . . . . 0.0 110.131 179.261 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 27.3 m -108.31 126.51 52.92 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.616 0.722 . . . . 0.0 112.562 -176.428 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 44.7 mm -89.75 133.85 30.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.118 176.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -93.85 114.44 26.68 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 120.769 0.318 . . . . 0.0 110.605 -178.028 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 92.5 t -112.55 137.19 46.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-O 121.096 0.474 . . . . 0.0 110.533 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.7 p90 -139.64 154.1 47.46 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.109 -179.325 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -80.35 111.51 16.81 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.465 0.65 . . . . 0.0 111.691 -176.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 77.1 mm-40 -109.04 32.23 5.09 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.029 177.618 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 18.0 tm0? -54.62 -43.34 72.17 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.129 0.49 . . . . 0.0 110.377 178.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 11.5 m -102.79 132.48 48.93 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 65.59 34.27 88.57 Favored Glycine 0 C--O 1.239 0.42 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.233 -176.624 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.136 0 CA-C-O 118.587 -1.118 . . . . 0.0 111.616 -178.182 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.426 ' O ' ' HB3' ' A' ' 2' ' ' ALA . 1.8 pmm? . . . . . 0 N--CA 1.476 0.872 0 CA-C-O 120.34 0.114 . . . . 0.0 111.18 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.426 ' HB3' ' O ' ' A' ' 1' ' ' MET . . . 86.41 119.56 0.04 OUTLIER 'General case' 0 C--N 1.354 0.772 0 C-N-CA 124.272 1.029 . . . . 0.0 110.745 178.206 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -109.56 30.24 6.83 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.924 -178.156 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -28.88 112.02 0.07 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.392 1.077 . . . . 0.0 113.738 178.413 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -139.58 139.06 21.21 Favored Pre-proline 0 C--N 1.309 -1.17 0 CA-C-N 115.028 -0.987 . . . . 0.0 108.781 178.414 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -67.88 -163.29 0.08 OUTLIER 'Trans proline' 0 CA--C 1.535 0.552 0 C-N-CA 122.439 2.093 . . . . 0.0 112.244 179.021 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.23 1.11 46.95 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.549 0.69 . . . . 0.0 110.761 -179.054 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -148.87 129.9 14.41 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.915 178.161 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -147.1 39.29 1.07 Allowed Glycine 0 C--N 1.309 -0.933 0 N-CA-C 111.499 -0.641 . . . . 0.0 111.499 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.7 p -100.22 126.14 53.82 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 CA-C-O 121.677 0.751 . . . . 0.0 110.928 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.48 123.39 16.46 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.292 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.6 t -90.37 135.55 33.61 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.202 0.525 . . . . 0.0 110.444 178.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -125.57 173.87 8.64 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.774 -179.369 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -85.0 -4.28 59.09 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.391 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 31.0 m-80 -101.31 158.39 16.08 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.016 0.436 . . . . 0.0 110.376 -179.208 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -122.08 -167.2 1.51 Allowed 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 177.783 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 14.1 p80 -120.35 152.46 37.84 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.369 0.605 . . . . 0.0 112.027 -176.449 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 38.9 pt -132.2 170.53 19.71 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.653 178.434 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.486 HD21 ' HB3' ' A' ' 31' ' ' GLN . 16.6 t-20 -104.57 129.64 52.63 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 121.02 0.438 . . . . 0.0 110.797 -179.819 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.432 HD23 HG12 ' A' ' 34' ' ' ILE . 3.0 mm? -123.1 135.18 54.27 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 176.481 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.411 ' HG2' ' HG3' ' A' ' 31' ' ' GLN . 51.5 mtmt -119.86 141.69 49.34 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 -179.625 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.726 HG22 HG13 ' A' ' 84' ' ' ILE . 62.9 t -121.58 131.51 72.91 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 -177.785 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.25 125.71 50.67 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.152 0.501 . . . . 0.0 110.07 -178.231 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.428 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -103.23 156.29 17.97 Favored Glycine 0 N--CA 1.432 -1.576 0 C-N-CA 120.332 -0.937 . . . . 0.0 112.139 -179.92 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.08 -10.9 0.21 Allowed 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 178.912 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -78.31 -21.64 49.35 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.612 0.72 . . . . 0.0 109.854 178.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 98.72 24.23 11.08 Favored Glycine 0 N--CA 1.443 -0.84 0 N-CA-C 110.196 -1.161 . . . . 0.0 110.196 -177.84 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.5 t -117.54 131.44 56.7 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.084 -0.558 . . . . 0.0 110.186 -177.785 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.574 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 3.1 p -124.55 142.61 40.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-O 121.317 0.58 . . . . 0.0 110.912 179.26 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.8 t -125.19 140.91 46.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.486 ' HB3' HD21 ' A' ' 19' ' ' ASN . 0.5 OUTLIER -106.28 140.26 39.5 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 120.844 0.354 . . . . 0.0 110.944 -179.675 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 12.5 m-85 -133.79 152.14 51.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.851 0.358 . . . . 0.0 110.439 -179.043 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.536 HD13 HD23 ' A' ' 43' ' ' LEU . 24.9 pt -127.53 168.27 20.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.984 0.421 . . . . 0.0 111.314 -177.141 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 10.6 mptt -80.82 153.73 27.54 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.023 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.5 ptt180 -71.46 -13.95 61.98 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.217 0.532 . . . . 0.0 111.21 -178.571 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -105.75 -5.41 19.92 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 122.16 0.981 . . . . 0.0 108.479 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.498 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.8 m -85.77 130.3 51.29 Favored Pre-proline 0 N--CA 1.427 -1.613 0 CA-C-N 114.594 -1.185 . . . . 0.0 109.776 -179.649 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -61.88 123.01 11.82 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.367 2.045 . . . . 0.0 112.198 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.622 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.3 pp -61.42 -16.56 47.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.707 179.221 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.459 ' N ' HD12 ' A' ' 40' ' ' LEU . 47.9 t -50.15 -35.29 25.42 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 123.34 0.656 . . . . 0.0 111.569 179.309 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -66.59 -42.77 86.43 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 120.985 -0.286 . . . . 0.0 110.902 -178.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.622 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.0 pp -69.98 -33.27 71.84 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.988 0.423 . . . . 0.0 109.991 178.396 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 48.1 mtm -65.75 -48.27 72.44 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.24 0.543 . . . . 0.0 110.731 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 10.8 mmmm -64.31 -38.12 89.9 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 121.002 0.43 . . . . 0.0 110.158 177.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.62 -40.59 97.47 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.196 178.35 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -58.26 -54.56 45.65 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.615 178.253 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.612 ' SG ' HD11 ' A' ' 58' ' ' ILE . 31.4 m -58.92 -44.16 91.25 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.881 0.372 . . . . 0.0 110.976 -178.617 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -62.01 -42.42 99.14 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.014 0.375 . . . . 0.0 112.014 -179.35 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -78.8 -36.9 42.07 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.177 0.513 . . . . 0.0 111.732 -177.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.439 ' CB ' HD23 ' A' ' 53' ' ' LEU . 24.9 mm-40 -79.09 -20.38 48.91 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 112.403 0.52 . . . . 0.0 112.403 -177.615 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.51 42.29 6.98 Favored Glycine 0 N--CA 1.429 -1.792 0 C-N-CA 119.926 -1.13 . . . . 0.0 110.856 -177.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.439 HD23 ' CB ' ' A' ' 51' ' ' GLN . 4.0 mm? -124.01 163.66 20.94 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.405 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.403 ' HB2' ' HB2' ' A' ' 57' ' ' GLN . 48.6 m -116.59 151.37 36.35 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 178.516 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 10.0 mmt -60.39 -28.01 67.89 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.321 0.581 . . . . 0.0 111.382 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.509 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -84.81 -17.33 38.48 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.529 0.681 . . . . 0.0 110.503 177.923 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.403 ' HB2' ' HB2' ' A' ' 54' ' ' SER . 1.0 OUTLIER -90.43 -22.96 21.17 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.215 -178.277 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.612 HD11 ' SG ' ' A' ' 48' ' ' CYS . 16.1 pt -136.49 177.84 5.73 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 CA-C-O 121.513 0.673 . . . . 0.0 111.944 -178.738 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.445 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 17.0 mmt-85 -151.82 140.01 20.3 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.344 178.126 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -96.18 142.7 28.04 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.249 179.035 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -142.42 144.99 33.34 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-O 121.112 0.482 . . . . 0.0 110.888 -176.822 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.507 ' HB2' HD11 ' A' ' 67' ' ' ILE . 73.1 t80 -150.72 146.1 26.22 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 178.847 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 22.7 t70 56.71 23.42 7.86 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 121.772 0.796 . . . . 0.0 110.836 -178.163 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.01 -19.81 28.41 Favored Glycine 0 N--CA 1.428 -1.84 0 C-N-CA 121.055 -0.593 . . . . 0.0 112.312 -178.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -97.21 149.5 35.78 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-O 120.833 0.349 . . . . 0.0 111.199 -178.189 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.56 142.68 36.81 Favored 'Trans proline' 0 C--O 1.237 0.474 0 C-N-CA 122.651 2.234 . . . . 0.0 112.285 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.507 HD11 ' HB2' ' A' ' 62' ' ' PHE . 23.7 mt -95.69 149.68 4.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.104 0.478 . . . . 0.0 110.16 -179.442 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -127.03 173.01 10.0 Favored 'General case' 0 CA--C 1.5 -0.947 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 178.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -75.31 -9.68 58.77 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.399 0.619 . . . . 0.0 110.041 177.62 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 22.1 p -92.22 -4.76 53.66 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.585 -179.084 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -95.76 143.57 26.88 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-O 121.608 0.718 . . . . 0.0 112.229 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.95 152.13 43.43 Favored Pre-proline 0 C--N 1.312 -1.055 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.377 177.354 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.477 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 18.8 Cg_endo -58.64 -29.62 89.79 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.538 2.159 . . . . 0.0 112.251 -177.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -77.27 -13.37 59.95 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.952 -178.282 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -76.39 -37.54 57.02 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.374 0.607 . . . . 0.0 110.545 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.464 ' H ' HD12 ' A' ' 76' ' ' LEU . 0.7 OUTLIER -91.15 9.68 30.07 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.99 -179.688 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 44.16 36.87 1.64 Allowed 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.253 1.021 . . . . 0.0 111.857 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.477 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 7.0 ptm -76.36 159.71 30.26 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.554 -178.485 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.559 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 7.4 pt-20 -115.03 167.92 10.38 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.446 -176.705 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.429 ' O ' ' HB2' ' A' ' 81' ' ' GLU . 6.8 p-10 -59.49 144.97 45.66 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-O 121.017 0.436 . . . . 0.0 111.202 175.221 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 80' ' ' ASP . 56.3 mm-40 74.39 14.74 3.6 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.181 0.992 . . . . 0.0 111.7 -179.58 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.559 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 0.6 OUTLIER -74.52 154.23 38.74 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.293 178.627 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 18.1 m -112.33 131.67 55.4 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.597 0.713 . . . . 0.0 112.919 -175.172 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.726 HG13 HG22 ' A' ' 22' ' ' VAL . 22.8 mm -94.92 142.78 12.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.838 178.208 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -101.84 116.14 32.06 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.935 0.398 . . . . 0.0 110.547 179.017 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.445 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 44.7 t -111.19 135.98 48.69 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.085 0 CA-C-O 121.302 0.572 . . . . 0.0 110.91 178.279 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.2 p90 -135.5 160.09 39.55 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.781 -179.103 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.431 ' HG3' ' H ' ' A' ' 90' ' ' GLN . 4.1 tp60 -88.47 120.87 30.25 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.411 0.624 . . . . 0.0 111.698 -176.13 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 -106.14 19.88 19.82 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.333 177.581 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.431 ' H ' ' HG3' ' A' ' 88' ' ' GLN . 34.2 tt0 -63.39 121.43 13.77 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.133 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 8.2 m -59.77 117.8 5.41 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.174 0.511 . . . . 0.0 111.35 -178.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -91.26 75.81 1.52 Allowed Glycine 0 N--CA 1.442 -0.929 0 C-N-CA 120.875 -0.678 . . . . 0.0 111.597 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.908 0 CA-C-O 118.717 -1.046 . . . . 0.0 111.936 -179.489 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 47.3 tpp . . . . . 0 N--CA 1.477 0.882 0 CA-C-O 121.095 0.474 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.517 ' HA ' ' HG3' ' A' ' 5' ' ' LYS . . . -117.05 26.24 9.93 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.508 0.67 . . . . 0.0 109.969 179.768 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -59.67 -43.16 94.07 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.58 -0.736 . . . . 0.0 112.03 -176.766 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -115.26 35.13 4.5 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.208 0.527 . . . . 0.0 110.867 -179.068 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.517 ' HG3' ' HA ' ' A' ' 2' ' ' ALA . 16.2 ptmt -169.16 88.97 0.6 Allowed Pre-proline 0 C--N 1.32 -0.708 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.593 -177.534 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -79.85 156.86 24.07 Favored 'Trans proline' 0 N--CA 1.45 -1.071 0 C-N-CA 122.565 2.177 . . . . 0.0 112.081 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.67 -16.57 30.15 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 121.446 0.641 . . . . 0.0 110.353 178.295 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -100.39 103.47 14.85 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.193 178.317 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 82.09 60.57 2.13 Favored Glycine 0 N--CA 1.439 -1.146 0 C-N-CA 120.634 -0.793 . . . . 0.0 111.998 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 14.9 p -57.68 147.6 6.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 177.268 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -98.02 -168.22 1.63 Allowed 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 121.544 -0.722 . . . . 0.0 111.007 -176.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.0 t -128.19 139.08 52.67 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.353 179.507 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -93.59 -6.83 45.68 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.235 0.54 . . . . 0.0 110.315 179.058 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 70.35 27.31 4.05 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.254 -0.884 . . . . 0.0 111.225 175.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -81.61 69.54 8.3 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.673 0.749 . . . . 0.0 111.205 179.778 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -62.83 169.45 3.2 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.898 177.035 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.517 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 30.1 p80 -117.28 143.76 45.57 Favored 'General case' 0 C--N 1.291 -1.968 0 CA-C-O 121.363 0.602 . . . . 0.0 110.474 -177.518 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.419 HD11 ' HB2' ' A' ' 73' ' ' PRO . 35.3 pt -123.33 168.46 15.82 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.563 0 CA-C-O 121.466 0.65 . . . . 0.0 111.211 -176.783 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -105.65 135.86 46.3 Favored 'General case' 0 C--N 1.307 -1.278 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 179.285 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -125.96 134.03 51.64 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.075 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -120.21 141.63 49.74 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.722 HG22 HG13 ' A' ' 84' ' ' ILE . 61.5 t -124.27 134.77 65.75 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.388 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 -176.663 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.72 130.13 55.65 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.035 0.445 . . . . 0.0 110.574 -177.775 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -102.6 174.1 23.41 Favored Glycine 0 N--CA 1.436 -1.341 0 N-CA-C 111.446 -0.662 . . . . 0.0 111.446 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -72.57 -18.73 61.59 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.353 0.597 . . . . 0.0 111.185 -177.691 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -71.11 -16.91 62.59 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.868 177.511 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 96.46 16.37 37.39 Favored Glycine 0 CA--C 1.496 -1.124 0 N-CA-C 110.836 -0.906 . . . . 0.0 110.836 179.11 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.1 m -106.68 132.11 53.05 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 115.257 -0.471 . . . . 0.0 111.032 -177.685 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.563 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.2 p -122.48 139.03 50.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 121.199 0.523 . . . . 0.0 111.292 178.492 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.411 HG11 ' HD3' ' A' ' 50' ' ' ARG . 6.2 t -118.99 137.48 52.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.303 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -104.79 140.49 38.02 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.904 0.383 . . . . 0.0 111.022 -179.063 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.448 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 15.1 m-85 -136.15 155.68 49.81 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 121.01 0.433 . . . . 0.0 110.974 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 36.8 pt -141.29 164.77 19.7 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 CA-C-O 120.762 0.315 . . . . 0.0 110.514 -178.172 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.517 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 30.8 mtmm -78.26 154.14 31.24 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.808 0.337 . . . . 0.0 110.69 178.148 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -69.03 -18.13 63.99 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.084 0.468 . . . . 0.0 111.024 -179.26 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 -102.51 1.78 35.5 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.833 0.825 . . . . 0.0 109.045 -179.087 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 m -96.24 133.48 24.95 Favored Pre-proline 0 N--CA 1.437 -1.119 0 CA-C-N 114.959 -1.018 . . . . 0.0 109.569 179.138 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -65.97 134.88 38.76 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.517 2.145 . . . . 0.0 112.63 -177.545 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.606 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -68.55 -16.04 63.74 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -178.863 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.503 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 3.8 p -50.99 -31.31 17.61 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.8 mtpt -61.39 -47.88 83.82 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.241 0.543 . . . . 0.0 110.084 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.6 pp -73.93 -32.32 63.46 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.78 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 46.0 mtm -64.55 -45.47 86.97 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 121.19 0.519 . . . . 0.0 110.743 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? -69.86 -34.94 74.27 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.401 178.276 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.06 -37.38 87.22 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.308 0.575 . . . . 0.0 109.801 179.387 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -59.92 -55.55 32.71 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.907 177.227 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.68 ' SG ' HD11 ' A' ' 58' ' ' ILE . 33.1 m -60.46 -44.32 96.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.403 -178.098 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -66.4 -31.51 72.32 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -177.597 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.411 ' HD3' HG11 ' A' ' 30' ' ' VAL . 11.6 ptm180 -87.02 -36.68 18.07 Favored 'General case' 0 C--N 1.328 -0.352 0 O-C-N 121.853 -0.529 . . . . 0.0 111.095 178.793 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -77.79 -22.46 50.1 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-O 121.148 0.499 . . . . 0.0 112.041 -177.643 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.18 38.76 6.64 Favored Glycine 0 N--CA 1.434 -1.479 0 C-N-CA 120.386 -0.911 . . . . 0.0 111.523 -179.088 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -121.09 159.63 25.35 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.124 0.487 . . . . 0.0 110.32 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.473 ' HB2' ' HB2' ' A' ' 57' ' ' GLN . 51.1 m -108.8 148.21 30.89 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 178.201 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.9 mmt -58.35 -30.18 66.54 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-O 121.16 0.505 . . . . 0.0 111.626 179.019 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.458 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.68 -10.56 55.51 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.136 0.493 . . . . 0.0 111.662 178.35 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.473 ' HB2' ' HB2' ' A' ' 54' ' ' SER . 2.3 mp0 -98.24 -17.19 19.09 Favored 'General case' 0 CA--C 1.504 -0.809 0 CA-C-O 120.96 0.41 . . . . 0.0 111.497 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.68 HD11 ' SG ' ' A' ' 48' ' ' CYS . 17.0 pt -139.68 179.18 2.98 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 CA-C-O 120.937 0.398 . . . . 0.0 110.506 179.235 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.494 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 19.6 mmt-85 -154.43 144.74 22.07 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.097 0.475 . . . . 0.0 111.03 177.473 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -100.22 141.81 32.55 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.262 178.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -142.22 138.9 31.79 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-O 121.155 0.502 . . . . 0.0 110.701 -177.084 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.497 ' HB2' HD11 ' A' ' 67' ' ' ILE . 71.5 t80 -146.16 147.45 31.51 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 179.717 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 54.93 24.48 5.89 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.172 0.589 . . . . 0.0 111.524 -179.174 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.84 3.3 90.63 Favored Glycine 0 N--CA 1.442 -0.961 0 C-N-CA 120.652 -0.785 . . . . 0.0 113.177 179.335 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -121.88 151.49 57.91 Favored Pre-proline 0 C--N 1.317 -0.84 0 O-C-N 121.846 -0.797 . . . . 0.0 110.798 178.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.56 141.24 54.68 Favored 'Trans proline' 0 N--CA 1.459 -0.542 0 C-N-CA 122.259 1.973 . . . . 0.0 111.121 177.599 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.497 HD11 ' HB2' ' A' ' 62' ' ' PHE . 45.7 mt -90.63 145.01 7.94 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.94 0 CA-C-O 120.816 0.341 . . . . 0.0 110.102 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -111.92 157.53 20.55 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 178.034 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.503 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 16.9 pt-20 -71.01 -19.56 62.5 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 121.644 0.735 . . . . 0.0 110.019 179.257 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.2 p -91.27 5.97 47.08 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.878 -178.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -93.35 151.53 19.71 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-O 121.001 0.429 . . . . 0.0 110.365 -178.448 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.509 ' HB ' ' OE1' ' A' ' 75' ' ' GLN . 1.7 m -118.62 140.16 27.99 Favored Pre-proline 0 C--N 1.316 -0.867 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.556 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.519 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 12.4 Cg_endo -52.55 -32.28 52.87 Favored 'Trans proline' 0 C--N 1.355 0.872 0 C-N-CA 123.657 2.905 . . . . 0.0 113.146 -176.294 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.43 -20.82 64.67 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.098 -177.675 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.509 ' OE1' ' HB ' ' A' ' 72' ' ' THR . 1.6 mp0 -73.4 -37.35 65.99 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.919 0.39 . . . . 0.0 111.096 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.437 ' H ' HD12 ' A' ' 76' ' ' LEU . 1.0 OUTLIER -88.43 -2.91 58.86 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.92 0.39 . . . . 0.0 110.541 -178.146 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 58.5 34.14 23.68 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.343 0.592 . . . . 0.0 110.884 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.519 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.7 ptm -75.35 160.07 30.71 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.74 -178.573 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -116.4 168.26 10.31 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.582 -175.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -60.95 141.16 57.5 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.774 0.797 . . . . 0.0 111.636 177.429 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 70.12 17.98 7.13 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.412 -1.267 . . . . 0.0 112.609 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -70.03 156.83 38.59 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 176.332 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 10.5 m -107.83 132.33 53.53 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -174.055 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.722 HG13 HG22 ' A' ' 22' ' ' VAL . 20.8 mm -97.08 142.67 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.555 178.465 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -100.42 117.96 35.67 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 120.637 0.256 . . . . 0.0 110.406 178.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.494 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 47.9 t -112.92 132.92 60.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 CA-C-O 121.124 0.487 . . . . 0.0 110.346 176.069 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 16.6 p90 -131.65 149.04 52.63 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.938 -178.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -73.92 111.34 8.98 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.242 0.544 . . . . 0.0 111.344 -178.559 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.466 ' H ' ' HA ' ' A' ' 58' ' ' ILE . 8.9 mm-40 -93.85 22.94 5.17 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.357 0.599 . . . . 0.0 110.444 176.804 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -76.53 110.42 11.07 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 13.7 t -69.44 154.73 41.58 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 64.62 52.7 40.6 Favored Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 120.598 -0.811 . . . . 0.0 111.45 -177.792 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.41 0 CA-C-O 118.13 -1.372 . . . . 0.0 111.105 -178.985 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.489 1.498 0 CA-C-O 121.163 0.506 . . . . 0.0 111.284 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -154.53 24.55 0.46 Allowed 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.845 0.831 . . . . 0.0 109.209 -179.171 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -128.14 7.7 6.03 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.949 -176.578 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -55.44 111.91 0.99 Allowed 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.134 -0.939 . . . . 0.0 112.174 -178.575 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -136.13 125.27 15.76 Favored Pre-proline 0 C--N 1.315 -0.901 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.006 176.005 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -70.27 161.08 47.33 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.199 1.932 . . . . 0.0 111.695 178.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.451 ' HD2' ' N ' ' A' ' 8' ' ' GLU . 0.2 OUTLIER -79.98 -20.19 46.1 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -179.41 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.451 ' N ' ' HD2' ' A' ' 7' ' ' LYS . 23.5 mm-40 -136.62 175.55 9.51 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-O 121.257 0.551 . . . . 0.0 111.849 -178.816 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 86.09 -41.62 3.09 Favored Glycine 0 C--N 1.332 0.316 0 CA-C-N 116.027 -0.533 . . . . 0.0 112.818 178.588 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 61.8 t 55.49 74.46 0.09 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.407 0 CA-C-O 121.691 0.758 . . . . 0.0 111.2 -178.415 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.534 ' O ' ' HD3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -38.12 125.68 1.26 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 114.584 -1.189 . . . . 0.0 113.227 177.361 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.5 t -162.98 170.13 18.54 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.93 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -102.29 -72.39 0.69 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.816 0.341 . . . . 0.0 111.261 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 58.15 39.23 26.2 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-O 121.133 0.492 . . . . 0.0 111.344 -178.116 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -98.85 12.11 36.74 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.242 0.544 . . . . 0.0 110.067 -179.235 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -64.8 92.25 0.09 Allowed 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.758 0.79 . . . . 0.0 111.662 -179.503 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 52.5 p-80 -124.74 147.76 48.46 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.39 0.614 . . . . 0.0 111.757 -179.32 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.457 HG13 HD21 ' A' ' 20' ' ' LEU . 32.1 pt -130.87 170.75 19.03 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.297 -179.176 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.429 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 7.1 t30 -107.12 125.09 50.62 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 116.272 -0.422 . . . . 0.0 109.862 179.181 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.468 HD23 HG12 ' A' ' 34' ' ' ILE . 2.7 mm? -114.72 141.66 47.53 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.824 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -128.37 142.24 51.18 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 -178.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.745 HG22 HG13 ' A' ' 84' ' ' ILE . 57.7 t -122.79 132.75 70.7 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.364 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 -178.049 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.47 124.58 47.96 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 -179.211 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.516 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -102.66 169.13 19.0 Favored Glycine 0 N--CA 1.431 -1.643 0 C-N-CA 120.086 -1.054 . . . . 0.0 112.737 -178.306 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -61.43 -5.6 1.82 Allowed 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.205 0.602 . . . . 0.0 112.514 178.835 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -86.36 -21.66 27.09 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.62 0.724 . . . . 0.0 109.683 178.505 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 104.73 -16.46 47.46 Favored Glycine 0 CA--C 1.491 -1.409 0 N-CA-C 109.957 -1.257 . . . . 0.0 109.957 -178.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.9 m -76.72 131.91 39.02 Favored 'General case' 0 N--CA 1.429 -1.516 0 CA-C-N 114.639 -0.781 . . . . 0.0 111.233 -178.395 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.504 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.1 p -122.17 140.81 44.92 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.896 178.892 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.466 HG11 ' HD3' ' A' ' 50' ' ' ARG . 10.9 t -121.99 138.46 52.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 -179.192 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -107.18 140.11 40.56 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.041 0.448 . . . . 0.0 111.139 -179.888 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.496 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 15.5 m-85 -132.84 151.97 51.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.128 0.49 . . . . 0.0 110.727 -177.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.468 HG12 HD23 ' A' ' 20' ' ' LEU . 24.5 pt -138.15 168.97 19.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.052 0.453 . . . . 0.0 110.933 -177.146 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 7.1 mtmp? -80.92 144.87 31.6 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 120.81 0.338 . . . . 0.0 110.693 178.875 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -68.73 -14.12 62.82 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.186 0.517 . . . . 0.0 111.475 -177.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 -101.76 -3.27 28.4 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-O 122.247 1.022 . . . . 0.0 108.367 -178.603 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.463 ' HB ' ' O ' ' A' ' 35' ' ' LYS . 1.5 m -93.96 140.33 22.91 Favored Pre-proline 0 N--CA 1.437 -1.082 0 CA-C-N 114.244 -1.343 . . . . 0.0 110.796 -178.715 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.557 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 35.5 Cg_endo -59.71 126.11 19.64 Favored 'Trans proline' 0 C--O 1.238 0.478 0 C-N-CA 122.98 2.453 . . . . 0.0 112.29 -179.346 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.657 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.9 OUTLIER -69.92 -16.55 63.24 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.378 0.609 . . . . 0.0 111.346 179.579 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.474 ' N ' HD12 ' A' ' 40' ' ' LEU . 0.7 OUTLIER -50.53 -31.79 16.57 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 123.919 0.887 . . . . 0.0 111.742 -179.597 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.557 ' HE3' ' HG2' ' A' ' 39' ' ' PRO . 90.6 mttt -59.08 -50.63 73.34 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.431 0.634 . . . . 0.0 109.982 179.293 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.657 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.7 pp -70.17 -32.25 70.12 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.049 -178.845 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 45.2 mtm -64.71 -50.63 66.18 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 120.786 0.327 . . . . 0.0 111.305 -178.555 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.474 ' HA ' ' SG ' ' A' ' 48' ' ' CYS . 24.4 mmmt -65.61 -33.81 76.76 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 120.911 0.386 . . . . 0.0 110.469 178.104 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.77 -37.5 87.82 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.136 0.493 . . . . 0.0 109.979 178.505 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -60.08 -56.41 21.96 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.464 177.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.474 ' SG ' ' HA ' ' A' ' 45' ' ' LYS . 24.5 p -61.88 -35.63 78.89 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 111.814 0.301 . . . . 0.0 111.814 -178.167 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 48.3 mt-10 -66.72 -43.52 84.06 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 122.214 -0.303 . . . . 0.0 111.525 179.59 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.466 ' HD3' HG11 ' A' ' 30' ' ' VAL . 14.0 ptm180 -76.66 -37.28 56.52 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.117 0.484 . . . . 0.0 111.483 -178.653 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.505 ' HB3' HD23 ' A' ' 53' ' ' LEU . 21.1 mm-40 -74.29 -21.92 59.52 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 120.967 0.413 . . . . 0.0 111.914 -178.561 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.96 42.14 7.78 Favored Glycine 0 N--CA 1.428 -1.882 0 C-N-CA 119.767 -1.206 . . . . 0.0 110.995 -177.318 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.505 HD23 ' HB3' ' A' ' 51' ' ' GLN . 4.0 mm? -125.05 167.0 15.37 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 51.1 m -116.88 151.67 36.11 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 178.076 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.3 mmt -59.62 -28.12 66.93 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-O 121.197 0.522 . . . . 0.0 111.779 178.481 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.498 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -84.67 -13.87 50.2 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.58 0.705 . . . . 0.0 110.587 177.646 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -93.48 -17.2 23.7 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.026 -178.618 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 14.3 pt -141.49 179.66 2.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 121.176 0.512 . . . . 0.0 111.426 -179.163 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.469 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 6.1 mmt180 -155.23 140.23 17.35 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.689 177.725 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -97.83 143.02 28.87 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.732 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? -141.8 135.98 30.2 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.556 0.693 . . . . 0.0 111.402 -178.297 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.459 ' HB2' HD11 ' A' ' 67' ' ' ILE . 78.6 t80 -142.87 146.93 34.57 Favored 'General case' 0 N--CA 1.433 -1.302 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 177.343 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.4 ' C ' ' H ' ' A' ' 65' ' ' GLN . 13.0 t70 50.45 40.69 23.69 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 121.254 0.549 . . . . 0.0 109.906 -176.639 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 66.2 -20.9 0.17 Allowed Glycine 0 CA--C 1.532 1.152 0 N-CA-C 115.462 0.945 . . . . 0.0 115.462 -176.637 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.4 ' H ' ' C ' ' A' ' 63' ' ' ASP . 3.6 pt20 -92.81 147.11 33.43 Favored Pre-proline 0 C--N 1.316 -0.867 0 CA-C-N 117.516 0.658 . . . . 0.0 110.944 -177.597 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -69.68 142.51 48.46 Favored 'Trans proline' 0 N--CA 1.452 -0.919 0 C-N-CA 122.146 1.898 . . . . 0.0 110.912 179.34 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.459 HD11 ' HB2' ' A' ' 62' ' ' PHE . 34.4 mt -91.52 144.12 9.86 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.184 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 -178.727 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -121.42 162.7 19.97 Favored 'General case' 0 CA--C 1.499 -0.986 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -178.834 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -72.73 -13.75 61.4 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 121.244 0.545 . . . . 0.0 110.49 178.339 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 22.0 p -95.07 4.7 53.43 Favored 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 179.646 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -105.45 154.61 20.1 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.4 0.619 . . . . 0.0 112.01 178.719 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.46 155.49 48.52 Favored Pre-proline 0 C--N 1.319 -0.738 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.978 177.724 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.615 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 13.2 Cg_endo -57.28 -30.92 89.29 Favored 'Trans proline' 0 C--O 1.236 0.381 0 C-N-CA 122.835 2.357 . . . . 0.0 112.253 -179.329 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.95 -16.57 60.64 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.75 -178.683 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -73.2 -39.64 65.4 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.375 0.607 . . . . 0.0 110.314 178.621 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.456 HD13 ' SD ' ' A' ' 78' ' ' MET . 1.1 mp -86.05 -2.57 58.44 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.682 179.047 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 59.33 30.84 20.62 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.261 179.077 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.615 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 5.7 ptm -76.55 168.21 20.48 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.031 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -136.59 -178.62 5.25 Favored 'General case' 0 C--N 1.313 -1.004 0 O-C-N 122.167 -0.333 . . . . 0.0 110.65 -177.12 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.431 ' O ' ' HB2' ' A' ' 81' ' ' GLU . 8.0 p-10 -61.56 141.08 57.99 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.553 0.692 . . . . 0.0 112.121 179.174 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.431 ' HB2' ' O ' ' A' ' 80' ' ' ASP . 4.6 mm-40 80.31 15.93 0.73 Allowed 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.278 1.431 . . . . 0.0 111.531 178.798 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.412 ' OD2' HD12 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -62.24 146.11 51.76 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.857 176.897 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 17.6 m -114.17 111.73 22.04 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-O 121.822 0.82 . . . . 0.0 112.332 175.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.745 HG13 HG22 ' A' ' 22' ' ' VAL . 14.3 mm -80.82 144.39 10.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 114.955 -1.021 . . . . 0.0 109.741 179.283 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -107.43 123.48 48.46 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 120.962 0.411 . . . . 0.0 110.982 178.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.516 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 86.7 t -113.46 139.04 40.95 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-O 121.205 0.526 . . . . 0.0 110.998 177.954 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.6 p90 -133.61 150.12 51.6 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.052 179.34 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.0 tp60 -74.55 127.53 33.31 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.741 0.782 . . . . 0.0 112.102 -177.35 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.465 ' HG3' ' HG2' ' A' ' 59' ' ' ARG . 28.2 mm-40 -101.98 16.15 26.86 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.563 176.365 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 55.8 tt0 -96.57 86.68 4.18 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 15.1 p -126.55 119.57 27.45 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.424 -177.138 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 58.52 42.81 96.15 Favored Glycine 0 N--CA 1.453 -0.216 0 CA-C-N 116.378 -0.374 . . . . 0.0 113.1 178.474 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.274 0 CA-C-O 118.313 -1.271 . . . . 0.0 111.363 -179.946 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 54.2 tpp . . . . . 0 N--CA 1.473 0.681 0 CA-C-O 120.891 0.377 . . . . 0.0 110.721 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -116.84 35.06 4.77 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.578 0.704 . . . . 0.0 110.55 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -76.33 -42.74 43.97 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 121.348 0.594 . . . . 0.0 110.686 -176.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -95.05 22.57 6.46 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.182 -176.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -137.52 96.4 10.89 Favored Pre-proline 0 C--N 1.315 -0.918 0 O-C-N 122.074 -0.391 . . . . 0.0 110.058 -179.375 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -77.51 175.79 10.85 Favored 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 122.637 2.225 . . . . 0.0 111.526 178.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.573 ' HD2' ' H ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -71.93 -2.52 18.33 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.198 0.523 . . . . 0.0 111.035 178.087 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -84.03 173.73 10.89 Favored 'General case' 0 N--CA 1.436 -1.134 0 CA-C-O 121.251 0.548 . . . . 0.0 111.212 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 120.04 32.11 1.22 Allowed Glycine 0 N--CA 1.442 -0.93 0 N-CA-C 111.564 -0.614 . . . . 0.0 111.564 -179.508 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.3 t -106.35 99.88 9.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.073 0.463 . . . . 0.0 110.221 -179.193 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 14.4 tppt? -67.8 148.87 50.65 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.255 0.55 . . . . 0.0 111.185 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.4 t -151.03 148.29 28.17 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.006 177.268 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 60.81 13.16 4.22 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.609 0.763 . . . . 0.0 112.501 179.71 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -133.34 16.13 4.09 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-O 121.733 0.777 . . . . 0.0 109.28 178.346 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -114.82 -41.04 3.43 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.153 -0.93 . . . . 0.0 108.945 179.022 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.439 ' O ' ' HB3' ' A' ' 17' ' ' HIS . 2.9 p-10 -136.64 -158.17 0.84 Allowed 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 177.179 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.439 ' HB3' ' O ' ' A' ' 16' ' ' ASP . 6.0 t-160 75.64 96.94 0.07 Allowed 'General case' 0 CA--C 1.493 -1.247 0 CA-C-O 122.139 0.971 . . . . 0.0 108.853 -179.035 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 45.2 pt -121.52 170.55 11.48 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.215 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.952 -173.564 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -105.5 135.43 46.91 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.37 178.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.409 HD23 HG12 ' A' ' 34' ' ' ILE . 3.1 mm? -127.25 134.42 50.07 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 177.784 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -118.51 146.54 44.46 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-O 121.23 0.538 . . . . 0.0 110.14 179.579 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.571 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 4.8 p -125.09 128.93 73.32 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.897 0 CA-C-N 116.108 -0.497 . . . . 0.0 109.992 -179.705 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -119.52 131.34 55.54 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.223 0.535 . . . . 0.0 109.906 -178.475 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -107.08 158.02 15.3 Favored Glycine 0 N--CA 1.432 -1.615 0 C-N-CA 120.41 -0.9 . . . . 0.0 111.355 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.19 -18.71 6.3 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 177.84 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -69.26 -21.88 63.87 Favored 'General case' 0 C--O 1.224 -0.288 0 O-C-N 121.961 -0.462 . . . . 0.0 110.574 177.6 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 103.79 2.77 46.25 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.043 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.0 t -93.7 159.39 15.23 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 179.213 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.571 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.6 p -148.97 136.91 14.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.05 0.452 . . . . 0.0 110.662 -179.445 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.8 t -118.93 135.54 59.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -106.72 143.14 35.25 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.824 0.345 . . . . 0.0 110.733 -179.384 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.564 ' HE1' HG12 ' A' ' 22' ' ' VAL . 14.0 m-85 -137.16 161.56 35.83 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.167 0.508 . . . . 0.0 110.83 -178.666 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.409 HG12 HD23 ' A' ' 20' ' ' LEU . 19.4 pt -130.67 171.54 17.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 121.1 0.476 . . . . 0.0 110.826 -177.472 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.423 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 32.7 mtmm -83.51 150.33 26.06 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 176.87 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -71.73 -11.07 60.64 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.269 0.556 . . . . 0.0 111.082 -178.724 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 18.8 t60 -99.16 -2.01 37.93 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.535 0.683 . . . . 0.0 109.636 -178.223 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -99.33 148.17 34.29 Favored Pre-proline 0 N--CA 1.442 -0.864 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.006 -178.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -65.12 131.53 28.91 Favored 'Trans proline' 0 C--O 1.239 0.553 0 C-N-CA 122.582 2.188 . . . . 0.0 112.509 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.486 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.2 pp -70.28 -16.93 63.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.131 0.491 . . . . 0.0 111.628 179.444 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.486 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 9.0 p -53.16 -28.25 25.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.076 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.0 mtmt -66.1 -42.98 88.55 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 120.861 0.362 . . . . 0.0 110.907 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.7 pp -71.89 -34.3 69.05 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 121.17 0.509 . . . . 0.0 109.794 178.382 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 47.9 mtm -65.07 -46.62 80.39 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 120.997 0.427 . . . . 0.0 110.722 -179.011 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.488 ' HA ' ' SG ' ' A' ' 48' ' ' CYS . 80.8 mttt -66.76 -36.15 81.77 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 120.855 0.36 . . . . 0.0 110.796 177.956 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.463 ' O ' ' HG2' ' A' ' 50' ' ' ARG . . . -63.34 -37.88 88.98 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.232 0.539 . . . . 0.0 109.666 178.732 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -61.14 -56.4 21.28 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.945 178.239 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.488 ' SG ' ' HA ' ' A' ' 45' ' ' LYS . 24.3 p -62.52 -38.65 90.8 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.727 0.298 . . . . 0.0 111.436 -177.435 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -65.95 -37.4 85.93 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 -179.808 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ARG . . . . . 0.463 ' HG2' ' O ' ' A' ' 46' ' ' ALA . 14.7 ptm180 -83.26 -33.25 26.07 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 121.87 -0.519 . . . . 0.0 111.438 -179.656 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.405 ' HB3' HD23 ' A' ' 53' ' ' LEU . 15.8 mm100 -78.61 -21.85 47.89 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-O 120.998 0.428 . . . . 0.0 112.053 -178.945 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.71 39.83 7.46 Favored Glycine 0 N--CA 1.433 -1.531 0 C-N-CA 120.167 -1.016 . . . . 0.0 111.24 -178.638 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.405 HD23 ' HB3' ' A' ' 51' ' ' GLN . 3.4 mm? -126.37 168.2 14.48 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.013 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.6 m -120.61 157.22 30.01 Favored 'General case' 0 C--N 1.312 -1.041 0 O-C-N 122.264 -0.273 . . . . 0.0 110.647 179.038 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 15.5 mmt -63.13 -26.76 68.97 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.422 0.63 . . . . 0.0 111.457 179.485 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.493 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.53 -12.99 50.34 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 121.548 0.689 . . . . 0.0 110.437 177.74 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -96.48 -26.03 15.44 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.911 -178.017 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.3 pt -135.29 176.37 8.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 120.819 0.342 . . . . 0.0 110.714 -179.028 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.413 ' HD3' ' HA ' ' A' ' 59' ' ' ARG . 17.4 mmt180 -152.88 146.57 25.12 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.209 0.528 . . . . 0.0 111.07 179.018 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -104.6 143.25 33.32 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.439 -177.815 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.445 ' HG2' ' O ' ' A' ' 65' ' ' GLN . 7.7 tmm_? -143.03 141.31 31.29 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-O 121.172 0.511 . . . . 0.0 110.859 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.536 ' HB2' HD11 ' A' ' 67' ' ' ILE . 69.5 t80 -146.8 147.42 30.87 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 178.45 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 24.8 t70 58.59 23.19 10.62 Favored 'General case' 0 N--CA 1.483 1.182 0 CA-C-O 121.869 0.842 . . . . 0.0 110.728 -178.199 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.2 1.32 85.48 Favored Glycine 0 N--CA 1.428 -1.835 0 C-N-CA 120.939 -0.648 . . . . 0.0 112.849 -179.213 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.445 ' O ' ' HG2' ' A' ' 61' ' ' ARG . 12.0 pt20 -116.72 147.44 39.9 Favored Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 122.148 -0.619 . . . . 0.0 110.599 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -67.62 141.05 53.71 Favored 'Trans proline' 0 C--O 1.237 0.431 0 C-N-CA 122.602 2.202 . . . . 0.0 111.824 -179.329 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.536 HD11 ' HB2' ' A' ' 62' ' ' PHE . 24.1 mt -98.79 141.24 16.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-O 121.049 0.452 . . . . 0.0 110.088 -179.183 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -112.39 170.61 8.05 Favored 'General case' 0 CA--C 1.497 -1.08 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 177.201 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.486 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 8.9 pt-20 -73.76 -17.01 61.15 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.564 0.697 . . . . 0.0 110.119 177.85 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 17.6 p -82.96 -21.62 33.97 Favored 'General case' 0 N--CA 1.434 -1.225 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.707 -177.574 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.64 154.08 32.55 Favored 'General case' 0 N--CA 1.437 -1.11 0 N-CA-C 112.999 0.741 . . . . 0.0 112.999 -178.079 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.412 ' OG1' ' HG2' ' A' ' 75' ' ' GLN . 0.9 OUTLIER -115.31 154.22 47.5 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.892 175.5 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_endo -57.88 -29.3 85.85 Favored 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.981 2.454 . . . . 0.0 111.915 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.83 -20.24 60.51 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.673 -178.296 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.412 ' HG2' ' OG1' ' A' ' 72' ' ' THR . 27.4 mm-40 -69.52 -37.06 76.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.363 0.602 . . . . 0.0 111.146 179.6 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.438 ' H ' HD12 ' A' ' 76' ' ' LEU . 1.1 mp -88.76 -2.15 58.45 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.204 -178.677 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 53.87 38.14 28.04 Favored 'General case' 0 C--N 1.345 0.388 0 CA-C-O 121.772 0.796 . . . . 0.0 110.985 179.351 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.1 ptm -77.79 169.49 18.2 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.631 -178.543 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -117.68 169.15 9.81 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -177.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -62.58 142.63 57.92 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 121.64 0.733 . . . . 0.0 111.439 176.481 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 74.71 16.77 3.03 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 124.847 1.259 . . . . 0.0 111.953 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.69 155.4 40.58 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.769 0.318 . . . . 0.0 110.276 176.365 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 84.3 m -111.0 132.15 54.45 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.696 0.76 . . . . 0.0 112.708 -175.543 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.429 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 41.5 mm -96.7 141.93 14.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.341 -0.845 . . . . 0.0 108.906 177.651 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -103.51 124.12 48.17 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 120.957 0.408 . . . . 0.0 110.919 179.233 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 99.0 t -115.28 136.16 52.94 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-O 121.264 0.555 . . . . 0.0 111.113 178.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.4 p90 -135.98 152.95 51.47 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.916 -179.446 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.412 ' HG3' ' H ' ' A' ' 90' ' ' GLN . 4.2 tp60 -80.04 113.91 18.57 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.339 0.59 . . . . 0.0 112.504 -176.555 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.401 ' HG3' ' CG ' ' A' ' 59' ' ' ARG . 15.0 mm100 -95.14 22.81 6.28 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.359 0.599 . . . . 0.0 111.303 176.517 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.412 ' H ' ' HG3' ' A' ' 88' ' ' GLN . 21.5 tm0? -105.92 101.5 11.0 Favored 'General case' 0 N--CA 1.438 -1.069 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 -179.755 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.8 t -145.74 143.75 29.92 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.251 -178.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 110.98 148.52 11.41 Favored Glycine 0 N--CA 1.431 -1.638 0 C-N-CA 120.543 -0.837 . . . . 0.0 111.996 178.746 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.372 0 CA-C-O 118.63 -1.094 . . . . 0.0 111.472 179.628 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.8 ptt? . . . . . 0 N--CA 1.482 1.16 0 N-CA-C 111.775 0.287 . . . . 0.0 111.775 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.56 4.71 17.56 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.381 0.61 . . . . 0.0 111.091 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -80.73 -13.94 58.55 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.634 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.502 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 45.0 mt-10 -108.91 138.3 45.46 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 177.258 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.502 ' HB2' ' O ' ' A' ' 4' ' ' GLU . 0.9 OUTLIER 76.13 155.6 0.15 Allowed Pre-proline 0 N--CA 1.472 0.637 0 C-N-CA 123.295 0.638 . . . . 0.0 111.343 178.18 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_endo -79.29 -160.19 0.12 Allowed 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.595 2.197 . . . . 0.0 110.904 177.679 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.445 ' HD2' ' N ' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -76.3 -12.79 60.13 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.382 0.611 . . . . 0.0 110.871 177.908 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.445 ' N ' ' HD2' ' A' ' 7' ' ' LYS . 9.5 pt-20 -108.4 176.59 5.07 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.213 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 93.47 22.5 26.5 Favored Glycine 0 N--CA 1.446 -0.695 0 N-CA-C 110.786 -0.926 . . . . 0.0 110.786 -176.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.2 p -97.45 134.08 36.81 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 CA-C-O 120.892 0.377 . . . . 0.0 110.407 -178.491 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.2 mptt 56.66 68.13 0.9 Allowed 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.737 0.78 . . . . 0.0 111.424 -177.519 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.0 t -85.38 165.8 16.93 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.217 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -81.79 28.37 0.42 Allowed 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.603 0.716 . . . . 0.0 111.355 -178.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -105.68 8.32 33.0 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.305 0.574 . . . . 0.0 109.815 177.709 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -84.13 -3.83 58.37 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.725 0.774 . . . . 0.0 109.953 179.203 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -73.95 103.83 4.59 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.099 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 55.8 p-80 -122.88 152.5 40.72 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.042 -177.168 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 36.5 pt -131.66 164.02 35.69 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-O 121.376 0.608 . . . . 0.0 111.037 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -96.11 136.92 35.93 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.377 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.487 HD23 HG12 ' A' ' 34' ' ' ILE . 3.0 mm? -129.75 139.66 51.25 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 176.837 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -125.03 144.98 50.12 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-O 121.213 0.53 . . . . 0.0 110.305 -179.354 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.604 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 5.2 p -122.72 132.06 72.02 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.532 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.551 -178.496 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.1 119.07 33.64 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.376 0.608 . . . . 0.0 110.151 -179.059 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -96.33 146.5 18.29 Favored Glycine 0 N--CA 1.428 -1.854 0 C-N-CA 120.836 -0.697 . . . . 0.0 111.493 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.486 ' HG3' ' O ' ' A' ' 86' ' ' VAL . 0.0 OUTLIER -53.29 -16.36 1.28 Allowed 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 178.866 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -71.91 -21.37 61.64 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.206 0.527 . . . . 0.0 110.394 177.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 103.71 27.22 6.45 Favored Glycine 0 N--CA 1.443 -0.855 0 N-CA-C 110.651 -0.98 . . . . 0.0 110.651 -178.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.1 p -122.01 131.84 54.21 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-O 120.977 0.418 . . . . 0.0 111.475 -178.296 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.604 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.4 p -124.08 137.1 58.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 121.161 0.505 . . . . 0.0 111.525 178.882 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.1 t -120.79 137.16 55.45 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 179.047 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -107.15 144.16 34.28 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.934 0.397 . . . . 0.0 111.265 -179.394 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.527 ' HE1' HG12 ' A' ' 22' ' ' VAL . 10.6 m-85 -140.79 158.86 43.35 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.282 0.563 . . . . 0.0 110.982 -178.72 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.487 HG12 HD23 ' A' ' 20' ' ' LEU . 33.7 pt -136.86 167.93 22.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-O 120.829 0.347 . . . . 0.0 110.44 -177.43 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.511 ' HB2' ' OG1' ' A' ' 38' ' ' THR . 0.0 OUTLIER -79.39 151.74 30.77 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.184 0.516 . . . . 0.0 110.919 179.584 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 36' ' ' ARG . 5.9 ptt180 -67.05 -18.0 65.15 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.384 0.611 . . . . 0.0 110.723 179.258 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 59.8 t60 -102.93 -3.5 26.06 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 122.186 0.993 . . . . 0.0 108.897 -177.615 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.511 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 2.3 m -90.16 136.01 29.26 Favored Pre-proline 0 C--N 1.306 -1.311 0 CA-C-N 114.502 -1.227 . . . . 0.0 110.473 -178.711 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.45 125.26 15.26 Favored 'Trans proline' 0 C--O 1.24 0.578 0 C-N-CA 122.447 2.098 . . . . 0.0 111.979 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.485 HD12 ' N ' ' A' ' 41' ' ' SER . 1.2 pp -62.61 -17.34 60.04 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.445 0.64 . . . . 0.0 111.303 179.247 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.485 ' N ' HD12 ' A' ' 40' ' ' LEU . 0.7 OUTLIER -51.42 -29.49 16.1 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 124.11 0.964 . . . . 0.0 111.37 179.312 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -62.85 -49.1 76.2 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.618 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.8 pp -68.83 -34.78 76.07 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 120.968 0.413 . . . . 0.0 110.058 179.57 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 48.1 mtm -61.36 -45.92 92.39 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 121.059 0.457 . . . . 0.0 110.447 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.688 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 7.9 mtpm? -69.28 -40.44 77.75 Favored 'General case' 0 C--O 1.212 -0.897 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.642 177.802 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.64 -40.17 82.66 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-O 121.444 0.64 . . . . 0.0 109.83 -179.23 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 58.8 t80 -56.89 -55.67 31.56 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.224 176.547 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.664 ' SG ' HD11 ' A' ' 58' ' ' ILE . 21.7 m -61.16 -39.94 91.98 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.87 0.367 . . . . 0.0 110.698 -179.231 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.688 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 69.2 mm-40 -58.75 -49.91 75.89 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 121.274 0.559 . . . . 0.0 111.098 178.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 -77.71 -36.83 50.61 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.805 -176.187 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.465 ' HB3' HD23 ' A' ' 53' ' ' LEU . 14.9 mm100 -76.25 -22.14 55.51 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -177.506 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.401 ' C ' HD22 ' A' ' 53' ' ' LEU . . . 85.22 42.52 7.0 Favored Glycine 0 N--CA 1.431 -1.659 0 C-N-CA 119.523 -1.323 . . . . 0.0 110.782 -176.518 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.465 HD23 ' HB3' ' A' ' 51' ' ' GLN . 4.1 mm? -125.16 164.15 20.89 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-O 121.149 0.5 . . . . 0.0 110.157 -179.847 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.8 m -117.0 154.15 31.41 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.0 mmt -63.88 -25.59 68.23 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-O 121.336 0.589 . . . . 0.0 111.093 179.022 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.85 -17.89 36.58 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.42 0.628 . . . . 0.0 110.772 177.554 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -88.78 -25.74 22.1 Favored 'General case' 0 CA--C 1.507 -0.697 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.352 -178.012 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.664 HD11 ' SG ' ' A' ' 48' ' ' CYS . 15.1 pt -136.08 -178.02 2.21 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.088 0 CA-C-O 121.022 0.439 . . . . 0.0 111.344 -179.204 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.438 ' HD3' ' HA ' ' A' ' 59' ' ' ARG . 19.3 mmt180 -157.89 146.9 19.46 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.505 177.222 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -102.77 146.34 28.39 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.151 -178.437 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 8.0 tmm_? -143.58 142.32 31.03 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.545 0.688 . . . . 0.0 111.326 -179.559 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.58 ' HB2' HD11 ' A' ' 67' ' ' ILE . 65.7 t80 -148.59 148.11 29.78 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.996 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 18.5 t70 57.59 22.7 8.47 Favored 'General case' 0 N--CA 1.484 1.273 0 CA-C-O 121.667 0.746 . . . . 0.0 110.978 -177.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.05 11.61 84.66 Favored Glycine 0 N--CA 1.43 -1.744 0 C-N-CA 120.477 -0.868 . . . . 0.0 112.627 -179.005 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -126.87 147.08 59.77 Favored Pre-proline 0 CA--C 1.534 0.338 0 O-C-N 122.222 -0.575 . . . . 0.0 109.891 178.546 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -66.21 143.34 70.65 Favored 'Trans proline' 0 CA--C 1.532 0.42 0 C-N-CA 122.314 2.01 . . . . 0.0 111.959 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.58 HD11 ' HB2' ' A' ' 62' ' ' PHE . 28.7 mt -97.7 148.84 5.43 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-O 120.95 0.405 . . . . 0.0 110.244 -178.484 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -125.79 169.96 12.08 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 178.93 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -77.19 -8.72 58.02 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-O 121.316 0.579 . . . . 0.0 110.311 177.905 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 41.0 p -91.12 -3.65 56.9 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.34 179.434 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -100.52 148.4 24.83 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.413 0.625 . . . . 0.0 112.173 -179.794 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -111.8 157.26 40.01 Favored Pre-proline 0 C--N 1.323 -0.559 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.766 178.137 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.583 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 18.0 Cg_endo -60.32 -31.24 92.59 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.733 2.289 . . . . 0.0 111.595 178.705 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -77.91 -11.02 59.86 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.555 -179.165 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -71.44 -48.37 49.95 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 121.638 0.732 . . . . 0.0 110.118 -179.465 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.498 ' H ' HD12 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -86.11 0.46 53.45 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.364 -178.169 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 51.98 44.17 29.71 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 121.731 0.777 . . . . 0.0 110.674 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.583 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.0 ptm -76.35 158.81 31.1 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.956 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -108.84 167.11 10.31 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-O 120.804 0.335 . . . . 0.0 110.577 -176.008 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -52.08 137.63 27.11 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.326 0.584 . . . . 0.0 111.443 174.517 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 67.65 23.76 8.66 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.083 -0.962 . . . . 0.0 112.482 178.084 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.98 150.41 47.72 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 175.307 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 28.8 m -106.31 126.75 52.62 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 121.558 0.694 . . . . 0.0 112.807 -174.646 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.439 HD11 ' HE1' ' A' ' 78' ' ' MET . 42.0 mm -93.06 140.93 15.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 176.814 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -106.36 123.33 47.9 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-O 121.054 0.454 . . . . 0.0 110.916 179.102 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.486 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 85.9 t -111.38 137.08 45.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.029 0.442 . . . . 0.0 111.193 179.682 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.2 p90 -134.3 152.87 52.05 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.855 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.467 ' HG3' ' H ' ' A' ' 90' ' ' GLN . 5.3 tp60 -77.31 118.56 19.91 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.516 0.674 . . . . 0.0 111.507 -178.106 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.434 ' HG3' ' CG ' ' A' ' 59' ' ' ARG . 55.5 mm-40 -102.72 20.26 17.62 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.075 178.017 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.467 ' H ' ' HG3' ' A' ' 88' ' ' GLN . 40.7 tt0 -88.36 109.37 19.93 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 178.133 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 62.3 m -131.1 99.51 4.9 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.232 0.539 . . . . 0.0 110.572 179.509 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 79.5 -76.59 1.96 Allowed Glycine 0 N--CA 1.444 -0.812 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.122 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.51 0 CA-C-O 118.181 -1.344 . . . . 0.0 111.477 -179.486 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.559 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 43.7 p-80 . . . . . 0 N--CA 1.434 -1.248 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 40.5 pt -119.26 162.14 17.75 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.838 0 CA-C-O 121.634 0.73 . . . . 0.0 111.375 -176.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.513 ' HA ' ' O ' ' A' ' 32' ' ' PHE . 23.7 t-20 -100.11 132.88 45.21 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.27 178.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -122.6 134.56 54.51 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-O 121.102 0.477 . . . . 0.0 109.793 177.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.412 ' HG2' ' HG3' ' A' ' 31' ' ' GLN . 48.3 mtmt -117.39 144.41 44.99 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.695 HG22 HG13 ' A' ' 84' ' ' ILE . 90.5 t -124.86 134.98 65.48 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.705 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -177.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -117.08 130.11 56.43 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.171 0.51 . . . . 0.0 110.819 -178.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -101.69 178.32 27.32 Favored Glycine 0 N--CA 1.43 -1.71 0 C-N-CA 121.036 -0.602 . . . . 0.0 111.896 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.673 ' H ' ' NE2' ' A' ' 25' ' ' GLN . 0.5 OUTLIER -60.52 -31.74 70.8 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.76 0.791 . . . . 0.0 110.592 -179.002 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -71.33 -16.0 62.42 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.285 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.31 5.95 69.27 Favored Glycine 0 N--CA 1.446 -0.684 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 -175.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 9.2 t -80.84 126.45 31.36 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.622 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 28.3 t -120.42 138.84 49.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-O 121.272 0.558 . . . . 0.0 110.878 -178.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.8 t -122.12 136.85 57.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 177.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.413 ' HB3' HD21 ' A' ' 19' ' ' ASN . 0.4 OUTLIER -104.74 143.82 32.58 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.742 0.306 . . . . 0.0 110.562 -179.586 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.513 ' O ' ' HA ' ' A' ' 19' ' ' ASN . 14.4 m-85 . . . . . 0 N--CA 1.47 0.543 0 CA-C-O 120.808 0.337 . . . . 0.0 110.702 -179.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.458 HD13 HD23 ' A' ' 43' ' ' LEU . 36.6 pt . . . . . 0 N--CA 1.465 0.284 0 CA-C-O 120.805 0.336 . . . . 0.0 111.007 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.559 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 0.0 OUTLIER -80.7 153.28 27.95 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 121.123 0.487 . . . . 0.0 110.641 178.456 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.5 ptt180 -63.43 -19.37 64.64 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.762 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 67.1 t60 -104.3 -3.55 24.07 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 122.161 0.981 . . . . 0.0 108.728 -176.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 m -86.68 132.32 42.81 Favored Pre-proline 0 N--CA 1.43 -1.441 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.96 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -59.91 122.07 10.83 Favored 'Trans proline' 0 C--O 1.239 0.565 0 C-N-CA 122.482 2.121 . . . . 0.0 112.413 -178.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.658 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.9 OUTLIER -63.37 -17.23 62.4 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.375 0.607 . . . . 0.0 111.102 179.075 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.491 ' N ' HD12 ' A' ' 40' ' ' LEU . 0.8 OUTLIER -50.69 -34.68 27.62 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 123.974 0.91 . . . . 0.0 111.211 179.193 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.3 mtpm? -59.15 -51.42 70.11 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.361 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.658 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.3 pp -68.72 -34.54 75.81 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.738 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 48.2 mtm -63.01 -51.18 67.8 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-O 121.152 0.501 . . . . 0.0 110.863 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -66.58 -34.59 78.22 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-O 121.021 0.438 . . . . 0.0 110.932 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.23 -36.52 84.36 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.08 0.467 . . . . 0.0 110.022 177.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -59.92 -55.63 31.68 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.672 178.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 26.5 p -65.12 -34.98 79.69 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 122.097 -0.377 . . . . 0.0 111.557 -177.098 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -65.89 -38.64 89.3 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.93 0.395 . . . . 0.0 111.751 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -85.27 -30.18 24.0 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.009 0.433 . . . . 0.0 111.165 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -82.66 -21.65 34.91 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -177.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 87.9 40.45 6.66 Favored Glycine 0 N--CA 1.437 -1.272 0 C-N-CA 119.882 -1.152 . . . . 0.0 111.198 -177.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.406 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 4.0 mm? -123.34 161.88 23.82 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.879 0.371 . . . . 0.0 110.262 179.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.459 ' HB2' ' HB2' ' A' ' 57' ' ' GLN . 48.3 m -114.79 150.07 35.99 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 110.346 -0.242 . . . . 0.0 110.346 178.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.2 mmt -64.44 -23.95 67.46 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.216 0.532 . . . . 0.0 111.508 178.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.425 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -84.41 -17.48 39.15 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.306 0.574 . . . . 0.0 110.368 176.922 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.459 ' HB2' ' HB2' ' A' ' 54' ' ' SER . 2.4 mp0 -93.31 -30.13 15.29 Favored 'General case' 0 CA--C 1.507 -0.696 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.896 -178.286 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.7 pt -128.57 178.35 5.06 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.249 0 CA-C-O 121.39 0.614 . . . . 0.0 111.862 -178.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.405 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 15.5 mmt180 -156.55 142.54 18.0 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.394 177.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -97.36 148.3 23.3 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -147.65 134.75 20.39 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-O 121.245 0.545 . . . . 0.0 111.087 -176.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.492 ' HB2' HD11 ' A' ' 67' ' ' ILE . 69.2 t80 -141.41 147.86 38.66 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.44 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 17.3 t70 55.94 23.52 6.71 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-O 121.826 0.822 . . . . 0.0 110.32 -176.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.58 -21.63 21.09 Favored Glycine 0 N--CA 1.423 -2.21 0 CA-C-N 115.7 -0.682 . . . . 0.0 112.638 -179.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.427 HE21 HD23 ' A' ' 76' ' ' LEU . 12.4 pt20 -95.31 149.07 35.64 Favored Pre-proline 0 C--N 1.324 -0.54 0 O-C-N 122.518 -0.401 . . . . 0.0 111.502 -177.572 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -70.96 142.95 43.84 Favored 'Trans proline' 0 C--O 1.235 0.351 0 C-N-CA 122.776 2.317 . . . . 0.0 112.138 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.492 HD11 ' HB2' ' A' ' 62' ' ' PHE . 15.9 mt -99.0 147.28 7.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-O 120.983 0.421 . . . . 0.0 110.825 -179.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -128.24 172.95 10.56 Favored 'General case' 0 CA--C 1.507 -0.673 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.356 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -75.01 -8.08 55.5 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.235 0.541 . . . . 0.0 110.984 177.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 26.2 p -93.45 -4.17 51.77 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.276 0.56 . . . . 0.0 111.141 178.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -94.68 144.51 25.56 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.487 0.661 . . . . 0.0 112.006 179.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -117.46 149.41 44.72 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.686 177.119 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.403 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 17.8 Cg_endo -59.71 -31.32 94.0 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.939 2.426 . . . . 0.0 113.469 -175.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.28 -23.05 63.78 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -178.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 6.1 mp0 -69.86 -37.35 76.09 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.098 0.475 . . . . 0.0 111.125 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.439 ' H ' HD12 ' A' ' 76' ' ' LEU . 1.2 mp -86.48 -5.21 59.21 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 -178.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 55.96 44.48 25.57 Favored 'General case' 0 C--N 1.344 0.332 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.514 179.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.403 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 5.8 ptm -86.12 161.35 18.93 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.003 -177.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -112.18 164.94 12.61 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 -178.112 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.452 ' CB ' ' H ' ' A' ' 19' ' ' ASN . 6.2 p-10 -62.48 144.77 55.59 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.654 0.74 . . . . 0.0 112.137 176.565 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 73.82 17.9 3.47 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.282 -1.326 . . . . 0.0 112.109 179.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -78.19 164.42 24.95 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 120.303 -0.559 . . . . 0.0 109.731 176.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 21.0 m -114.21 138.15 50.84 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.611 0.72 . . . . 0.0 112.868 -175.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.695 HG13 HG22 ' A' ' 22' ' ' VAL . 19.7 mm -99.18 139.34 21.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.443 -0.798 . . . . 0.0 109.858 178.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -98.32 116.78 31.26 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.981 0.42 . . . . 0.0 110.76 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.438 HG12 HE22 ' A' ' 25' ' ' GLN . 73.4 t -111.03 137.87 41.68 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.12 0 CA-C-O 121.189 0.519 . . . . 0.0 110.133 177.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.8 p90 -136.52 156.7 48.22 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.858 -178.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.95 116.05 23.94 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.436 0.636 . . . . 0.0 111.443 -177.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 . . . . . 0 C--N 1.319 -0.74 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.604 177.97 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 0.3 OUTLIER . . . . . 0 N--CA 1.45 -0.448 0 CA-C-O 122.09 0.948 . . . . 0.0 112.341 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.525 HG13 HD21 ' A' ' 20' ' ' LEU . 39.6 pt -131.95 171.03 18.71 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.212 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.159 -177.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.519 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 24.8 t-20 -102.52 126.96 49.76 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-O 120.881 0.372 . . . . 0.0 110.162 179.096 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.609 HD23 HG12 ' A' ' 34' ' ' ILE . 2.7 mm? -118.84 141.54 48.55 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 177.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.422 ' HE2' ' HA ' ' A' ' 81' ' ' GLU . 49.4 mtmt -128.78 141.25 51.37 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-O 121.725 0.774 . . . . 0.0 110.814 -178.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.624 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 3.6 p -120.8 127.61 75.96 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.943 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.262 -177.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -120.83 131.91 54.71 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-O 121.19 0.519 . . . . 0.0 110.052 -179.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -109.19 148.01 16.94 Favored Glycine 0 N--CA 1.426 -1.98 0 C-N-CA 120.519 -0.848 . . . . 0.0 111.241 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.51 ' HG3' ' O ' ' A' ' 86' ' ' VAL . 0.0 OUTLIER -53.56 -12.31 0.46 Allowed 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 179.261 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -73.55 -21.88 60.24 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.505 0.669 . . . . 0.0 110.219 176.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.86 30.15 4.66 Favored Glycine 0 CA--C 1.501 -0.812 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.398 176.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.0 p -124.25 157.93 33.69 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 120.857 0.36 . . . . 0.0 110.735 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.624 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.7 p -149.55 139.2 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-O 121.116 0.484 . . . . 0.0 111.266 -178.263 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.468 HG11 ' HD3' ' A' ' 50' ' ' ARG . 6.4 t -122.88 138.03 54.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.204 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -108.17 144.83 35.05 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.827 0.346 . . . . 0.0 110.553 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.548 ' HE1' HG12 ' A' ' 22' ' ' VAL . 7.0 m-85 . . . . . 0 N--CA 1.463 0.216 0 CA-C-O 120.898 0.38 . . . . 0.0 110.567 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.609 HG12 HD23 ' A' ' 20' ' ' LEU . 21.2 pt . . . . . 0 CA--C 1.514 -0.408 0 CA-C-O 120.837 0.351 . . . . 0.0 110.514 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 9.5 mptt -75.6 150.8 37.95 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 4.2 ppt_? -71.79 -12.91 61.53 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 121.194 0.521 . . . . 0.0 110.951 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -103.1 -4.44 24.5 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 122.115 0.96 . . . . 0.0 108.669 179.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.533 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.8 m -86.39 135.23 36.77 Favored Pre-proline 0 C--N 1.304 -1.386 0 CA-C-N 114.799 -1.092 . . . . 0.0 110.241 -178.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -59.48 124.21 15.01 Favored 'Trans proline' 0 C--O 1.236 0.399 0 C-N-CA 122.668 2.245 . . . . 0.0 112.326 -179.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.6 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.2 pp -66.13 -17.19 64.56 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.298 0.571 . . . . 0.0 111.688 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.478 ' N ' HD12 ' A' ' 40' ' ' LEU . 3.3 p -54.25 -29.34 46.4 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.895 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -64.24 -40.99 97.16 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.461 -179.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.0 pp -73.28 -33.66 65.36 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.055 0.455 . . . . 0.0 110.074 178.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 51.6 mtm -65.66 -49.81 67.25 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.941 -178.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.41 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 38.0 mttp -67.75 -35.4 78.66 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.624 178.714 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.22 -32.02 73.44 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.146 0.498 . . . . 0.0 109.988 178.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -64.11 -55.95 18.35 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.609 178.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 17.6 p -63.16 -36.11 82.54 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.841 0.353 . . . . 0.0 111.194 -177.451 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 43.9 mt-10 -67.12 -40.35 86.8 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.92 0.391 . . . . 0.0 111.711 -179.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.468 ' HD3' HG11 ' A' ' 30' ' ' VAL . 10.3 ptm180 -84.64 -31.28 24.3 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 122.02 -0.425 . . . . 0.0 111.84 -177.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.3 mm-40 -80.7 -22.53 40.27 Favored 'General case' 0 CA--C 1.508 -0.672 0 CA-C-O 121.006 0.431 . . . . 0.0 111.747 -178.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.401 ' C ' HD22 ' A' ' 53' ' ' LEU . . . 88.32 40.98 6.3 Favored Glycine 0 N--CA 1.431 -1.691 0 C-N-CA 120.153 -1.022 . . . . 0.0 111.249 -178.124 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.454 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 3.9 mm? -125.09 166.38 16.51 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.878 -0.415 . . . . 0.0 109.878 179.404 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 57.4 m -117.03 152.95 33.57 Favored 'General case' 0 C--N 1.316 -0.856 0 O-C-N 122.218 -0.301 . . . . 0.0 110.285 178.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 12.9 mmt -61.28 -27.44 68.47 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.213 0.53 . . . . 0.0 111.566 178.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.76 -12.34 53.92 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.518 0.675 . . . . 0.0 110.49 176.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -96.82 -16.87 20.57 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.159 -178.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.6 pt -140.37 176.75 4.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-O 121.204 0.526 . . . . 0.0 111.32 -179.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.553 ' CG ' ' HG3' ' A' ' 89' ' ' GLN . 3.3 mmt85 -151.53 140.15 20.7 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.914 178.539 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -101.39 138.77 37.96 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.415 -178.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 4.9 ttt180 -140.11 146.96 39.55 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.055 -178.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.532 ' HB2' HD11 ' A' ' 67' ' ' ILE . 78.3 t80 -152.57 143.82 23.22 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 178.253 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 54.71 24.87 5.92 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.351 0.596 . . . . 0.0 111.355 -178.193 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.38 -21.96 32.44 Favored Glycine 0 N--CA 1.443 -0.896 0 CA-C-N 116.161 -0.472 . . . . 0.0 113.141 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.532 HE21 HD23 ' A' ' 76' ' ' LEU . 8.6 pt20 -98.84 151.59 37.47 Favored Pre-proline 0 C--N 1.321 -0.639 0 O-C-N 122.434 -0.45 . . . . 0.0 111.52 -177.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -71.27 139.61 35.47 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.499 2.132 . . . . 0.0 111.36 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.532 HD11 ' HB2' ' A' ' 62' ' ' PHE . 39.0 mt -89.58 147.22 5.35 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-O 120.839 0.352 . . . . 0.0 110.418 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.461 HD22 ' HB2' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -114.84 156.83 24.2 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 178.0 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.461 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 14.6 pt-20 -73.25 -12.08 60.73 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.547 0.689 . . . . 0.0 110.997 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 16.4 p -97.61 14.24 27.34 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.344 177.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.461 ' HB2' HD22 ' A' ' 68' ' ' ASN . 2.8 t70 -98.04 151.69 20.08 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.123 0.487 . . . . 0.0 110.817 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.452 ' CG2' ' HD2' ' A' ' 73' ' ' PRO . 1.6 m -113.57 141.02 25.26 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 178.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.484 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 16.2 Cg_endo -54.39 -34.03 79.33 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 123.01 2.474 . . . . 0.0 112.263 -178.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.69 -16.14 63.29 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.865 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 24.8 mm-40 -74.62 -37.49 62.8 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.093 0.473 . . . . 0.0 111.079 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.532 HD23 HE21 ' A' ' 65' ' ' GLN . 1.0 OUTLIER -86.86 -1.24 57.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.222 -178.24 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 60.0 mm-40 58.4 33.56 23.23 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.562 0.696 . . . . 0.0 110.887 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.484 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.1 ptm -78.83 161.28 26.89 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.967 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -125.17 174.4 8.1 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 -178.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.519 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 7.0 p-10 -57.11 144.01 36.38 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 121.438 0.637 . . . . 0.0 112.08 177.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.422 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 58.2 mm-40 77.44 19.64 1.22 Allowed 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 124.901 1.28 . . . . 0.0 111.526 178.091 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.27 150.57 38.83 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.109 177.404 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 16.5 m -112.61 114.21 26.72 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 121.271 0.557 . . . . 0.0 112.053 175.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.499 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 28.9 mm -81.54 142.16 14.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.322 177.223 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -100.07 116.23 31.61 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-O 120.615 0.245 . . . . 0.0 111.102 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.51 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 67.6 t -114.71 135.66 53.86 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-O 121.041 0.448 . . . . 0.0 110.762 177.225 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . 0.434 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 10.7 p90 -135.5 153.77 51.63 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.931 -179.248 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.35 120.92 23.04 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.456 0.646 . . . . 0.0 112.11 -175.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.553 ' HG3' ' CG ' ' A' ' 59' ' ' ARG . 30.3 mm-40 . . . . . 0 C--N 1.319 -0.759 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.686 177.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.591 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 38.8 p-80 . . . . . 0 N--CA 1.438 -1.047 0 CA-C-O 121.75 0.786 . . . . 0.0 112.609 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.483 HG13 HD21 ' A' ' 20' ' ' LEU . 29.7 pt -132.86 170.13 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.244 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.64 178.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.499 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 27.5 t-20 -105.2 129.42 53.58 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 178.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.557 HD23 HG12 ' A' ' 34' ' ' ILE . 2.7 mm? -117.38 142.48 47.06 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -127.56 140.59 52.02 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-O 121.477 0.655 . . . . 0.0 110.155 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.618 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 2.7 p -120.89 126.12 74.85 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.035 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.808 -176.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -115.2 128.22 56.02 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.263 0.554 . . . . 0.0 110.154 -178.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.458 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -99.87 158.66 19.65 Favored Glycine 0 N--CA 1.43 -1.714 0 C-N-CA 120.335 -0.936 . . . . 0.0 111.312 179.421 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.67 -16.49 1.66 Allowed 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 177.668 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -77.38 -21.6 52.97 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.458 0.647 . . . . 0.0 110.844 178.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.01 -8.55 45.77 Favored Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.915 -0.659 . . . . 0.0 111.928 -178.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.9 t -78.85 153.99 30.17 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.618 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.7 p -149.75 140.57 16.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 120.875 0.369 . . . . 0.0 111.071 -177.404 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.55 HG11 ' HD3' ' A' ' 50' ' ' ARG . 4.7 t -123.2 139.59 49.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -108.82 142.34 39.54 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.842 0.353 . . . . 0.0 110.674 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.556 ' HE1' HG12 ' A' ' 22' ' ' VAL . 16.7 m-85 . . . . . 0 N--CA 1.468 0.472 0 CA-C-O 121.289 0.566 . . . . 0.0 111.293 -177.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.557 HG12 HD23 ' A' ' 20' ' ' LEU . 27.2 pt . . . . . 0 CA--C 1.513 -0.478 0 CA-C-O 120.844 0.354 . . . . 0.0 110.097 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.591 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 0.0 OUTLIER -77.34 150.01 35.22 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.553 179.843 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 3.4 ppt_? -70.41 -8.35 50.15 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.673 0.749 . . . . 0.0 110.211 179.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 30.1 t-80 -104.48 -8.22 19.25 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 -179.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.406 ' HB ' ' O ' ' A' ' 35' ' ' LYS . 1.2 m -87.16 137.9 32.72 Favored Pre-proline 0 N--CA 1.44 -0.956 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.108 179.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -60.7 126.48 19.9 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.374 2.05 . . . . 0.0 112.176 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.512 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.3 pp -67.21 -17.75 64.95 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -178.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.469 ' N ' HD12 ' A' ' 40' ' ' LEU . 2.8 p -55.89 -28.86 58.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.886 0.374 . . . . 0.0 111.831 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -60.29 -46.24 90.54 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 120.928 0.394 . . . . 0.0 110.375 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.8 pp -71.83 -35.65 69.95 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.043 0.449 . . . . 0.0 110.436 179.27 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 47.6 mtm -63.07 -46.01 89.46 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.18 0.514 . . . . 0.0 110.863 -178.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.5 mtpm? -69.84 -37.05 76.05 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.44 178.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.415 ' O ' ' HG2' ' A' ' 50' ' ' ARG . . . -62.27 -37.76 86.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.157 0.503 . . . . 0.0 109.945 178.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -58.42 -55.64 32.44 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.184 177.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.611 ' SG ' HD11 ' A' ' 58' ' ' ILE . 22.5 m -60.24 -44.93 94.81 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.339 0.59 . . . . 0.0 110.741 -177.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -67.32 -30.85 70.8 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 112.824 0.676 . . . . 0.0 112.824 -176.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.55 ' HD3' HG11 ' A' ' 30' ' ' VAL . 13.8 ptm180 -90.65 -34.06 15.58 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.823 -0.548 . . . . 0.0 111.551 179.141 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 21.4 mm-40 -78.52 -21.82 48.27 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 121.154 0.502 . . . . 0.0 111.924 -178.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.82 39.83 6.45 Favored Glycine 0 N--CA 1.432 -1.614 0 C-N-CA 119.947 -1.12 . . . . 0.0 110.933 -177.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -123.81 166.18 16.04 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.7 m -118.31 155.27 30.93 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 178.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.6 mmt -61.93 -28.16 69.34 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-O 121.451 0.644 . . . . 0.0 111.185 177.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.27 -17.89 38.19 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.44 0.638 . . . . 0.0 110.841 177.537 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -88.58 -25.8 22.28 Favored 'General case' 0 CA--C 1.504 -0.807 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.815 -177.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.611 HD11 ' SG ' ' A' ' 48' ' ' CYS . 12.0 pt -133.27 178.65 5.32 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.157 0 CA-C-O 121.497 0.665 . . . . 0.0 112.532 -178.273 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 6.7 mmt180 -148.4 139.4 23.13 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.303 177.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -99.69 141.68 32.17 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.886 179.224 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -142.33 143.79 32.91 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-O 121.006 0.431 . . . . 0.0 110.937 -176.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.454 ' HB2' HD11 ' A' ' 67' ' ' ILE . 73.0 t80 -149.28 146.21 27.45 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.646 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 17.9 t70 56.82 22.83 7.39 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-O 121.778 0.799 . . . . 0.0 110.481 -178.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.19 -21.05 26.44 Favored Glycine 0 N--CA 1.429 -1.817 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.562 -179.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -95.72 156.46 37.34 Favored Pre-proline 0 C--N 1.329 -0.313 0 O-C-N 122.575 -0.368 . . . . 0.0 111.131 -178.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -77.17 142.04 21.24 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 122.496 2.131 . . . . 0.0 111.589 178.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.454 HD11 ' HB2' ' A' ' 62' ' ' PHE . 38.8 mt -90.04 153.41 3.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 120.949 0.404 . . . . 0.0 110.589 -178.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.57 HD22 ' HB2' ' A' ' 71' ' ' ASP . 0.1 OUTLIER -116.38 162.82 16.95 Favored 'General case' 0 CA--C 1.498 -1.038 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 178.889 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.496 ' H ' ' CD ' ' A' ' 69' ' ' GLU . 0.8 OUTLIER -75.27 -18.82 59.99 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-O 121.39 0.614 . . . . 0.0 110.349 178.984 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 8.3 t -98.96 11.97 37.33 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.375 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.57 ' HB2' HD22 ' A' ' 68' ' ' ASN . 0.9 OUTLIER -95.53 154.09 17.38 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-O 120.959 0.409 . . . . 0.0 110.596 -179.594 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -114.03 147.83 38.66 Favored Pre-proline 0 C--N 1.316 -0.891 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.249 178.575 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.547 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 18.6 Cg_endo -58.91 -28.65 88.1 Favored 'Trans proline' 0 C--O 1.238 0.514 0 C-N-CA 122.79 2.327 . . . . 0.0 112.018 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -77.91 -14.77 59.44 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.506 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.8 tp60 -68.32 -42.35 79.5 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.653 0.74 . . . . 0.0 109.56 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.449 ' H ' HD12 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -91.05 -1.8 57.74 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.146 -179.472 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 56.94 34.75 25.37 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.277 179.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.547 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 4.7 ptm -68.92 159.8 31.99 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.012 0.434 . . . . 0.0 110.851 -178.357 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -115.98 166.53 11.89 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.173 -176.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.499 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 9.7 p-10 -61.1 141.37 57.47 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.39 0.614 . . . . 0.0 111.775 177.014 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 81.83 17.06 0.43 Allowed 'General case' 0 C--O 1.236 0.355 0 C-N-CA 125.419 1.487 . . . . 0.0 110.877 -179.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.41 ' OD1' HD12 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -61.52 148.73 41.12 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.523 178.496 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 29.4 m -111.07 110.52 21.1 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 121.419 0.628 . . . . 0.0 112.252 176.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.475 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 28.1 mm -79.45 139.37 18.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.523 177.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -98.12 113.86 25.88 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.915 0.388 . . . . 0.0 110.541 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.458 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 82.0 t -111.55 134.72 53.03 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 CA-C-O 121.292 0.568 . . . . 0.0 111.019 178.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -131.27 166.78 20.43 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.546 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.526 ' NE2' HG22 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -95.1 133.02 39.37 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.597 0.713 . . . . 0.0 111.93 -174.387 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 . . . . . 0 C--N 1.318 -0.78 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.717 177.124 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.51 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 11.4 p-80 . . . . . 0 N--CA 1.448 -0.567 0 CA-C-O 121.114 0.483 . . . . 0.0 110.682 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.447 HG13 HD21 ' A' ' 20' ' ' LEU . 29.2 pt -127.53 170.91 16.62 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.122 0 CA-C-O 121.295 0.569 . . . . 0.0 110.725 -178.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.452 ' HA ' ' O ' ' A' ' 32' ' ' PHE . 25.3 t-20 -107.28 122.5 46.67 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.838 179.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.447 HD21 HG13 ' A' ' 18' ' ' ILE . 2.8 mm? -113.16 139.58 48.64 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 178.558 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -125.01 141.29 52.22 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 -178.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.73 HG22 HG13 ' A' ' 84' ' ' ILE . 85.6 t -120.7 130.31 74.69 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.697 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.121 -177.118 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -116.37 123.81 48.53 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-O 121.293 0.568 . . . . 0.0 110.295 -179.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.505 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -96.13 158.72 21.84 Favored Glycine 0 N--CA 1.426 -2.001 0 C-N-CA 120.238 -0.982 . . . . 0.0 110.98 178.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -52.57 -16.42 0.92 Allowed 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 178.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -76.14 -22.13 55.8 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.387 0.613 . . . . 0.0 110.854 178.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 99.33 9.93 49.54 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 -177.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.4 t -96.45 125.05 40.67 Favored 'General case' 0 N--CA 1.44 -0.94 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.555 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 16.3 t -118.08 141.16 38.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 121.062 0.458 . . . . 0.0 110.953 -179.008 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.599 HG11 ' HD3' ' A' ' 50' ' ' ARG . 16.2 t -124.56 138.7 53.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 178.163 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.407 ' HB3' HD21 ' A' ' 19' ' ' ASN . 0.4 OUTLIER -107.89 142.41 38.01 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.748 0.308 . . . . 0.0 110.591 -179.766 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.504 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 15.9 m-85 . . . . . 0 C--N 1.329 -0.324 0 CA-C-O 120.99 0.424 . . . . 0.0 110.687 -178.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.493 HD13 HD23 ' A' ' 43' ' ' LEU . 22.3 pt . . . . . 0 CA--C 1.516 -0.356 0 CA-C-O 120.751 0.31 . . . . 0.0 110.48 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.51 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 86.3 mttt -77.28 150.36 35.3 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 178.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.4 ptt180 -69.37 -18.47 63.78 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.302 0.573 . . . . 0.0 111.092 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 49.3 t-80 -103.33 -1.14 29.2 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 122.329 1.061 . . . . 0.0 108.867 -176.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.434 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.7 m -91.17 138.21 25.94 Favored Pre-proline 0 C--N 1.304 -1.381 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.46 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -58.0 120.06 7.71 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.676 2.251 . . . . 0.0 112.085 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.601 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.3 pt? -66.93 -15.95 64.02 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.21 0.529 . . . . 0.0 111.364 -179.022 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.533 ' HB2' ' O ' ' A' ' 69' ' ' GLU . 44.4 t -49.71 -32.87 14.41 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.219 177.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 39.2 mtmt -60.57 -47.48 86.02 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 120.978 0.418 . . . . 0.0 110.305 179.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.2 pp -72.67 -35.75 67.77 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.468 -179.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 63.3 mtm -62.61 -48.0 81.29 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 120.997 0.427 . . . . 0.0 110.831 179.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.441 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 47.9 mttp -66.72 -35.57 80.42 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.144 0.497 . . . . 0.0 110.344 177.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.83 -35.31 80.19 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.297 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -63.5 -54.38 37.18 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.788 178.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 22.5 p -64.01 -36.4 83.86 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 120.726 0.298 . . . . 0.0 111.314 -176.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 44.3 mt-10 -66.6 -42.05 87.51 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.749 0.309 . . . . 0.0 111.673 -179.172 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.599 ' HD3' HG11 ' A' ' 30' ' ' VAL . 9.9 ptm180 -79.21 -27.03 42.52 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.251 0.548 . . . . 0.0 110.77 -178.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 23.4 mm-40 -84.03 -20.64 32.39 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 94.29 7.04 61.01 Favored Glycine 0 N--CA 1.444 -0.803 0 C-N-CA 120.339 -0.934 . . . . 0.0 112.817 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -98.13 174.27 6.61 Favored 'General case' 0 C--N 1.321 -0.672 0 O-C-N 122.071 -0.664 . . . . 0.0 111.199 -179.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.403 ' HB2' ' OE1' ' A' ' 57' ' ' GLN . 16.8 m -125.1 158.84 32.86 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.617 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.0 mmt -62.87 -27.21 69.19 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.134 0.492 . . . . 0.0 111.954 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.501 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.18 -14.38 47.08 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.482 0.658 . . . . 0.0 110.527 177.485 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.403 ' OE1' ' HB2' ' A' ' 54' ' ' SER . 1.2 mp0 -92.1 -25.87 18.55 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.779 -178.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.409 HG22 ' NE2' ' A' ' 88' ' ' GLN . 12.8 pt -136.42 178.93 4.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.181 0.515 . . . . 0.0 111.442 -178.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.445 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 7.8 mmt180 -154.74 140.9 18.49 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.708 177.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -97.91 142.35 29.76 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.639 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.01 137.98 28.06 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-O 121.119 0.485 . . . . 0.0 111.029 -176.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.437 ' HB2' HD11 ' A' ' 67' ' ' ILE . 85.5 t80 -143.64 147.48 34.39 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.9 t70 59.43 21.2 9.58 Favored 'General case' 0 N--CA 1.482 1.16 0 CA-C-O 122.181 0.991 . . . . 0.0 109.701 -178.069 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.15 -20.36 21.65 Favored Glycine 0 N--CA 1.42 -2.394 0 CA-C-N 115.532 -0.758 . . . . 0.0 112.299 -178.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.452 HE21 HD23 ' A' ' 76' ' ' LEU . 12.6 pt20 -95.6 149.53 36.21 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-O 121.124 0.488 . . . . 0.0 111.336 -177.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_exo -66.57 138.08 48.58 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.787 2.325 . . . . 0.0 111.823 177.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.545 HG21 HD11 ' A' ' 40' ' ' LEU . 53.2 mt -89.04 150.57 3.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 110.17 -0.307 . . . . 0.0 110.17 179.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.629 HD22 ' HB2' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -120.2 152.99 36.91 Favored 'General case' 0 CA--C 1.502 -0.897 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 177.865 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.533 ' O ' ' HB2' ' A' ' 41' ' ' SER . 7.3 pt-20 -72.59 -18.07 61.64 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-O 121.296 0.57 . . . . 0.0 111.569 -177.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.9 t -92.98 7.7 42.96 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-O 120.934 0.397 . . . . 0.0 111.383 -178.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.629 ' HB2' HD22 ' A' ' 68' ' ' ASN . 0.9 OUTLIER -101.05 171.77 7.42 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.204 0.526 . . . . 0.0 111.335 -179.678 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.404 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.6 OUTLIER -124.29 149.8 62.08 Favored Pre-proline 0 C--N 1.319 -0.758 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.877 177.901 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.6 -31.39 92.17 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.056 2.504 . . . . 0.0 112.684 -178.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.63 -18.9 63.63 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.938 0.399 . . . . 0.0 111.346 -179.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.404 ' HB2' ' O ' ' A' ' 72' ' ' THR . 26.4 mm-40 -70.67 -37.85 73.69 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.212 0.529 . . . . 0.0 110.685 178.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.467 ' H ' HD12 ' A' ' 76' ' ' LEU . 0.9 OUTLIER -90.52 5.9 45.82 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 179.433 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 45.43 33.68 1.37 Allowed 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.004 1.322 . . . . 0.0 112.213 -179.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.1 ptm -69.6 160.89 30.71 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.366 -179.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -119.76 166.96 12.56 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.258 -176.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.451 ' O ' ' HB2' ' A' ' 81' ' ' GLU . 5.9 p-10 -59.84 145.61 44.96 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.119 0.485 . . . . 0.0 111.579 177.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.451 ' HB2' ' O ' ' A' ' 80' ' ' ASP . 3.4 mm-40 79.8 16.3 0.82 Allowed 'General case' 0 C--O 1.233 0.213 0 C-N-CA 124.862 1.265 . . . . 0.0 110.936 -178.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.414 ' OD2' HD12 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -63.84 147.97 50.52 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.161 177.956 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 11.7 m -110.87 110.33 20.88 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.43 0.633 . . . . 0.0 111.748 176.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.73 HG13 HG22 ' A' ' 22' ' ' VAL . 13.2 mm -80.02 139.67 17.89 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.216 178.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -96.79 113.07 24.59 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.887 0.375 . . . . 0.0 110.582 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.505 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 43.9 t -111.02 134.82 52.09 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 CA-C-O 121.55 0.69 . . . . 0.0 110.808 177.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.6 p90 -134.2 153.89 51.57 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.81 -178.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.409 ' NE2' HG22 ' A' ' 58' ' ' ILE . 4.9 tp60 -78.49 114.12 17.11 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.044 0.45 . . . . 0.0 110.824 -177.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 . . . . . 0 C--N 1.32 -0.682 0 CA-C-O 121.479 0.657 . . . . 0.0 110.061 178.427 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 30.5 p-80 . . . . . 0 N--CA 1.451 -0.397 0 CA-C-O 121.567 0.698 . . . . 0.0 112.613 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 35.0 pt -133.19 170.74 19.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.94 179.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.483 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 11.2 m120 -97.29 138.57 34.55 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 178.091 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.495 HD23 HG12 ' A' ' 34' ' ' ILE . 3.2 mm? -130.14 138.26 50.56 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 174.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -126.25 142.4 51.54 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-O 121.175 0.512 . . . . 0.0 110.334 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.691 HG22 HG13 ' A' ' 84' ' ' ILE . 90.4 t -124.02 133.91 67.99 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.147 -177.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -111.46 129.13 56.13 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 121.211 0.529 . . . . 0.0 110.945 -177.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -100.47 167.28 20.05 Favored Glycine 0 N--CA 1.435 -1.397 0 C-N-CA 121.238 -0.505 . . . . 0.0 111.874 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.696 ' H ' ' NE2' ' A' ' 25' ' ' GLN . 0.2 OUTLIER -65.64 -30.19 70.86 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.44 0.638 . . . . 0.0 110.487 -177.075 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -73.67 -12.78 60.84 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.1 -178.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 102.3 0.61 50.69 Favored Glycine 0 C--O 1.227 -0.327 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.167 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.9 t -82.52 149.08 27.73 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 120.895 0.379 . . . . 0.0 110.202 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.554 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 47.5 t -142.7 135.28 26.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 -177.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.471 HG11 ' HD3' ' A' ' 50' ' ' ARG . 13.8 t -120.79 136.24 58.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -104.36 140.34 38.03 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.75 0.309 . . . . 0.0 110.266 178.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.404 ' O ' ' HA ' ' A' ' 19' ' ' ASN . 19.8 m-85 . . . . . 0 C--N 1.324 -0.506 0 CA-C-O 121.016 0.436 . . . . 0.0 111.215 -178.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.539 HD13 HD23 ' A' ' 43' ' ' LEU . 20.9 pt . . . . . 0 N--CA 1.467 0.412 0 CA-C-O 120.945 0.402 . . . . 0.0 111.013 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 23.8 mtpp -77.7 146.23 36.11 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.995 0.426 . . . . 0.0 110.632 178.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.414 ' HA ' ' HG2' ' A' ' 73' ' ' PRO . 1.4 ppt_? -71.8 -13.71 61.77 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.314 0.578 . . . . 0.0 111.025 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 32.0 t60 -98.91 -5.38 30.87 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.487 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.8 m -91.66 136.17 26.86 Favored Pre-proline 0 C--N 1.305 -1.341 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.321 -178.42 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.402 ' HB2' ' OG ' ' A' ' 41' ' ' SER . 19.4 Cg_endo -60.91 126.19 19.03 Favored 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 122.473 2.115 . . . . 0.0 111.83 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.569 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.2 pp -64.78 -16.55 63.19 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.777 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.54 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 4.0 p -51.8 -31.96 29.35 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 122.873 0.469 . . . . 0.0 111.679 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -61.67 -49.13 77.75 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.01 0.433 . . . . 0.0 110.342 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.6 pp -67.48 -35.08 78.46 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 121.053 0.454 . . . . 0.0 110.142 179.357 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 48.3 mtm -63.55 -49.3 73.98 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 121.087 0.47 . . . . 0.0 110.896 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.41 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 16.5 mtpp -67.54 -36.94 81.96 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.269 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.418 ' O ' ' HG2' ' A' ' 50' ' ' ARG . . . -62.03 -38.8 90.06 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.128 0.489 . . . . 0.0 109.851 178.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -58.74 -53.71 55.33 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.108 177.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 29.6 p -65.99 -36.51 83.48 Favored 'General case' 0 N--CA 1.453 -0.285 0 O-C-N 121.981 -0.449 . . . . 0.0 111.184 -177.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 45.2 mt-10 -66.11 -40.2 90.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.797 0.332 . . . . 0.0 111.547 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.471 ' HD3' HG11 ' A' ' 30' ' ' VAL . 13.9 ptm180 -80.29 -30.5 38.26 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.052 0.453 . . . . 0.0 111.117 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -83.97 -16.13 45.23 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -178.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 92.61 6.77 63.76 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 119.955 -1.117 . . . . 0.0 112.954 179.065 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -98.94 175.22 6.01 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.444 0.64 . . . . 0.0 111.197 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.432 ' HB2' ' OE1' ' A' ' 57' ' ' GLN . 68.7 m -126.06 159.89 31.58 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.652 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.6 mmt -66.43 -25.16 66.62 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.3 0.572 . . . . 0.0 111.428 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.46 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.32 -18.34 34.14 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.677 0.751 . . . . 0.0 110.285 176.448 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.432 ' OE1' ' HB2' ' A' ' 54' ' ' SER . 1.3 mp0 -89.2 -28.15 20.17 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.812 -179.399 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 11.2 pt -136.46 177.29 6.44 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 CA-C-O 121.354 0.597 . . . . 0.0 112.007 -177.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.463 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 15.9 mmt180 -151.9 143.43 23.5 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.65 178.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -99.01 144.73 27.82 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.71 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.612 ' HG2' ' N ' ' A' ' 62' ' ' PHE . 0.8 OUTLIER -142.14 151.0 41.84 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-O 121.224 0.535 . . . . 0.0 111.211 -177.521 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.612 ' N ' ' HG2' ' A' ' 61' ' ' ARG . 66.7 t80 -155.77 146.81 22.38 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 177.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 22.5 t70 56.72 23.88 8.39 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-O 121.795 0.807 . . . . 0.0 110.251 -177.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.38 -16.41 29.75 Favored Glycine 0 N--CA 1.431 -1.638 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.945 -178.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.487 HE21 HD23 ' A' ' 76' ' ' LEU . 12.7 pt20 -97.99 147.41 33.03 Favored Pre-proline 0 C--N 1.326 -0.44 0 O-C-N 122.414 -0.462 . . . . 0.0 110.716 -179.44 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.97 138.77 34.65 Favored 'Trans proline' 0 CA--C 1.533 0.465 0 C-N-CA 122.544 2.163 . . . . 0.0 112.091 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.455 HD11 ' HB2' ' A' ' 62' ' ' PHE . 31.6 mt -88.14 151.96 3.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 120.889 0.376 . . . . 0.0 110.285 -178.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -128.79 172.08 11.62 Favored 'General case' 0 CA--C 1.499 -1.003 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.54 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 7.1 pt-20 -78.77 -8.43 58.75 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 121.508 0.671 . . . . 0.0 110.064 177.197 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 23.5 p -93.29 -1.77 55.68 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.158 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -104.0 144.03 32.08 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.299 0.571 . . . . 0.0 112.277 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.533 ' OG1' ' HG2' ' A' ' 75' ' ' GLN . 0.6 OUTLIER -111.65 157.95 37.87 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.981 176.612 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.53 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 17.9 Cg_endo -58.59 -28.62 86.52 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.755 2.303 . . . . 0.0 112.16 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -78.87 -10.74 59.9 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.907 -178.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.533 ' HG2' ' OG1' ' A' ' 72' ' ' THR . 23.5 mm-40 -79.26 -38.88 34.42 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.1 0.476 . . . . 0.0 111.683 -178.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.563 ' H ' HD12 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -93.59 1.01 56.81 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 179.621 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 54.01 48.64 20.66 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.815 0.817 . . . . 0.0 110.705 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.53 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.4 ptm -82.42 152.96 25.93 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.283 -179.325 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.532 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 13.3 pt-20 -99.34 163.97 12.31 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.142 -177.274 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.483 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 7.3 p-10 -57.37 143.93 38.11 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 121.36 0.6 . . . . 0.0 110.737 173.481 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 68.07 20.98 8.9 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.821 -179.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.532 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 0.5 OUTLIER -69.56 155.39 40.56 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 120.414 -0.514 . . . . 0.0 109.976 179.218 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 24.4 m -102.1 119.93 39.61 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 -174.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.691 HG13 HG22 ' A' ' 22' ' ' VAL . 19.8 mm -90.5 136.53 23.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.292 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -100.67 118.59 37.11 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.064 0.459 . . . . 0.0 110.676 178.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.463 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 76.1 t -111.14 140.39 30.64 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.518 0 CA-C-O 121.051 0.453 . . . . 0.0 110.0 177.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.3 p90 -136.31 153.66 51.09 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -83.46 117.48 23.1 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 121.144 0.497 . . . . 0.0 110.714 -176.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.482 ' HA ' ' OE1' ' A' ' 89' ' ' GLN . 11.6 mm-40 . . . . . 0 C--N 1.316 -0.852 0 CA-C-O 121.437 0.637 . . . . 0.0 111.293 178.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 22.0 p-80 . . . . . 0 N--CA 1.455 -0.213 0 CA-C-O 121.081 0.467 . . . . 0.0 111.233 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.412 HG13 HD21 ' A' ' 20' ' ' LEU . 42.8 pt -136.87 170.65 17.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.443 -179.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.405 ' C ' HD22 ' A' ' 20' ' ' LEU . 23.2 t-20 -105.51 134.2 49.01 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.179 179.065 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.61 HD23 HG12 ' A' ' 34' ' ' ILE . 2.7 mm? -126.41 145.07 50.62 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 177.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -129.86 144.24 51.21 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-O 121.297 0.57 . . . . 0.0 110.402 -178.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.64 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 4.7 p -125.01 132.25 71.54 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.874 -176.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -122.33 138.74 54.41 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.18 0.514 . . . . 0.0 110.662 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -112.98 160.4 13.14 Favored Glycine 0 N--CA 1.437 -1.275 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -62.71 -19.13 63.6 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.677 0.751 . . . . 0.0 110.02 -179.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -81.27 11.01 4.66 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.871 -177.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 71.45 39.52 61.25 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 119.893 -1.146 . . . . 0.0 113.186 179.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.5 t -132.06 147.37 52.44 Favored 'General case' 0 C--N 1.31 -1.114 0 O-C-N 122.038 -0.683 . . . . 0.0 110.287 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.64 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.5 p -146.72 137.16 17.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.124 0.488 . . . . 0.0 111.523 -178.327 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 t -123.85 138.05 54.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 178.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -107.8 140.73 40.45 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.819 0.342 . . . . 0.0 110.939 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.528 ' HE1' HG12 ' A' ' 22' ' ' VAL . 19.4 m-85 . . . . . 0 N--CA 1.468 0.466 0 CA-C-O 121.125 0.488 . . . . 0.0 111.31 -177.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.61 HG12 HD23 ' A' ' 20' ' ' LEU . 21.2 pt . . . . . 0 C--O 1.217 -0.646 0 CA-C-O 120.815 0.341 . . . . 0.0 110.309 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 1.7 mtpm? -94.82 151.11 19.51 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-O 120.903 0.383 . . . . 0.0 110.269 -178.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.9 ptt180 -67.08 -23.95 65.91 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.043 0.449 . . . . 0.0 111.762 -177.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -103.13 3.15 35.54 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 122.341 1.067 . . . . 0.0 109.044 -176.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.478 ' OG1' ' HD3' ' A' ' 35' ' ' LYS . 1.8 m -95.87 138.26 21.73 Favored Pre-proline 0 N--CA 1.428 -1.57 0 CA-C-N 114.523 -1.217 . . . . 0.0 110.186 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.428 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 27.3 Cg_endo -58.46 122.37 11.56 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.777 2.318 . . . . 0.0 112.149 -178.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.533 HD11 HG21 ' A' ' 67' ' ' ILE . 1.0 OUTLIER -70.37 -16.17 62.94 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.328 0.585 . . . . 0.0 111.242 -179.318 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.485 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 4.2 p -50.68 -29.75 11.95 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.554 178.286 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.428 ' HE3' ' HG2' ' A' ' 39' ' ' PRO . 96.4 mttt -60.49 -47.93 83.99 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.21 0.528 . . . . 0.0 110.016 177.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.0 OUTLIER -69.6 -37.74 77.01 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.019 179.089 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 57.4 mtm -61.95 -46.78 87.81 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 120.941 0.401 . . . . 0.0 111.287 -179.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.407 ' HE2' ' HB3' ' A' ' 45' ' ' LYS . 30.7 mtpt -67.3 -38.1 84.43 Favored 'General case' 0 CA--C 1.511 -0.529 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.578 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.39 -34.66 77.16 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.174 0.512 . . . . 0.0 109.947 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -62.5 -56.54 17.13 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.771 177.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 25.8 p -65.42 -37.07 85.82 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 122.091 -0.38 . . . . 0.0 111.512 -176.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -70.72 -29.78 66.15 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -178.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 50' ' ' ARG . 10.2 ptm85 -89.77 -30.88 17.7 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 121.961 -0.462 . . . . 0.0 111.13 178.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -80.61 -22.53 40.53 Favored 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -178.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.68 40.07 6.07 Favored Glycine 0 N--CA 1.434 -1.483 0 C-N-CA 120.012 -1.089 . . . . 0.0 110.949 -177.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.417 HD13 ' HA ' ' A' ' 53' ' ' LEU . 3.5 mm? -126.21 166.27 17.39 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 178.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 72.0 m -119.54 153.31 35.58 Favored 'General case' 0 C--N 1.309 -1.169 0 O-C-N 122.188 -0.32 . . . . 0.0 110.66 178.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.3 mmt -61.52 -25.67 67.43 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.149 0.499 . . . . 0.0 112.08 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.2 -13.46 49.9 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.563 0.697 . . . . 0.0 110.409 176.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -94.3 -28.27 15.67 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.648 -0.706 . . . . 0.0 112.188 -177.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.475 HG22 ' NE2' ' A' ' 88' ' ' GLN . 13.0 pt -133.35 175.29 11.69 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 CA-C-O 121.206 0.527 . . . . 0.0 111.149 -177.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.425 ' HD3' ' HA ' ' A' ' 59' ' ' ARG . 14.9 mmt180 -149.95 144.32 25.79 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.803 178.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -102.37 141.54 35.04 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.009 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.461 ' HG2' ' O ' ' A' ' 65' ' ' GLN . 8.3 tmm_? -142.92 141.63 31.53 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.362 0.601 . . . . 0.0 111.381 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.472 ' HB2' HD11 ' A' ' 67' ' ' ILE . 85.9 t80 -144.56 147.49 33.25 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.492 178.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.5 t70 58.06 24.45 11.19 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-O 121.728 0.775 . . . . 0.0 110.34 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.401 ' HA2' ' HD3' ' A' ' 61' ' ' ARG . . . 76.55 6.66 84.78 Favored Glycine 0 N--CA 1.433 -1.514 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.93 -179.525 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.562 HE21 HD23 ' A' ' 76' ' ' LEU . 12.8 pt20 -122.01 147.05 47.93 Favored Pre-proline 0 CA--C 1.536 0.425 0 O-C-N 122.224 -0.574 . . . . 0.0 110.48 179.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -66.69 138.44 49.26 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 122.492 2.128 . . . . 0.0 112.223 -178.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.533 HG21 HD11 ' A' ' 40' ' ' LEU . 45.2 mt -91.54 146.47 6.22 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-O 120.952 0.406 . . . . 0.0 110.099 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.635 HD22 ' HB2' ' A' ' 71' ' ' ASP . 0.2 OUTLIER -114.42 165.9 12.25 Favored 'General case' 0 CA--C 1.492 -1.282 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.634 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.518 ' H ' ' CD ' ' A' ' 69' ' ' GLU . 0.4 OUTLIER -77.95 -19.81 53.89 Favored 'General case' 0 C--N 1.291 -1.97 0 CA-C-O 121.44 0.638 . . . . 0.0 109.693 178.659 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 36.2 p -92.38 4.04 54.22 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.893 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.635 ' HB2' HD22 ' A' ' 68' ' ' ASN . 20.8 t0 -98.96 159.82 14.69 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 121.899 -0.5 . . . . 0.0 110.568 -178.656 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -118.39 154.2 52.05 Favored Pre-proline 0 C--N 1.316 -0.864 0 O-C-N 122.24 -0.287 . . . . 0.0 111.664 177.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.17 -30.96 92.49 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.94 2.427 . . . . 0.0 112.276 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.17 -19.68 62.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.145 0.497 . . . . 0.0 111.129 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.43 ' NE2' ' HA ' ' A' ' 75' ' ' GLN . 4.0 tp60 -67.84 -37.57 82.05 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.645 0.736 . . . . 0.0 110.152 -179.149 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.562 HD23 HE21 ' A' ' 65' ' ' GLN . 0.5 OUTLIER -93.54 5.19 52.43 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.945 -178.725 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 43.31 40.97 2.81 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.615 1.166 . . . . 0.0 111.94 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 4.3 ptm -74.27 161.89 29.46 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.723 -178.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -110.2 164.14 12.93 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 116.325 -0.398 . . . . 0.0 109.964 -177.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -55.42 138.07 46.82 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.591 0.71 . . . . 0.0 111.999 176.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 77.95 24.92 0.68 Allowed 'General case' 0 CA--C 1.512 -0.518 0 C-N-CA 124.895 1.278 . . . . 0.0 111.835 177.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.469 ' OD1' HD12 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -61.62 154.07 26.1 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.303 176.523 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 30.8 m -110.44 108.89 19.06 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-O 121.411 0.624 . . . . 0.0 112.05 176.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.432 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 25.1 mm -80.49 137.8 20.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.175 177.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -101.35 124.33 46.86 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.144 0.497 . . . . 0.0 110.423 178.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.419 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 91.0 t -114.19 131.58 65.75 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.08 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.716 178.152 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.4 p90 -133.85 152.06 51.74 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 116.248 -0.433 . . . . 0.0 109.93 -175.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.475 ' NE2' HG22 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -76.91 112.12 13.18 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-O 121.358 0.599 . . . . 0.0 112.369 -176.414 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 78.2 mm-40 . . . . . 0 C--N 1.317 -0.811 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.572 177.142 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.575 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 55.4 p-80 . . . . . 0 N--CA 1.436 -1.127 0 CA-C-O 121.459 0.647 . . . . 0.0 111.485 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 39.7 pt -127.12 167.65 21.57 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.206 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.33 -178.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.504 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 23.7 t-20 -100.62 137.86 38.44 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.381 178.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.406 HD23 HG12 ' A' ' 34' ' ' ILE . 3.0 mm? -127.85 135.9 50.68 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 176.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -119.65 145.02 46.84 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-O 121.301 0.572 . . . . 0.0 110.12 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.635 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 6.7 p -123.66 134.35 66.66 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.937 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.955 -178.435 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -117.93 117.99 30.77 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-O 121.241 0.543 . . . . 0.0 110.081 -178.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.403 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -84.12 155.14 31.11 Favored Glycine 0 N--CA 1.426 -2.012 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.092 -179.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -15.31 9.31 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 178.014 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -93.48 -11.19 32.6 Favored 'General case' 0 C--N 1.319 -0.718 0 O-C-N 122.015 -0.428 . . . . 0.0 110.828 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.99 7.58 35.53 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.648 -0.786 . . . . 0.0 112.737 178.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 74.5 m -91.36 124.94 35.93 Favored 'General case' 0 C--N 1.313 -0.988 0 O-C-N 122.363 -0.493 . . . . 0.0 111.118 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.635 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.2 p -119.91 132.31 69.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 CA-C-O 121.292 0.568 . . . . 0.0 111.605 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.5 t -119.19 135.26 60.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.044 179.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -104.89 142.18 35.22 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.707 0.289 . . . . 0.0 110.696 179.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.5 ' HE1' HG12 ' A' ' 22' ' ' VAL . 16.2 m-85 . . . . . 0 N--CA 1.47 0.546 0 CA-C-O 121.179 0.514 . . . . 0.0 111.149 -178.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.406 HG12 HD23 ' A' ' 20' ' ' LEU . 24.7 pt . . . . . 0 CA--C 1.515 -0.391 0 CA-C-O 120.916 0.389 . . . . 0.0 110.347 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.575 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 44.6 mtpt -86.58 152.96 22.16 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-O 121.134 0.492 . . . . 0.0 110.887 179.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 28.1 ptt180 -64.49 -24.06 67.49 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.172 -0.467 . . . . 0.0 112.0 -178.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 55.7 t60 -104.22 -2.26 25.94 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 122.086 0.946 . . . . 0.0 108.817 -176.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.475 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.5 m -87.15 137.87 32.76 Favored Pre-proline 0 N--CA 1.427 -1.587 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.355 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -58.92 122.7 12.05 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.672 2.248 . . . . 0.0 112.469 -178.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.461 HD12 ' N ' ' A' ' 41' ' ' SER . 1.2 pp -68.0 -16.47 64.06 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.427 179.225 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.5 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 10.1 p -52.14 -30.31 25.95 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.247 0.619 . . . . 0.0 111.899 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -64.24 -42.66 96.42 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.675 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.469 ' C ' HD12 ' A' ' 43' ' ' LEU . 1.0 OUTLIER -70.83 -35.91 72.67 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.05 0.453 . . . . 0.0 110.233 178.519 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 44.0 mtm -63.32 -49.28 74.59 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.015 0.436 . . . . 0.0 110.765 -178.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.422 ' HD2' ' HE2' ' A' ' 55' ' ' MET . 12.4 mmmm -66.55 -37.71 85.56 Favored 'General case' 0 N--CA 1.441 -0.878 0 O-C-N 122.267 -0.271 . . . . 0.0 110.48 177.178 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.34 -43.41 88.26 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.378 0.608 . . . . 0.0 110.04 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.406 ' CD1' HG11 ' A' ' 22' ' ' VAL . 63.1 t80 -56.38 -55.08 37.96 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.619 177.575 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.659 ' SG ' HD11 ' A' ' 58' ' ' ILE . 33.2 m -63.08 -42.71 99.69 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.926 0.393 . . . . 0.0 111.174 -177.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.45 -35.95 81.56 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -177.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -84.98 -34.2 22.43 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.92 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -83.17 -13.57 55.21 Favored 'General case' 0 C--N 1.334 -0.096 0 N-CA-C 113.083 0.772 . . . . 0.0 113.083 -178.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.42 6.49 73.95 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.152 -1.023 . . . . 0.0 113.203 178.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -92.18 169.94 10.21 Favored 'General case' 0 C--N 1.32 -0.675 0 O-C-N 121.975 -0.721 . . . . 0.0 110.925 178.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 71.6 m -120.77 154.38 35.75 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.319 179.234 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.422 ' HE2' ' HD2' ' A' ' 45' ' ' LYS . 12.5 mmt -62.01 -28.19 69.4 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-O 121.375 0.607 . . . . 0.0 111.592 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.552 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.08 -14.85 45.91 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.438 0.637 . . . . 0.0 110.818 178.397 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -90.18 -31.64 16.97 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.586 -179.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.659 HD11 ' SG ' ' A' ' 48' ' ' CYS . 12.0 pt -128.84 175.95 9.16 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.151 0 CA-C-O 121.296 0.569 . . . . 0.0 111.678 -177.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.455 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 25.0 mmt180 -148.51 138.77 22.53 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.341 179.378 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 41.8 m-85 -96.71 139.6 32.54 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.308 179.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.444 ' HD2' ' HB2' ' A' ' 85' ' ' ASP . 0.2 OUTLIER -141.62 137.71 32.05 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-O 121.04 0.448 . . . . 0.0 111.063 -176.755 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.556 ' HB2' HD11 ' A' ' 67' ' ' ILE . 67.2 t80 -143.33 145.15 32.45 Favored 'General case' 0 C--O 1.214 -0.801 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 177.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 23.7 t70 54.02 23.75 4.24 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 121.895 0.855 . . . . 0.0 110.871 -177.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.437 ' HA2' ' NE ' ' A' ' 61' ' ' ARG . . . 85.08 -18.03 29.49 Favored Glycine 0 N--CA 1.434 -1.469 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.997 -178.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.489 HE21 HD23 ' A' ' 76' ' ' LEU . 12.4 pt20 -96.11 149.94 36.59 Favored Pre-proline 0 C--N 1.318 -0.765 0 O-C-N 122.532 -0.393 . . . . 0.0 111.071 -179.355 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.92 141.98 37.97 Favored 'Trans proline' 0 C--O 1.235 0.344 0 C-N-CA 122.53 2.153 . . . . 0.0 111.751 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.556 HD11 ' HB2' ' A' ' 62' ' ' PHE . 23.9 mt -94.53 148.15 5.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 120.979 0.419 . . . . 0.0 110.19 -179.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -129.24 166.72 18.86 Favored 'General case' 0 CA--C 1.498 -1.042 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.5 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 12.6 pt-20 -75.16 -12.48 60.31 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 121.341 0.591 . . . . 0.0 110.479 178.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.8 t -91.71 -1.33 57.45 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 121.221 0.534 . . . . 0.0 111.171 -178.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -103.93 147.12 27.72 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 120.9 0.381 . . . . 0.0 111.022 177.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.56 153.72 42.73 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.46 179.533 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -60.7 -31.27 91.81 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.701 2.268 . . . . 0.0 112.551 -177.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.83 -20.78 62.52 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.79 -179.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -67.21 -37.22 83.27 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.153 0.502 . . . . 0.0 111.127 -178.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.489 HD23 HE21 ' A' ' 65' ' ' GLN . 0.6 OUTLIER -94.51 11.24 31.54 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.564 -178.023 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 43.73 36.97 1.41 Allowed 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 124.147 0.979 . . . . 0.0 112.202 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.8 ptm -73.53 158.47 34.8 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.901 -178.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -109.33 165.43 11.63 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 120.916 0.389 . . . . 0.0 110.534 -178.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.504 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 10.3 p-10 -61.55 142.73 56.9 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.339 0.59 . . . . 0.0 111.196 175.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 72.83 17.33 4.36 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 124.42 1.088 . . . . 0.0 111.721 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -75.48 161.54 29.11 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 176.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 6.7 m -109.95 131.86 54.68 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -174.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 45.9 mm -97.62 134.01 37.33 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 175.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.444 ' HB2' ' HD2' ' A' ' 61' ' ' ARG . 43.3 m-20 -97.39 124.65 41.64 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-O 121.07 0.462 . . . . 0.0 110.967 179.474 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.455 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 87.3 t -115.61 139.09 43.78 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 CA-C-O 120.99 0.424 . . . . 0.0 110.329 177.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 9.7 p90 -134.9 155.87 49.94 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -88.63 116.38 26.84 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.541 0.686 . . . . 0.0 111.48 -175.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 75.0 mm-40 . . . . . 0 C--N 1.315 -0.896 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.524 178.082 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 5.9 p-80 . . . . . 0 N--CA 1.453 -0.283 0 CA-C-O 121.403 0.62 . . . . 0.0 111.409 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 29.2 pt -128.96 171.12 17.36 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.128 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.028 178.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -107.27 133.91 51.13 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 178.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -124.35 135.35 53.26 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 177.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.46 ' HG2' ' HG3' ' A' ' 31' ' ' GLN . 49.8 mtmt -121.95 144.42 48.88 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 121.155 0.503 . . . . 0.0 110.099 -179.279 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.622 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 2.5 p -121.62 127.45 75.58 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.527 -177.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -117.44 126.69 53.05 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.294 0.568 . . . . 0.0 110.09 -178.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -104.13 152.95 17.71 Favored Glycine 0 N--CA 1.429 -1.812 0 C-N-CA 120.439 -0.886 . . . . 0.0 111.548 -179.303 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.05 -16.2 1.03 Allowed 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 177.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -70.26 -22.8 62.84 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.507 0.67 . . . . 0.0 110.51 177.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 102.56 9.66 40.29 Favored Glycine 0 N--CA 1.448 -0.501 0 N-CA-C 111.338 -0.705 . . . . 0.0 111.338 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 39.9 t -101.89 157.15 17.06 Favored 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 122.492 0.317 . . . . 0.0 110.224 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.622 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 3.7 p -149.51 140.59 16.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.0 0.428 . . . . 0.0 110.616 -179.197 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.9 t -125.18 139.71 50.37 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.46 ' HG3' ' HG2' ' A' ' 21' ' ' LYS . 0.4 OUTLIER -108.63 144.55 36.22 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.951 0.405 . . . . 0.0 111.049 -179.46 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.549 ' HE1' HG12 ' A' ' 22' ' ' VAL . 14.1 m-85 . . . . . 0 N--CA 1.469 0.496 0 CA-C-O 121.171 0.51 . . . . 0.0 111.142 -178.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 37.8 pt . . . . . 0 CA--C 1.517 -0.313 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 3.9 mppt? -77.99 151.88 33.38 Favored 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.187 177.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.1 ptt180 -68.06 -14.37 62.92 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 121.378 0.609 . . . . 0.0 110.9 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 76.4 t60 -107.34 -1.62 21.44 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 122.289 1.042 . . . . 0.0 108.645 -178.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.53 ' OG1' ' HE2' ' A' ' 35' ' ' LYS . 1.3 m -86.63 139.34 33.41 Favored Pre-proline 0 N--CA 1.432 -1.362 0 CA-C-N 114.548 -1.205 . . . . 0.0 109.73 178.702 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -59.99 119.31 6.44 Favored 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 122.356 2.038 . . . . 0.0 112.397 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.599 HD11 HG21 ' A' ' 67' ' ' ILE . 1.7 pt? -67.82 -16.74 64.25 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.515 0.674 . . . . 0.0 110.58 179.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 14.4 p -52.25 -28.83 20.22 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.223 177.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.2 mtpt -62.25 -46.96 86.47 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 121.101 0.477 . . . . 0.0 109.739 178.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.8 pp -72.88 -37.52 67.28 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 120.881 0.372 . . . . 0.0 110.265 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 62.7 mtm -61.49 -43.78 98.25 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 120.922 0.391 . . . . 0.0 111.363 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.523 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 43.3 mttp -69.53 -37.63 77.2 Favored 'General case' 0 CA--C 1.514 -0.422 0 O-C-N 122.071 -0.393 . . . . 0.0 110.751 177.607 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.93 -35.49 80.85 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.146 0.498 . . . . 0.0 109.824 -179.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.412 ' CZ ' ' HG3' ' A' ' 51' ' ' GLN . 69.3 t80 -61.73 -54.74 38.48 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.602 178.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.629 ' SG ' HD11 ' A' ' 58' ' ' ILE . 19.5 m -58.77 -39.18 80.26 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.054 0.454 . . . . 0.0 110.447 -179.115 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.523 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 67.2 mt-10 -62.09 -49.33 76.38 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.115 0.483 . . . . 0.0 111.729 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -74.89 -36.63 62.24 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.087 0.402 . . . . 0.0 112.087 -176.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.412 ' HG3' ' CZ ' ' A' ' 47' ' ' TYR . 26.7 mm-40 -78.09 -21.19 50.86 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -178.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.405 ' C ' HD22 ' A' ' 53' ' ' LEU . . . 86.46 41.65 6.83 Favored Glycine 0 N--CA 1.431 -1.686 0 C-N-CA 119.905 -1.14 . . . . 0.0 111.271 -178.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.405 HD22 ' C ' ' A' ' 52' ' ' GLY . 3.6 mm? -127.64 170.38 12.74 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.47 ' HB2' ' OE1' ' A' ' 57' ' ' GLN . 50.0 m -124.71 157.56 35.36 Favored 'General case' 0 C--N 1.311 -1.088 0 O-C-N 122.303 -0.248 . . . . 0.0 110.491 177.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 12.1 mmt -60.73 -28.91 69.04 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-O 121.327 0.584 . . . . 0.0 111.784 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.554 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.36 -16.07 41.12 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.401 0.62 . . . . 0.0 110.634 178.694 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.47 ' OE1' ' HB2' ' A' ' 54' ' ' SER . 1.3 mp0 -90.82 -25.13 20.07 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.782 -177.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.629 HD11 ' SG ' ' A' ' 48' ' ' CYS . 12.7 pt -135.27 177.94 6.02 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.069 0 CA-C-O 120.933 0.397 . . . . 0.0 110.761 -178.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.433 ' CG ' ' HG3' ' A' ' 89' ' ' GLN . 15.0 mmt180 -150.54 139.61 21.08 Favored 'General case' 0 CA--C 1.501 -0.924 0 CA-C-O 121.341 0.591 . . . . 0.0 111.081 178.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -97.91 141.23 31.14 Favored 'General case' 0 N--CA 1.438 -1.033 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.685 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.446 ' HG2' ' N ' ' A' ' 62' ' ' PHE . 8.4 tmm_? -143.48 145.58 32.71 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 121.247 0.546 . . . . 0.0 110.94 -179.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.525 ' HB2' HD11 ' A' ' 67' ' ' ILE . 86.1 t80 -151.13 148.74 28.65 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.657 179.029 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 19.5 t70 58.4 22.08 9.09 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.753 0.787 . . . . 0.0 110.123 -178.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.0 4.44 88.73 Favored Glycine 0 N--CA 1.43 -1.765 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.662 -178.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -121.39 143.58 37.98 Favored Pre-proline 0 N--CA 1.444 -0.738 0 O-C-N 122.071 -0.664 . . . . 0.0 110.11 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -61.71 141.1 89.56 Favored 'Trans proline' 0 C--N 1.329 -0.457 0 C-N-CA 122.848 2.366 . . . . 0.0 112.091 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.599 HG21 HD11 ' A' ' 40' ' ' LEU . 41.2 mt -96.78 146.84 6.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 120.859 0.362 . . . . 0.0 110.146 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -114.5 163.01 15.96 Favored 'General case' 0 CA--C 1.5 -0.959 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 176.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -79.04 -11.22 59.99 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 120.106 -0.638 . . . . 0.0 110.597 179.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 35.0 p -84.76 -11.99 54.64 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.72 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.56 165.74 16.82 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -178.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -121.54 153.37 59.25 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.217 173.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.417 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 12.2 Cg_endo -57.38 -30.2 87.03 Favored 'Trans proline' 0 C--O 1.236 0.424 0 C-N-CA 122.779 2.319 . . . . 0.0 112.137 -179.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.27 -20.73 62.19 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.163 0.506 . . . . 0.0 111.64 -179.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -69.16 -39.1 78.99 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.318 0.58 . . . . 0.0 110.863 179.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.457 ' H ' HD12 ' A' ' 76' ' ' LEU . 1.1 mp -86.92 2.86 47.89 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.143 -178.283 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 57.02 31.08 19.28 Favored 'General case' 0 C--N 1.349 0.567 0 CA-C-O 121.51 0.671 . . . . 0.0 111.193 178.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.546 ' HE1' HD11 ' A' ' 84' ' ' ILE . 6.8 ptm -79.06 164.73 24.09 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.769 -178.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -121.89 172.69 8.0 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.578 -176.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -63.06 145.31 55.73 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-O 121.528 0.68 . . . . 0.0 111.835 177.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 71.16 16.33 6.3 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 114.57 -1.196 . . . . 0.0 111.492 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.4 ' OD1' ' CE1' ' A' ' 62' ' ' PHE . 11.2 t70 -70.79 153.95 42.29 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.156 175.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 19.7 m -112.99 134.99 54.25 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-O 121.454 0.645 . . . . 0.0 112.367 -177.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.546 HD11 ' HE1' ' A' ' 78' ' ' MET . 39.2 mm -98.48 145.28 10.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 123.372 0.669 . . . . 0.0 110.089 -179.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -100.27 117.04 33.65 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 122.316 0.246 . . . . 0.0 110.852 179.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 86.4 t -115.37 136.02 53.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-O 121.298 0.57 . . . . 0.0 111.285 177.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -134.05 153.18 51.97 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.061 -178.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -79.47 115.33 19.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.312 0.577 . . . . 0.0 111.623 -178.273 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.433 ' HG3' ' CG ' ' A' ' 59' ' ' ARG . 51.8 mm-40 . . . . . 0 C--N 1.314 -0.967 0 CA-C-O 121.485 0.659 . . . . 0.0 110.716 177.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.403 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 33.2 p-80 . . . . . 0 N--CA 1.444 -0.726 0 CA-C-O 121.13 0.491 . . . . 0.0 111.54 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 31.0 pt -130.29 170.85 18.54 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.908 -177.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -105.21 136.23 45.09 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -128.21 136.6 51.31 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 121.01 0.433 . . . . 0.0 109.879 178.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.462 ' O ' ' HA ' ' A' ' 83' ' ' THR . 52.2 mtmt -120.29 146.46 46.07 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.016 0.436 . . . . 0.0 109.911 179.666 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.616 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 3.8 p -124.56 132.6 71.1 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.615 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.832 -178.28 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -119.26 127.67 53.46 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 121.234 0.54 . . . . 0.0 110.36 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -103.0 147.39 16.89 Favored Glycine 0 N--CA 1.433 -1.556 0 C-N-CA 121.019 -0.61 . . . . 0.0 111.943 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.521 ' HG3' ' HA ' ' A' ' 87' ' ' PHE . 0.0 OUTLIER -51.93 -24.49 6.49 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 177.89 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -75.04 -18.17 60.37 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.218 0.532 . . . . 0.0 110.734 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 106.01 27.4 5.67 Favored Glycine 0 CA--C 1.499 -0.965 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.088 175.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.419 ' HB3' ' OE1' ' A' ' 51' ' ' GLN . 71.0 m -111.29 147.63 34.67 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 120.656 0.265 . . . . 0.0 110.491 179.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.616 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.4 p -145.81 132.33 14.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.188 0.518 . . . . 0.0 111.667 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 t -124.15 139.66 49.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -108.03 142.4 38.26 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.816 0.341 . . . . 0.0 110.771 179.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.513 ' HE1' HG12 ' A' ' 22' ' ' VAL . 20.8 m-85 . . . . . 0 N--CA 1.468 0.449 0 CA-C-O 121.37 0.605 . . . . 0.0 111.797 -177.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.403 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 29.1 pt . . . . . 0 CA--C 1.517 -0.325 0 CA-C-O 121.014 0.435 . . . . 0.0 111.063 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.403 ' HB2' ' HB ' ' A' ' 38' ' ' THR . 36.0 mtmm -74.72 147.15 41.64 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 178.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.9 ptt180 -71.24 -13.16 61.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.682 0.753 . . . . 0.0 110.243 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 -100.52 -5.64 26.64 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -178.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.403 ' HB ' ' HB2' ' A' ' 35' ' ' LYS . 1.0 OUTLIER -94.8 141.89 23.95 Favored Pre-proline 0 N--CA 1.445 -0.719 0 CA-C-N 114.763 -1.108 . . . . 0.0 109.73 179.758 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -63.09 128.92 24.14 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.257 1.971 . . . . 0.0 112.375 -179.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.533 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.1 pt? -69.26 -17.29 63.74 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.692 0.758 . . . . 0.0 110.446 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.416 ' N ' HD23 ' A' ' 40' ' ' LEU . 0.9 OUTLIER -51.73 -28.96 16.72 Favored 'General case' 0 C--N 1.31 -1.111 0 C-N-CA 124.43 1.092 . . . . 0.0 111.204 178.57 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 51.5 mtpt -63.38 -43.14 98.47 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.897 179.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.3 pp -73.04 -38.64 66.43 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 120.938 0.399 . . . . 0.0 109.985 178.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 59.7 mtm -60.74 -49.41 77.59 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 121.049 0.452 . . . . 0.0 111.108 -179.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.439 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 47.7 mtpt -68.67 -35.36 77.12 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.821 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.488 ' O ' ' HG2' ' A' ' 50' ' ' ARG . . . -63.86 -38.03 89.58 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.055 0.455 . . . . 0.0 110.004 178.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -57.02 -56.34 22.98 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.849 178.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.49 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 26.1 p -63.46 -37.62 87.99 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.869 0.366 . . . . 0.0 111.45 -177.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.439 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 44.8 mt-10 -67.61 -36.45 80.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.788 0.328 . . . . 0.0 111.732 -179.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.54 ' HG3' HE21 ' A' ' 51' ' ' GLN . 14.2 ptm180 -85.23 -37.39 20.14 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 121.96 -0.462 . . . . 0.0 111.695 -179.382 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.54 HE21 ' HG3' ' A' ' 50' ' ' ARG . 21.5 mm-40 -77.67 -21.88 51.44 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -176.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 92.45 37.14 5.96 Favored Glycine 0 N--CA 1.439 -1.165 0 C-N-CA 120.281 -0.962 . . . . 0.0 111.173 -178.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.49 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 4.0 mm? -122.25 162.99 20.42 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -179.641 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.428 ' HB2' ' HB2' ' A' ' 57' ' ' GLN . 16.6 m -116.72 152.83 33.49 Favored 'General case' 0 C--N 1.312 -1.036 0 O-C-N 122.017 -0.427 . . . . 0.0 110.556 178.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 11.9 mmt -63.73 -25.9 68.41 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.542 0.687 . . . . 0.0 111.283 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.613 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.56 -16.79 38.25 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.325 0.583 . . . . 0.0 110.735 177.133 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.601 ' NE2' ' HG2' ' A' ' 56' ' ' ARG . 2.7 mp0 -93.31 -27.04 17.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.8 -179.357 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.6 pt -129.86 -179.12 2.92 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-O 121.062 0.458 . . . . 0.0 111.266 -179.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.452 ' HA ' ' HD3' ' A' ' 59' ' ' ARG . 8.3 mmt180 -158.17 143.29 16.57 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.851 177.609 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -100.74 145.55 28.35 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.621 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.2 ttt180 -142.48 148.08 37.11 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 120.884 0.373 . . . . 0.0 110.547 -178.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.524 ' HB2' HD11 ' A' ' 67' ' ' ILE . 73.8 t80 -152.72 143.69 23.01 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 178.292 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.0 t70 54.92 23.91 5.42 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.509 0.724 . . . . 0.0 111.244 -178.162 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.92 -23.34 20.91 Favored Glycine 0 N--CA 1.435 -1.427 0 C-N-CA 120.906 -0.664 . . . . 0.0 112.679 -178.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.504 HE21 HD23 ' A' ' 76' ' ' LEU . 9.7 pt20 -94.18 150.4 38.3 Favored Pre-proline 0 C--N 1.315 -0.912 0 O-C-N 122.516 -0.402 . . . . 0.0 110.954 -178.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -72.47 143.32 38.36 Favored 'Trans proline' 0 N--CA 1.462 -0.326 0 C-N-CA 122.434 2.089 . . . . 0.0 111.575 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.524 HD11 ' HB2' ' A' ' 62' ' ' PHE . 38.4 mt -93.31 143.08 12.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-O 120.977 0.417 . . . . 0.0 110.296 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -114.07 157.5 22.47 Favored 'General case' 0 CA--C 1.499 -0.985 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 178.037 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -74.11 -12.04 60.48 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-O 121.24 0.543 . . . . 0.0 110.445 178.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.6 p -95.11 6.28 49.5 Favored 'General case' 0 N--CA 1.438 -1.033 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 178.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -100.13 162.12 13.17 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.974 0.416 . . . . 0.0 111.238 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -116.18 155.34 48.31 Favored Pre-proline 0 C--N 1.318 -0.765 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.149 176.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -61.12 -34.6 89.27 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.715 2.277 . . . . 0.0 111.779 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.72 -10.94 60.0 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.288 -179.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -77.05 -40.74 45.19 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 121.351 0.596 . . . . 0.0 109.758 179.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.504 HD23 HE21 ' A' ' 65' ' ' GLN . 0.3 OUTLIER -85.47 12.22 8.9 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.197 -179.604 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 43.61 43.69 4.86 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.293 1.037 . . . . 0.0 112.134 178.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.2 ptm -86.81 164.89 16.4 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.461 -178.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -117.68 167.82 11.0 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.86 0.362 . . . . 0.0 110.399 -178.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -60.96 142.74 56.23 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.639 0.733 . . . . 0.0 112.171 177.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 73.82 16.51 3.74 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 124.856 1.263 . . . . 0.0 111.506 178.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -77.47 162.09 27.44 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 177.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . 0.462 ' HA ' ' O ' ' A' ' 21' ' ' LYS . 37.1 m -116.34 139.01 50.86 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 121.661 0.743 . . . . 0.0 112.953 -175.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 44.6 mm -98.48 143.02 13.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.538 178.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -102.39 122.08 43.58 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.847 0.356 . . . . 0.0 110.702 178.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.473 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 76.7 t -115.0 137.86 47.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.717 0 CA-C-O 121.17 0.51 . . . . 0.0 110.932 178.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . 0.521 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 5.3 p90 -136.26 153.04 51.31 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.458 -179.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -80.98 113.56 19.27 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.354 0.597 . . . . 0.0 111.479 -177.189 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 75.9 mm-40 . . . . . 0 C--N 1.314 -0.973 0 CA-C-O 121.359 0.599 . . . . 0.0 110.083 176.974 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 15.9 p-80 . . . . . 0 N--CA 1.454 -0.24 0 CA-C-O 120.96 0.409 . . . . 0.0 110.922 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 44.3 pt -129.54 166.95 25.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 121.435 0.636 . . . . 0.0 111.656 -175.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.498 ' HA ' ' O ' ' A' ' 32' ' ' PHE . 16.5 t-20 -97.29 139.94 32.51 Favored 'General case' 0 CA--C 1.506 -0.712 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.872 178.601 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.402 HD13 ' O ' ' A' ' 19' ' ' ASN . 3.0 mm? -130.93 139.98 50.13 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 176.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 47.3 mtmt -125.38 145.28 50.12 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-O 121.07 0.462 . . . . 0.0 110.515 -179.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.662 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 2.5 p -126.23 131.79 71.17 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.638 -178.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -112.57 131.71 55.48 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-O 121.195 0.522 . . . . 0.0 110.884 -178.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -96.94 176.44 31.97 Favored Glycine 0 N--CA 1.438 -1.178 0 CA-C-N 116.24 -0.437 . . . . 0.0 112.483 -179.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.588 ' H ' ' NE2' ' A' ' 25' ' ' GLN . 0.3 OUTLIER -69.39 -24.58 63.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.738 0.78 . . . . 0.0 110.739 -177.894 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -83.93 -4.76 58.95 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.86 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.53 3.57 64.61 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.515 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.5 t -77.58 156.02 31.14 Favored 'General case' 0 C--N 1.322 -0.63 0 O-C-N 122.357 -0.496 . . . . 0.0 109.692 178.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.662 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.5 p -149.3 136.61 13.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-O 121.01 0.433 . . . . 0.0 110.587 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.5 t -119.89 136.57 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.72 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 179.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -108.32 143.42 37.22 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.016 0.436 . . . . 0.0 110.785 -179.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.517 ' HE1' HG12 ' A' ' 22' ' ' VAL . 11.4 m-85 . . . . . 0 N--CA 1.467 0.424 0 CA-C-O 121.085 0.469 . . . . 0.0 110.952 -178.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 31.9 pt . . . . . 0 CA--C 1.518 -0.254 0 CA-C-O 120.853 0.359 . . . . 0.0 110.468 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 32.0 mtmm -75.27 146.85 40.73 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 120.833 0.349 . . . . 0.0 110.604 178.221 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.434 ' HA ' ' HG2' ' A' ' 73' ' ' PRO . 5.7 ppt_? -71.39 -11.1 60.72 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.435 0.636 . . . . 0.0 110.891 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -101.94 -4.07 26.76 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.441 ' HB ' ' O ' ' A' ' 35' ' ' LYS . 1.3 m -92.36 137.33 24.72 Favored Pre-proline 0 N--CA 1.44 -0.94 0 CA-C-N 114.441 -1.254 . . . . 0.0 109.918 178.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -60.45 130.61 34.44 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.599 2.2 . . . . 0.0 112.443 -179.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.469 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.2 pp -70.18 -17.34 63.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.154 -0.475 . . . . 0.0 112.011 -179.215 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.468 ' N ' HD12 ' A' ' 40' ' ' LEU . 3.8 p -53.49 -28.58 31.64 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.94 -179.645 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 29.5 mtpp -59.6 -47.38 85.79 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.281 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.8 pp -73.75 -36.28 65.11 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.797 -179.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 39.8 mtm -63.03 -49.41 74.7 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 121.068 0.461 . . . . 0.0 111.02 -178.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.446 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 42.9 mtpt -69.53 -33.32 72.62 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.919 0.39 . . . . 0.0 110.604 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.0 -36.53 84.29 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.302 0.572 . . . . 0.0 109.659 177.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -59.23 -54.31 48.34 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.762 177.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 24.2 p -65.18 -35.2 80.34 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 122.15 -0.344 . . . . 0.0 111.211 -177.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 45.0 mt-10 -65.49 -42.1 92.54 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 120.762 0.315 . . . . 0.0 111.359 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -80.08 -33.28 38.99 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 120.969 0.414 . . . . 0.0 111.723 -178.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.42 ' HB3' HD23 ' A' ' 53' ' ' LEU . 24.9 mm-40 -81.84 -22.13 37.19 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -177.141 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.43 ' C ' HD22 ' A' ' 53' ' ' LEU . . . 88.42 39.57 6.73 Favored Glycine 0 N--CA 1.437 -1.239 0 C-N-CA 119.858 -1.163 . . . . 0.0 111.113 -177.339 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.496 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 4.0 mm? -125.73 168.05 14.31 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.04 0.448 . . . . 0.0 110.104 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.5 m -125.26 158.65 33.6 Favored 'General case' 0 C--N 1.312 -1.025 0 O-C-N 122.142 -0.349 . . . . 0.0 110.72 177.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 18.2 mmt -64.99 -25.29 67.8 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-O 121.367 0.603 . . . . 0.0 111.69 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.442 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.97 -14.74 43.71 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.525 0.679 . . . . 0.0 110.819 176.379 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -94.33 -26.62 16.49 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.087 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.7 pt -132.46 179.02 4.79 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-O 121.071 0.462 . . . . 0.0 110.942 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.41 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 3.8 mmt85 -153.81 140.54 19.02 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.602 178.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -99.59 139.85 34.64 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.333 -179.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.11 136.08 24.73 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.249 0.547 . . . . 0.0 110.607 -177.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.584 ' HB2' HD11 ' A' ' 67' ' ' ILE . 85.7 t80 -141.29 146.86 37.31 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.001 -179.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 52.0 25.79 3.36 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.576 0.75 . . . . 0.0 111.82 -179.077 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.8 -11.67 68.1 Favored Glycine 0 N--CA 1.44 -1.098 0 C-N-CA 120.836 -0.697 . . . . 0.0 113.542 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.522 HE21 HD23 ' A' ' 76' ' ' LEU . 10.8 pt20 -109.01 150.37 40.85 Favored Pre-proline 0 C--N 1.319 -0.733 0 O-C-N 122.118 -0.636 . . . . 0.0 111.075 -179.358 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -71.98 139.81 33.68 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 122.613 2.208 . . . . 0.0 111.724 179.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.584 HD11 ' HB2' ' A' ' 62' ' ' PHE . 21.0 mt -94.75 146.92 6.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-O 120.94 0.4 . . . . 0.0 110.325 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -117.36 162.34 18.08 Favored 'General case' 0 CA--C 1.497 -1.072 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 176.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.456 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 10.0 pt-20 -70.7 -16.16 62.77 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-O 121.473 0.654 . . . . 0.0 110.489 178.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 17.3 p -86.6 -13.93 44.29 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -177.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.06 160.42 19.3 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 121.508 0.67 . . . . 0.0 112.518 -177.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -113.16 154.99 45.03 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.644 178.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.434 ' HG2' ' HA ' ' A' ' 36' ' ' ARG . 19.2 Cg_endo -59.37 -29.57 90.52 Favored 'Trans proline' 0 CA--C 1.531 0.359 0 C-N-CA 123.005 2.47 . . . . 0.0 111.785 178.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -75.78 -19.04 59.29 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.202 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -68.6 -42.64 77.88 Favored 'General case' 0 CA--C 1.51 -0.588 0 CA-C-O 121.726 0.774 . . . . 0.0 109.831 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.522 HD23 HE21 ' A' ' 65' ' ' GLN . 0.4 OUTLIER -85.31 6.84 24.55 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.594 -179.792 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 43.39 43.22 4.2 Favored 'General case' 0 C--N 1.359 1.018 0 C-N-CA 124.381 1.073 . . . . 0.0 111.995 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.4 ptm -83.38 169.64 15.38 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.677 -178.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 12.5 pt-20 -117.2 168.3 10.43 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 110.097 -0.335 . . . . 0.0 110.097 -179.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -58.95 142.86 49.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.52 0.676 . . . . 0.0 111.842 175.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 73.62 16.02 3.97 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 124.674 1.189 . . . . 0.0 111.902 179.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.453 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 1.5 t0 -73.63 155.5 38.97 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.211 -0.596 . . . . 0.0 109.631 178.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 34.7 m -111.58 136.87 50.18 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.636 0.732 . . . . 0.0 112.746 -174.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 43.1 mm -99.52 138.61 23.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.765 178.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -98.22 120.44 38.63 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.817 0.342 . . . . 0.0 110.324 178.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.41 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 96.7 t -113.04 138.73 41.46 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.081 0 CA-C-O 121.064 0.459 . . . . 0.0 109.899 177.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 14.8 p90 -137.28 153.27 50.36 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.016 -179.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -80.03 116.6 20.25 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.364 0.602 . . . . 0.0 112.039 -176.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 71.1 mm-40 . . . . . 0 C--N 1.323 -0.558 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.63 176.675 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.507 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 56.6 p-80 . . . . . 0 N--CA 1.445 -0.723 0 CA-C-O 120.966 0.413 . . . . 0.0 110.635 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 40.3 pt -131.19 169.39 21.79 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.078 0 CA-C-O 121.364 0.602 . . . . 0.0 110.885 -178.017 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -103.49 139.73 38.45 Favored 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 177.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.405 HD23 HG12 ' A' ' 34' ' ' ILE . 3.2 mm? -126.75 136.97 53.13 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 177.488 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.48 ' HG2' ' HG3' ' A' ' 31' ' ' GLN . 52.1 mtmt -124.12 139.08 54.28 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.269 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.733 HG22 HG13 ' A' ' 84' ' ' ILE . 61.0 t -124.65 130.58 73.4 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.387 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -175.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -115.56 135.82 53.7 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 -178.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -121.46 162.0 15.35 Favored Glycine 0 N--CA 1.445 -0.763 0 C-N-CA 120.449 -0.881 . . . . 0.0 112.871 -178.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.594 ' HG2' ' HA ' ' A' ' 87' ' ' PHE . 22.8 mm-40 -66.17 -11.73 51.3 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.503 0.668 . . . . 0.0 110.397 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -78.23 6.82 7.35 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.431 179.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 72.82 36.36 57.83 Favored Glycine 0 C--N 1.338 0.658 0 C-N-CA 120.696 -0.764 . . . . 0.0 113.405 178.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.4 t -143.24 160.92 39.57 Favored 'General case' 0 C--N 1.314 -0.948 0 O-C-N 122.14 -0.623 . . . . 0.0 111.35 -179.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.554 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.8 p -149.32 139.12 16.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.39 -179.027 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.516 HG11 ' HD3' ' A' ' 50' ' ' ARG . 7.9 t -124.31 142.46 41.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 O-C-N 122.119 -0.363 . . . . 0.0 110.43 -179.483 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.48 ' HG3' ' HG2' ' A' ' 21' ' ' LYS . 0.7 OUTLIER -107.98 141.15 40.07 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 120.916 0.389 . . . . 0.0 110.997 179.092 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 . . . . . 0 N--CA 1.47 0.556 0 CA-C-O 120.921 0.391 . . . . 0.0 111.111 -178.283 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.405 HG12 HD23 ' A' ' 20' ' ' LEU . 30.2 pt . . . . . 0 CA--C 1.514 -0.425 0 CA-C-O 121.086 0.469 . . . . 0.0 110.263 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.507 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 36.9 mtmm -75.73 139.57 41.95 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 177.237 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.426 ' HA ' ' HG2' ' A' ' 73' ' ' PRO . 8.1 ppt_? -69.32 -11.99 61.29 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.448 0.642 . . . . 0.0 110.608 179.383 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 15.2 t-160 -99.23 2.53 45.75 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 122.181 0.991 . . . . 0.0 108.503 179.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.429 ' HB ' ' HB2' ' A' ' 35' ' ' LYS . 0.9 OUTLIER -103.4 143.29 26.32 Favored Pre-proline 0 N--CA 1.447 -0.599 0 CA-C-N 114.805 -1.089 . . . . 0.0 109.831 178.635 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -60.83 130.08 31.59 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 122.691 2.26 . . . . 0.0 112.493 -179.159 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.557 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.3 pp -70.34 -16.25 62.96 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.09 -0.504 . . . . 0.0 112.014 -179.41 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.459 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 0.1 OUTLIER -51.45 -29.6 16.79 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 122.955 0.502 . . . . 0.0 111.847 179.994 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -61.09 -47.85 84.41 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.222 0.534 . . . . 0.0 110.317 179.028 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.4 pp -73.5 -32.31 64.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.821 -178.724 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 46.7 mtm -62.76 -50.28 71.67 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.006 0.432 . . . . 0.0 111.018 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.45 ' HA ' ' SG ' ' A' ' 48' ' ' CYS . 81.0 mttt -66.97 -33.95 76.7 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.104 178.484 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.72 -35.88 82.47 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.169 0.509 . . . . 0.0 109.936 179.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -62.61 -56.63 16.07 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.544 178.17 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.509 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 26.3 p -62.1 -36.25 81.16 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.728 0.299 . . . . 0.0 111.649 -177.326 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -64.23 -44.32 92.22 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 120.905 0.383 . . . . 0.0 111.605 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.516 ' HD3' HG11 ' A' ' 30' ' ' VAL . 14.0 ptm180 -80.57 -32.01 36.68 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.047 0.451 . . . . 0.0 111.464 -177.526 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -80.91 -23.32 39.03 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.114 0.483 . . . . 0.0 112.006 -178.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.59 36.07 8.18 Favored Glycine 0 C--N 1.306 -1.084 0 C-N-CA 120.321 -0.943 . . . . 0.0 111.483 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.509 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 3.8 mm? -119.86 160.52 22.49 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 178.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.409 ' HB2' ' OE1' ' A' ' 57' ' ' GLN . 67.3 m -114.33 157.69 22.46 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 122.162 -0.336 . . . . 0.0 110.227 179.138 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 16.7 mmt -64.66 -27.57 69.01 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.264 0.554 . . . . 0.0 111.208 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.49 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -86.24 -7.59 58.42 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.427 0.632 . . . . 0.0 110.29 177.021 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.409 ' OE1' ' HB2' ' A' ' 54' ' ' SER . 0.9 OUTLIER -97.84 -19.83 17.9 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.59 -178.989 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.583 HG22 HE21 ' A' ' 88' ' ' GLN . 14.8 pt -144.88 -177.39 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 CA-C-O 121.102 0.477 . . . . 0.0 111.241 -177.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.409 ' CG ' ' HG3' ' A' ' 89' ' ' GLN . 16.8 mmt180 -155.58 141.45 18.12 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.56 177.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -96.63 139.82 32.14 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 178.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -140.4 139.83 35.37 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.245 0.545 . . . . 0.0 110.905 -178.153 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.53 ' HB2' HD11 ' A' ' 67' ' ' ILE . 64.3 t80 -144.88 147.01 32.29 Favored 'General case' 0 C--O 1.21 -1.017 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.956 178.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.8 t70 57.0 23.45 8.36 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 121.633 0.73 . . . . 0.0 110.805 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.6 -2.69 86.95 Favored Glycine 0 N--CA 1.429 -1.791 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.816 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.506 HE21 HD23 ' A' ' 76' ' ' LEU . 13.0 pt20 -115.14 148.74 41.3 Favored Pre-proline 0 C--N 1.323 -0.549 0 O-C-N 122.293 -0.534 . . . . 0.0 110.645 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -69.33 142.94 51.29 Favored 'Trans proline' 0 C--O 1.236 0.392 0 C-N-CA 122.323 2.015 . . . . 0.0 111.836 179.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.53 HD11 ' HB2' ' A' ' 62' ' ' PHE . 32.4 mt -96.4 146.24 7.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.972 0.415 . . . . 0.0 110.53 -179.422 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -126.21 170.32 11.95 Favored 'General case' 0 CA--C 1.504 -0.81 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 178.399 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.459 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 11.2 pt-20 -70.32 -19.04 63.1 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-O 120.982 0.42 . . . . 0.0 111.657 -179.663 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.3 t -90.93 3.67 54.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.193 0.521 . . . . 0.0 111.288 -178.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.7 142.09 28.41 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-O 121.423 0.63 . . . . 0.0 111.412 178.172 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.695 ' HB ' ' OE1' ' A' ' 75' ' ' GLN . 1.1 m -112.48 140.69 24.07 Favored Pre-proline 0 C--N 1.317 -0.82 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.487 ' HD2' HG22 ' A' ' 72' ' ' THR . 15.7 Cg_endo -54.23 -33.75 76.55 Favored 'Trans proline' 0 N--CA 1.481 0.76 0 C-N-CA 123.478 2.785 . . . . 0.0 113.244 -176.699 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.45 -27.12 64.97 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.0 0.429 . . . . 0.0 111.574 -178.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.695 ' OE1' ' HB ' ' A' ' 72' ' ' THR . 5.9 mp0 -68.29 -32.61 72.88 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.053 0.454 . . . . 0.0 111.564 -178.855 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.506 HD23 HE21 ' A' ' 65' ' ' GLN . 0.8 OUTLIER -92.58 10.07 31.94 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.005 0.431 . . . . 0.0 110.045 179.9 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 43.62 41.16 3.32 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.598 1.159 . . . . 0.0 112.264 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 5.9 ptm -80.3 163.62 23.8 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.5 -178.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -107.48 165.96 11.02 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.129 -177.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -59.48 143.23 50.58 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 121.448 0.642 . . . . 0.0 110.802 171.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 69.55 19.15 7.55 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.032 -0.985 . . . . 0.0 111.67 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -62.49 149.27 43.28 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.186 176.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.0 m -102.05 122.09 43.44 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 121.597 0.713 . . . . 0.0 112.052 -177.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.733 HG13 HG22 ' A' ' 22' ' ' VAL . 14.0 mm -93.22 139.15 18.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.658 179.033 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -97.57 118.79 34.87 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 120.989 0.423 . . . . 0.0 110.687 179.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 43.5 t -114.06 133.11 61.1 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 CA-C-O 121.406 0.622 . . . . 0.0 110.114 176.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . 0.594 ' HA ' ' HG2' ' A' ' 25' ' ' GLN . 24.2 p90 -134.39 153.37 51.94 Favored 'General case' 0 C--N 1.3 -1.587 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.431 -178.355 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.583 HE21 HG22 ' A' ' 58' ' ' ILE . 0.6 OUTLIER -62.27 157.9 18.5 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-O 121.12 0.486 . . . . 0.0 110.747 179.711 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.437 ' HG2' ' O ' ' A' ' 88' ' ' GLN . 35.0 mm-40 . . . . . 0 C--N 1.321 -0.646 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.696 -177.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 11.5 p-80 . . . . . 0 N--CA 1.447 -0.612 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 43.5 pt -128.01 167.47 23.01 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.072 0 CA-C-O 121.105 0.478 . . . . 0.0 111.036 -176.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.51 ' HA ' ' O ' ' A' ' 32' ' ' PHE . 45.1 t-20 -107.18 128.03 54.05 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.719 -0.475 . . . . 0.0 109.719 179.412 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -118.64 134.06 55.39 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 178.156 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.4 mtmp? -115.37 149.18 38.35 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-O 120.999 0.428 . . . . 0.0 109.979 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.701 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 2.7 p -125.15 129.01 73.3 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.011 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.693 -177.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -110.64 120.84 43.72 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.058 0.456 . . . . 0.0 109.836 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.52 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -92.88 156.07 22.81 Favored Glycine 0 N--CA 1.427 -1.946 0 C-N-CA 120.575 -0.822 . . . . 0.0 112.837 -178.673 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.56 -13.42 1.56 Allowed 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 178.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -90.3 -13.3 35.54 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.131 0.491 . . . . 0.0 110.728 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 104.94 6.56 39.82 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 121.01 -0.614 . . . . 0.0 112.225 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 40.1 t -89.83 155.53 19.1 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 120.821 0.343 . . . . 0.0 110.421 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.701 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.7 p -147.95 134.59 13.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 CA-C-O 121.096 0.474 . . . . 0.0 110.714 178.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.5 t -122.22 139.23 49.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -107.74 142.79 37.2 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 120.741 0.305 . . . . 0.0 110.907 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.529 ' HE1' HG12 ' A' ' 22' ' ' VAL . 10.1 m-85 . . . . . 0 N--CA 1.476 0.86 0 CA-C-O 121.318 0.58 . . . . 0.0 111.587 -178.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 39.9 pt . . . . . 0 CA--C 1.515 -0.381 0 CA-C-O 120.965 0.412 . . . . 0.0 110.594 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 28.9 mtmm -87.66 150.14 23.83 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 120.923 0.392 . . . . 0.0 110.421 178.274 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.402 ' O ' ' HG2' ' A' ' 73' ' ' PRO . 23.8 ptt180 -62.68 -24.33 67.58 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.488 0.661 . . . . 0.0 111.099 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 14.6 t60 -103.11 1.72 33.67 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.883 0.849 . . . . 0.0 109.594 -177.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.1 m -92.56 139.35 23.7 Favored Pre-proline 0 C--N 1.31 -1.123 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.878 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.76 128.64 19.32 Favored 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 121.934 1.756 . . . . 0.0 112.185 -177.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.529 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.0 OUTLIER -66.83 -16.86 64.57 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.01 -179.445 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.562 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 1.0 OUTLIER -52.14 -29.87 24.01 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.921 0.391 . . . . 0.0 111.882 179.607 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 35.3 mtpt -62.83 -44.58 95.75 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-O 120.996 0.427 . . . . 0.0 110.417 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.9 pp -73.47 -33.9 65.09 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 120.896 0.379 . . . . 0.0 110.29 178.71 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 47.8 mtm -62.12 -49.31 76.4 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 121.32 0.581 . . . . 0.0 110.411 -179.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -68.65 -35.3 77.07 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.073 178.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.13 -33.13 75.06 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.309 0.576 . . . . 0.0 109.826 178.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 62.3 t80 -63.72 -55.19 25.2 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.797 178.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.427 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 25.3 p -63.13 -35.82 81.56 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.803 0.335 . . . . 0.0 110.922 -178.082 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -61.75 -48.63 79.83 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 121.035 0.445 . . . . 0.0 111.422 178.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -76.72 -31.08 56.92 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.967 0.413 . . . . 0.0 111.383 -177.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -82.77 -21.96 34.47 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 -178.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 93.75 8.13 60.95 Favored Glycine 0 CA--C 1.523 0.561 0 C-N-CA 120.268 -0.968 . . . . 0.0 113.319 179.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.427 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 3.2 mm? -97.98 173.74 6.91 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 122.205 -0.585 . . . . 0.0 111.01 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 71.7 m -122.27 157.8 30.91 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 120.719 0.295 . . . . 0.0 111.154 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.7 mmt -63.7 -27.28 69.1 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.118 0.485 . . . . 0.0 112.247 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.73 -12.61 53.42 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.636 0.731 . . . . 0.0 109.944 177.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -93.66 -30.97 14.65 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.699 -177.721 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 9.6 pt -132.56 177.34 7.26 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-O 121.132 0.492 . . . . 0.0 111.5 -177.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.403 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 12.9 mmt180 -150.1 143.77 25.3 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.164 179.407 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -100.9 141.44 33.78 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.705 179.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -142.99 139.34 30.59 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-O 121.19 0.519 . . . . 0.0 111.118 -177.002 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.547 ' HB2' HD11 ' A' ' 67' ' ' ILE . 72.5 t80 -144.61 145.92 32.03 Favored 'General case' 0 C--O 1.214 -0.767 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 16.7 t70 57.43 23.44 9.04 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 121.885 0.85 . . . . 0.0 109.962 -178.357 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.77 -25.88 8.05 Favored Glycine 0 N--CA 1.426 -1.977 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.548 -178.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.414 HE21 HD23 ' A' ' 76' ' ' LEU . 12.4 pt20 -90.25 149.26 40.95 Favored Pre-proline 0 C--N 1.323 -0.561 0 O-C-N 122.582 -0.363 . . . . 0.0 111.301 -177.427 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -71.7 141.58 37.98 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 122.206 1.938 . . . . 0.0 111.391 178.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.547 HD11 ' HB2' ' A' ' 62' ' ' PHE . 39.0 mt -91.9 149.27 4.18 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-O 120.964 0.411 . . . . 0.0 110.905 -177.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -115.53 175.57 5.46 Favored 'General case' 0 CA--C 1.502 -0.903 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 177.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.562 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 0.2 OUTLIER -77.5 -20.67 53.96 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-O 121.503 0.668 . . . . 0.0 110.223 179.423 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.8 t -95.22 8.59 42.6 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.843 0.83 . . . . 0.0 110.529 -178.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -78.49 134.97 37.26 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.0 178.006 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.27 137.42 21.52 Favored Pre-proline 0 C--N 1.311 -1.074 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.035 176.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.593 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 10.9 Cg_endo -55.81 -34.13 90.31 Favored 'Trans proline' 0 C--O 1.236 0.375 0 C-N-CA 123.027 2.485 . . . . 0.0 112.477 -177.622 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.25 -17.39 61.34 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.795 -179.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.6 -33.66 53.7 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.916 0.388 . . . . 0.0 110.98 -179.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.414 HD23 HE21 ' A' ' 65' ' ' GLN . 0.7 OUTLIER -89.86 -2.85 58.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.24 0.543 . . . . 0.0 109.974 178.662 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 57.01 36.75 28.18 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.862 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.593 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.9 ptm -76.27 160.83 29.28 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.635 -178.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.491 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 12.3 pt-20 -112.51 166.11 11.62 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-O 120.854 0.359 . . . . 0.0 110.469 -177.285 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -62.76 148.27 47.26 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 121.343 0.592 . . . . 0.0 110.975 174.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 73.07 13.52 4.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.424 -179.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.491 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 2.2 t0 -74.66 158.66 33.23 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.798 -0.361 . . . . 0.0 110.154 178.494 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 39.6 m -116.01 136.59 52.89 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.783 0.801 . . . . 0.0 112.982 -176.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.429 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 44.5 mm -97.26 140.94 16.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.371 178.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -99.11 117.38 33.46 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.707 0.289 . . . . 0.0 110.28 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.52 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 73.0 t -113.52 136.11 50.95 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 CA-C-O 121.432 0.634 . . . . 0.0 110.671 178.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -137.34 155.26 49.63 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.075 -178.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -80.83 111.91 17.72 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.187 0.517 . . . . 0.0 110.999 -176.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 64.4 mm-40 . . . . . 0 C--N 1.317 -0.831 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.744 179.241 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.498 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 43.9 p-80 . . . . . 0 N--CA 1.447 -0.612 0 CA-C-O 121.182 0.515 . . . . 0.0 111.753 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 31.5 pt -133.5 170.97 18.85 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.835 178.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -107.46 134.03 51.09 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.405 HD23 HG12 ' A' ' 34' ' ' ILE . 2.9 mm? -125.05 139.14 54.06 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 177.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 30' ' ' VAL . 52.3 mtmt -121.8 143.43 49.4 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.281 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.728 HG22 HG13 ' A' ' 84' ' ' ILE . 65.8 t -121.68 128.87 75.86 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -179.238 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -108.51 134.97 50.55 Favored 'General case' 0 C--O 1.245 0.835 0 CA-C-O 121.377 0.608 . . . . 0.0 111.092 -177.096 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -96.18 170.68 27.58 Favored Glycine 0 N--CA 1.428 -1.847 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.899 179.136 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.634 ' H ' ' NE2' ' A' ' 25' ' ' GLN . 0.0 OUTLIER -69.78 -25.46 63.81 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.207 0.527 . . . . 0.0 110.498 -176.568 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -84.66 -2.85 58.08 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.161 -178.049 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 94.9 7.61 59.75 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 120.197 -1.002 . . . . 0.0 113.515 179.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 37.0 t -85.45 155.25 21.33 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 177.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.496 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 5.3 p -150.82 143.05 16.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-O 121.164 0.507 . . . . 0.0 111.021 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.606 HG11 ' HD3' ' A' ' 50' ' ' ARG . 16.4 t -123.63 140.48 47.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 178.614 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -106.2 138.66 42.0 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 120.999 0.428 . . . . 0.0 110.356 179.104 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.403 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 16.4 m-85 . . . . . 0 C--N 1.324 -0.508 0 CA-C-O 121.047 0.451 . . . . 0.0 110.895 -177.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.541 HD13 HD23 ' A' ' 43' ' ' LEU . 20.9 pt . . . . . 0 CA--C 1.512 -0.498 0 CA-C-O 121.17 0.51 . . . . 0.0 110.777 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.533 ' HB2' ' OG1' ' A' ' 38' ' ' THR . 46.6 mtpt -81.83 148.25 28.94 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.267 179.108 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.9 ppt_? -69.01 -16.84 63.82 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.829 0.347 . . . . 0.0 111.397 -179.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 11.4 t-80 -100.95 -3.5 29.41 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 122.291 1.043 . . . . 0.0 108.52 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.533 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 2.4 m -90.81 137.28 26.96 Favored Pre-proline 0 N--CA 1.432 -1.334 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.429 -179.184 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_endo -61.6 129.15 26.83 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.39 2.06 . . . . 0.0 112.04 -179.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.734 HD13 ' SD ' ' A' ' 44' ' ' MET . 0.4 OUTLIER -69.36 -17.95 63.74 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.02 -0.537 . . . . 0.0 112.317 -178.868 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.571 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 7.8 p -50.93 -32.46 20.86 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 122.995 0.518 . . . . 0.0 111.658 179.01 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt -59.8 -48.34 82.08 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.446 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.6 pp -71.42 -33.78 69.72 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.234 0.54 . . . . 0.0 110.075 179.106 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.734 ' SD ' HD13 ' A' ' 40' ' ' LEU . 38.5 mtp -60.6 -49.28 78.18 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.183 0.516 . . . . 0.0 111.053 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 27.6 mmtp -67.23 -35.89 80.52 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.77 177.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.443 ' O ' ' HG2' ' A' ' 50' ' ' ARG . . . -63.68 -39.26 93.89 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 121.23 0.538 . . . . 0.0 110.186 179.326 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -57.81 -55.37 35.75 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.231 177.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.589 ' SG ' HD11 ' A' ' 58' ' ' ILE . 32.5 m -59.92 -41.26 91.37 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.104 -178.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -65.68 -39.91 91.79 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.606 ' HD3' HG11 ' A' ' 30' ' ' VAL . 14.6 ptm180 -82.08 -35.7 28.38 Favored 'General case' 0 C--N 1.329 -0.313 0 O-C-N 121.912 -0.492 . . . . 0.0 111.578 -178.822 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.425 ' HB3' HD23 ' A' ' 53' ' ' LEU . 24.9 mm-40 -77.67 -22.37 50.67 Favored 'General case' 0 CA--C 1.502 -0.896 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -179.19 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 84.48 42.8 7.21 Favored Glycine 0 N--CA 1.427 -1.957 0 C-N-CA 119.773 -1.203 . . . . 0.0 111.168 -177.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.425 HD23 ' HB3' ' A' ' 51' ' ' GLN . 4.0 mm? -122.8 164.17 18.86 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 178.687 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.8 m -113.58 150.25 33.31 Favored 'General case' 0 N--CA 1.44 -0.968 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 178.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 10.6 mmt -59.32 -29.16 67.44 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-O 121.3 0.571 . . . . 0.0 111.651 178.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.438 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -84.87 -13.58 50.5 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.511 0.672 . . . . 0.0 110.651 178.241 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -91.45 -19.07 23.24 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.77 -178.428 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.589 HD11 ' SG ' ' A' ' 48' ' ' CYS . 16.3 pt -139.41 -176.46 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.118 0.485 . . . . 0.0 111.026 -178.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.417 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 7.2 mmt180 -157.14 131.68 8.62 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.678 177.228 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -89.38 145.5 25.3 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.514 178.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.598 ' HD3' ' CA ' ' A' ' 64' ' ' GLY . 7.2 tmm_? -150.65 145.52 25.9 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-O 121.137 0.494 . . . . 0.0 110.596 -176.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.422 ' HB2' HD11 ' A' ' 67' ' ' ILE . 68.9 t80 -146.88 147.13 30.5 Favored 'General case' 0 C--O 1.216 -0.709 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.423 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 18.8 t70 55.83 23.75 6.75 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-O 121.753 0.787 . . . . 0.0 110.517 -177.199 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.598 ' CA ' ' HD3' ' A' ' 61' ' ' ARG . . . 83.9 -16.38 32.48 Favored Glycine 0 N--CA 1.428 -1.863 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.698 -179.182 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.575 ' O ' ' HG2' ' A' ' 61' ' ' ARG . 12.2 pt20 -97.1 148.0 33.76 Favored Pre-proline 0 CA--C 1.537 0.474 0 O-C-N 122.619 -0.342 . . . . 0.0 110.603 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -68.58 141.19 49.59 Favored 'Trans proline' 0 CA--C 1.53 0.325 0 C-N-CA 122.572 2.181 . . . . 0.0 112.337 -179.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.422 HD11 ' HB2' ' A' ' 62' ' ' PHE . 50.3 mt -90.25 146.78 5.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 179.46 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.662 HD22 ' HB2' ' A' ' 71' ' ' ASP . 0.2 OUTLIER -116.45 164.67 14.21 Favored 'General case' 0 CA--C 1.498 -1.054 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.463 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.571 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 9.5 pt-20 -75.84 -18.0 59.61 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.679 0.752 . . . . 0.0 109.859 177.649 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 23.5 p -93.0 1.65 57.2 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.735 -176.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.662 ' HB2' HD22 ' A' ' 68' ' ' ASN . 14.4 t70 -101.56 159.64 15.13 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 121.817 -0.552 . . . . 0.0 111.103 -177.585 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -114.79 151.31 45.29 Favored Pre-proline 0 C--O 1.219 -0.509 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 178.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.86 -29.86 91.31 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.978 2.452 . . . . 0.0 112.116 -179.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.45 -17.84 61.74 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.214 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -68.25 -41.51 81.04 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-O 121.64 0.733 . . . . 0.0 110.382 -178.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.481 HD23 HE21 ' A' ' 65' ' ' GLN . 0.8 OUTLIER -86.75 2.93 47.05 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.862 -174.634 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 56.55 33.21 22.26 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-O 121.399 0.619 . . . . 0.0 111.044 178.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.414 ' HE1' HD11 ' A' ' 84' ' ' ILE . 6.9 ptm -77.96 156.77 30.03 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.097 -177.766 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.575 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 12.3 pt-20 -107.08 162.61 13.71 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.274 -177.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -58.72 138.49 57.04 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.146 0.498 . . . . 0.0 111.127 174.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 77.21 19.54 1.3 Allowed 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 124.665 1.186 . . . . 0.0 110.613 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.575 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 0.7 OUTLIER -70.54 152.1 44.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.145 177.985 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 31.5 m -106.85 121.49 44.51 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.527 0.679 . . . . 0.0 112.694 -176.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.728 HG13 HG22 ' A' ' 22' ' ' VAL . 18.3 mm -85.3 140.53 15.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.232 176.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -102.23 116.18 32.12 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 120.837 0.351 . . . . 0.0 110.926 -179.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.417 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 72.3 t -109.69 138.43 37.26 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.938 0 CA-C-O 120.963 0.411 . . . . 0.0 110.471 177.378 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.6 p90 -133.99 149.01 51.2 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 116.092 -0.503 . . . . 0.0 109.817 178.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . 0.417 ' NE2' HG22 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -75.5 131.72 40.28 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.789 0.804 . . . . 0.0 112.168 -176.607 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 . . . . . 0 C--N 1.314 -0.942 0 CA-C-N 115.162 -0.926 . . . . 0.0 111.772 178.269 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.48 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 24.8 p-80 . . . . . 0 C--O 1.234 0.271 0 CA-C-O 120.982 0.42 . . . . 0.0 110.813 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 42.1 pt -129.65 171.21 17.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.277 0.56 . . . . 0.0 110.416 178.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.523 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 23.4 t-20 -110.5 135.72 50.73 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.099 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -124.65 143.57 50.66 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.436 ' HG2' ' HG3' ' A' ' 31' ' ' GLN . 54.6 mtmt -126.48 140.74 52.23 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-O 121.22 0.533 . . . . 0.0 109.826 179.262 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.749 HG22 HG13 ' A' ' 84' ' ' ILE . 60.1 t -122.99 131.96 72.31 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 -178.488 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.06 129.25 55.45 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 -178.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.454 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -105.66 156.95 16.41 Favored Glycine 0 N--CA 1.428 -1.872 0 C-N-CA 120.193 -1.003 . . . . 0.0 111.962 -179.388 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.24 -9.48 0.43 Allowed 'General case' 0 CA--C 1.55 0.96 0 N-CA-C 113.552 0.945 . . . . 0.0 113.552 178.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -82.48 -21.22 35.63 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.3 0.571 . . . . 0.0 110.208 178.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.51 3.52 40.6 Favored Glycine 0 CA--C 1.508 -0.394 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.7 t -91.03 152.66 20.57 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.514 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 3.2 p -148.35 137.02 15.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.161 0.505 . . . . 0.0 110.145 -178.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.418 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 3.8 t -125.99 141.72 44.82 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 O-C-N 122.108 -0.37 . . . . 0.0 110.516 -177.777 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.44 ' HB3' HD21 ' A' ' 19' ' ' ASN . 0.8 OUTLIER -106.07 141.71 36.98 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.195 179.166 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.449 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 20.1 m-85 . . . . . 0 C--N 1.323 -0.585 0 CA-C-O 121.172 0.51 . . . . 0.0 110.99 -177.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.435 HD13 HD23 ' A' ' 43' ' ' LEU . 33.7 pt . . . . . 0 CA--C 1.518 -0.272 0 CA-C-O 120.908 0.385 . . . . 0.0 110.177 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.524 ' HB2' ' OG1' ' A' ' 38' ' ' THR . 22.5 mtpp -85.89 151.23 23.94 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-O 121.131 0.491 . . . . 0.0 110.417 177.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -64.32 -25.1 67.89 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.072 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 19.5 t-160 -102.39 1.07 34.96 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.998 0.904 . . . . 0.0 109.25 -176.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.524 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.6 m -91.8 136.04 26.82 Favored Pre-proline 0 C--N 1.3 -1.575 0 CA-C-N 114.828 -1.078 . . . . 0.0 109.965 -179.26 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -58.23 125.85 19.74 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.597 2.198 . . . . 0.0 112.341 -179.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.583 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.3 pp -68.4 -16.8 64.05 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.039 -179.059 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.459 ' N ' HD12 ' A' ' 40' ' ' LEU . 26.2 t -51.19 -31.95 21.89 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 121.006 0.431 . . . . 0.0 111.125 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.3 mtpp -56.52 -50.49 71.68 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.305 0.574 . . . . 0.0 110.802 178.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.6 pp -71.5 -32.74 68.57 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.991 -179.082 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 49.5 mtm -64.0 -42.99 96.99 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.224 0.535 . . . . 0.0 110.731 -179.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.619 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 1.4 mmpt? -68.04 -38.94 83.09 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.54 177.491 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.19 -35.5 80.51 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-O 121.174 0.511 . . . . 0.0 110.068 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.523 ' CE2' ' HG3' ' A' ' 51' ' ' GLN . 64.4 t80 -61.79 -54.9 35.98 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.081 177.434 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.629 ' SG ' HD11 ' A' ' 58' ' ' ILE . 30.4 m -58.89 -39.04 80.27 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.127 0.489 . . . . 0.0 110.993 -179.146 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.619 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 73.6 mm-40 -59.84 -52.79 63.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.006 0.431 . . . . 0.0 111.399 178.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' ' 47' ' ' TYR . 9.6 ptp180 -71.17 -36.05 71.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.993 0.425 . . . . 0.0 111.965 -177.046 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.523 ' HG3' ' CE2' ' A' ' 47' ' ' TYR . 24.3 mm-40 -72.68 -16.95 61.68 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -179.157 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 74.9 38.04 42.56 Favored Glycine 0 N--CA 1.435 -1.381 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -174.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.617 HD23 HG21 ' A' ' 58' ' ' ILE . 3.7 mp -123.41 165.66 16.67 Favored 'General case' 0 N--CA 1.433 -1.292 0 C-N-CA 123.631 0.772 . . . . 0.0 109.376 -175.431 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.426 ' HB2' ' OE1' ' A' ' 57' ' ' GLN . 61.8 m -124.88 158.09 34.34 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-O 120.67 0.272 . . . . 0.0 111.082 178.362 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.8 mmt -61.56 -30.2 70.5 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-O 121.069 0.461 . . . . 0.0 111.998 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.57 -13.36 51.97 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.615 0.721 . . . . 0.0 110.491 177.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.426 ' OE1' ' HB2' ' A' ' 54' ' ' SER . 1.2 mp0 -89.95 -20.71 23.0 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.723 -178.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.629 HD11 ' SG ' ' A' ' 48' ' ' CYS . 13.5 pt -142.91 -177.2 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.306 0.574 . . . . 0.0 111.871 -177.701 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.7 mmt180 -157.26 140.83 15.78 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.861 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . 0.402 ' HB3' HD12 ' A' ' 67' ' ' ILE . 23.1 m-85 -97.36 145.58 26.01 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.886 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.429 ' NE ' ' HA2' ' A' ' 64' ' ' GLY . 1.2 tmt_? -143.32 138.84 29.79 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-O 121.068 0.461 . . . . 0.0 110.664 -177.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.566 ' HE1' ' OD1' ' A' ' 82' ' ' ASP . 80.6 t80 -143.36 147.42 34.65 Favored 'General case' 0 C--O 1.208 -1.089 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.994 179.46 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.0 t70 57.55 22.84 8.55 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 121.73 0.776 . . . . 0.0 110.665 179.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.429 ' HA2' ' NE ' ' A' ' 61' ' ' ARG . . . 80.27 2.74 89.47 Favored Glycine 0 N--CA 1.427 -1.95 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.706 -178.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 62' ' ' PHE . 13.3 pt20 -119.43 149.96 48.73 Favored Pre-proline 0 N--CA 1.442 -0.864 0 O-C-N 122.313 -0.522 . . . . 0.0 109.741 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 65' ' ' GLN . 14.2 Cg_exo -65.06 141.26 69.26 Favored 'Trans proline' 0 C--N 1.327 -0.56 0 C-N-CA 122.245 1.963 . . . . 0.0 111.654 178.269 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.539 HD11 ' HB2' ' A' ' 62' ' ' PHE . 44.2 mt -92.74 146.21 6.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 178.147 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.437 HD22 ' CG ' ' A' ' 71' ' ' ASP . 0.9 OUTLIER -112.85 170.46 8.18 Favored 'General case' 0 CA--C 1.502 -0.87 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.988 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -75.92 -15.72 60.14 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.515 0.674 . . . . 0.0 109.772 176.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 18.9 p -93.86 3.92 54.68 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.313 179.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.479 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 22.4 m-20 -82.09 142.05 32.62 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.477 0.656 . . . . 0.0 111.951 -179.359 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -116.41 139.31 25.19 Favored Pre-proline 0 C--N 1.317 -0.843 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.408 174.391 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.428 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 13.5 Cg_endo -56.76 -33.3 93.86 Favored 'Trans proline' 0 C--O 1.237 0.439 0 C-N-CA 123.036 2.491 . . . . 0.0 113.131 -175.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.83 -27.93 66.28 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.688 -179.089 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -65.05 -37.9 89.06 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.926 0.393 . . . . 0.0 111.296 -179.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.476 HD22 ' HD2' ' A' ' 62' ' ' PHE . 0.5 OUTLIER -93.09 7.14 45.4 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 -179.855 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 43.35 40.21 2.5 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.636 1.174 . . . . 0.0 112.479 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.428 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 5.5 ptm -74.16 157.09 36.58 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.827 -178.409 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -103.39 159.85 15.21 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.013 -176.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.523 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 10.5 p-10 -57.69 141.92 46.84 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.245 0.545 . . . . 0.0 111.057 174.423 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' A' ' 80' ' ' ASP . 8.3 mt-10 74.77 19.1 2.58 Favored 'General case' 0 CA--C 1.506 -0.727 0 C-N-CA 124.337 1.055 . . . . 0.0 111.48 -179.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.566 ' OD1' ' HE1' ' A' ' 62' ' ' PHE . 16.4 t70 -64.16 150.05 46.51 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.685 177.146 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 23.2 m -104.07 113.9 27.76 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.413 0.625 . . . . 0.0 112.044 -179.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.749 HG13 HG22 ' A' ' 22' ' ' VAL . 17.3 mm -83.59 145.08 8.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.532 178.278 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -102.83 116.86 33.38 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.124 -179.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.454 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 71.3 t -113.06 134.85 54.4 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-O 121.321 0.582 . . . . 0.0 111.175 176.496 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 13.0 p90 -132.9 155.5 48.94 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.749 -179.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -75.55 132.1 40.47 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.49 0.662 . . . . 0.0 112.051 -176.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 . . . . . 0 C--N 1.323 -0.555 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.2 178.238 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 . . . . . 0 N--CA 1.446 -0.644 0 CA-C-O 121.044 0.449 . . . . 0.0 110.429 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 31.9 pt -130.95 170.72 19.13 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.066 0 CA-C-O 121.379 0.609 . . . . 0.0 110.994 -178.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -104.85 136.23 44.74 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.563 178.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -127.93 135.93 50.64 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 177.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -121.81 146.82 46.7 Favored 'General case' 0 C--N 1.308 -1.215 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 179.018 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.669 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 3.4 p -124.62 131.44 72.7 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.797 -176.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -112.06 132.03 55.07 Favored 'General case' 0 C--O 1.244 0.79 0 CA-C-O 121.151 0.5 . . . . 0.0 110.762 -178.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -102.92 174.12 23.09 Favored Glycine 0 N--CA 1.435 -1.391 0 C-N-CA 121.292 -0.48 . . . . 0.0 112.725 -179.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.632 ' H ' ' NE2' ' A' ' 25' ' ' GLN . 0.1 OUTLIER -66.92 -31.41 71.98 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.531 0.681 . . . . 0.0 110.782 -177.529 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -77.31 -10.65 59.57 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.984 -178.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 98.82 7.37 55.51 Favored Glycine 0 N--CA 1.443 -0.894 0 C-N-CA 120.448 -0.882 . . . . 0.0 112.578 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 18.7 t -83.46 154.24 24.03 Favored 'General case' 0 N--CA 1.444 -0.765 0 O-C-N 122.416 -0.461 . . . . 0.0 109.976 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.669 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.2 p -146.68 132.69 13.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.269 0.557 . . . . 0.0 111.074 179.564 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.0 t -117.12 135.16 58.4 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -105.35 142.75 34.56 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.754 0.311 . . . . 0.0 110.92 -179.568 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.478 ' HE1' HG12 ' A' ' 22' ' ' VAL . 11.5 m-85 . . . . . 0 N--CA 1.468 0.447 0 CA-C-O 121.109 0.48 . . . . 0.0 110.96 -179.568 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 35.5 pt . . . . . 0 CA--C 1.52 -0.178 0 CA-C-O 121.149 0.499 . . . . 0.0 111.32 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.477 ' HB2' ' OG1' ' A' ' 38' ' ' THR . 15.6 mtpp -75.48 153.79 37.35 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.042 178.335 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.9 ptt180 -67.14 -22.38 65.78 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.507 0.67 . . . . 0.0 110.492 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -103.76 2.31 32.78 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 122.205 1.002 . . . . 0.0 109.357 -176.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.477 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.2 m -89.97 134.47 31.76 Favored Pre-proline 0 C--N 1.302 -1.476 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.808 178.551 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -61.34 125.51 17.07 Favored 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 122.33 2.02 . . . . 0.0 112.27 -178.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.531 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.0 OUTLIER -65.92 -17.42 64.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.112 0.482 . . . . 0.0 111.899 -179.57 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.455 ' N ' HD12 ' A' ' 40' ' ' LEU . 5.9 p -55.68 -28.25 54.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.416 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -60.91 -45.55 94.21 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 116.25 -0.432 . . . . 0.0 109.946 179.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.5 pp -72.91 -36.73 67.33 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.014 0.435 . . . . 0.0 110.231 178.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 45.1 mtm -63.58 -49.59 72.78 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 120.996 0.426 . . . . 0.0 110.855 -178.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.46 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 92.5 mttt -66.25 -36.1 82.13 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-O 120.688 0.28 . . . . 0.0 110.866 178.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.54 -37.42 87.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.114 0.483 . . . . 0.0 109.981 178.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -58.73 -55.43 35.16 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.793 178.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.51 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 24.4 p -64.8 -35.47 81.19 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 122.141 -0.349 . . . . 0.0 111.325 -177.061 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 60.7 mt-10 -67.04 -40.75 87.22 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.795 0.331 . . . . 0.0 111.507 179.653 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -81.82 -32.26 31.32 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 120.935 0.398 . . . . 0.0 111.472 -178.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.7 mm-40 -82.04 -22.69 36.28 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -177.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 90.2 37.7 6.6 Favored Glycine 0 N--CA 1.437 -1.262 0 C-N-CA 120.114 -1.041 . . . . 0.0 111.174 -178.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.51 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 3.9 mm? -123.62 165.35 17.33 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 179.297 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.1 m -119.49 155.48 32.02 Favored 'General case' 0 C--N 1.312 -1.031 0 O-C-N 121.922 -0.486 . . . . 0.0 110.971 178.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 12.9 mmt -63.15 -26.04 68.63 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.448 0.642 . . . . 0.0 111.453 178.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.54 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.84 -12.65 50.24 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.553 0.692 . . . . 0.0 110.52 177.219 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -96.94 -27.23 14.74 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.748 -0.66 . . . . 0.0 112.178 -178.112 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.8 pt -132.59 176.12 9.8 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.041 0 CA-C-O 121.076 0.465 . . . . 0.0 110.485 -178.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.413 ' HD3' ' HA ' ' A' ' 59' ' ' ARG . 16.1 mmt180 -149.72 141.67 23.83 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.729 178.696 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -100.08 139.41 35.78 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.977 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.63 ' HG2' ' N ' ' A' ' 62' ' ' PHE . 1.5 ttm180 -137.83 150.63 47.33 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-O 121.179 0.514 . . . . 0.0 110.865 -178.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.63 ' N ' ' HG2' ' A' ' 61' ' ' ARG . 74.4 t80 -155.23 146.1 22.44 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.841 176.511 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.2 t70 57.45 24.6 10.4 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 121.637 0.732 . . . . 0.0 110.403 -178.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.95 0.18 84.62 Favored Glycine 0 N--CA 1.435 -1.417 0 C-N-CA 121.011 -0.614 . . . . 0.0 113.292 -179.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.42 HE21 HD23 ' A' ' 76' ' ' LEU . 12.1 pt20 -115.87 146.52 37.12 Favored Pre-proline 0 C--N 1.319 -0.728 0 O-C-N 122.13 -0.629 . . . . 0.0 110.067 179.221 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.55 139.74 45.58 Favored 'Trans proline' 0 C--O 1.238 0.495 0 C-N-CA 122.053 1.836 . . . . 0.0 111.806 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.523 HD11 ' HB2' ' A' ' 62' ' ' PHE . 42.8 mt -91.72 146.43 6.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 120.929 0.395 . . . . 0.0 110.242 -178.631 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.475 HD22 ' HB2' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -109.53 157.74 18.7 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 177.222 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.435 ' OE2' HG23 ' A' ' 70' ' ' THR . 0.1 OUTLIER -68.65 -19.53 64.41 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-O 121.649 0.738 . . . . 0.0 110.579 178.061 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.435 HG23 ' OE2' ' A' ' 69' ' ' GLU . 1.0 OUTLIER -96.32 14.81 23.03 Favored 'General case' 0 N--CA 1.421 -1.905 0 CA-C-N 116.011 -0.54 . . . . 0.0 112.107 179.693 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.475 ' HB2' HD22 ' A' ' 68' ' ' ASN . 3.3 t70 -96.4 150.84 20.14 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 120.881 0.372 . . . . 0.0 110.31 -179.576 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.734 ' HB ' ' OE1' ' A' ' 75' ' ' GLN . 0.9 OUTLIER -117.61 141.39 28.85 Favored Pre-proline 0 CA--C 1.545 0.754 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 179.179 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.518 ' HD2' HG22 ' A' ' 72' ' ' THR . 12.2 Cg_endo -53.66 -34.26 73.03 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 123.545 2.83 . . . . 0.0 113.122 -177.246 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.81 -26.25 65.98 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.76 -178.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.734 ' OE1' ' HB ' ' A' ' 72' ' ' THR . 6.3 mp0 -67.29 -38.83 85.65 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.936 0.398 . . . . 0.0 111.444 -179.332 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.42 HD23 HE21 ' A' ' 65' ' ' GLN . 1.1 mp -81.51 -10.48 59.47 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.513 -179.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 55.01 46.74 23.64 Favored 'General case' 0 C--N 1.347 0.474 0 CA-C-O 121.971 0.891 . . . . 0.0 109.785 -179.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 5.6 ptm -76.04 -141.22 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 114.703 -1.135 . . . . 0.0 112.048 -176.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.562 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 11.9 pt-20 -160.74 152.07 19.19 Favored 'General case' 0 CA--C 1.508 -0.641 0 O-C-N 121.673 -0.642 . . . . 0.0 109.367 -176.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -59.01 142.97 49.75 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.285 0.564 . . . . 0.0 111.163 173.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 71.56 15.63 6.03 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 124.14 0.976 . . . . 0.0 111.175 179.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.562 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 3.6 t0 -70.98 158.92 35.68 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.811 0.339 . . . . 0.0 110.131 179.261 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 27.3 m -108.31 126.51 52.92 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.616 0.722 . . . . 0.0 112.562 -176.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 44.7 mm -89.75 133.85 30.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.118 176.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -93.85 114.44 26.68 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 120.769 0.318 . . . . 0.0 110.605 -178.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 92.5 t -112.55 137.19 46.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-O 121.096 0.474 . . . . 0.0 110.533 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.7 p90 -139.64 154.1 47.46 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.109 -179.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -80.35 111.51 16.81 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.465 0.65 . . . . 0.0 111.691 -176.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 77.1 mm-40 . . . . . 0 C--N 1.313 -0.992 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.029 177.618 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 50.2 p-80 . . . . . 0 N--CA 1.447 -0.576 0 CA-C-O 121.369 0.605 . . . . 0.0 112.027 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 38.9 pt -132.2 170.53 19.71 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.653 178.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.486 HD21 ' HB3' ' A' ' 31' ' ' GLN . 16.6 t-20 -104.57 129.64 52.63 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 121.02 0.438 . . . . 0.0 110.797 -179.819 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.432 HD23 HG12 ' A' ' 34' ' ' ILE . 3.0 mm? -123.1 135.18 54.27 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 176.481 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.411 ' HG2' ' HG3' ' A' ' 31' ' ' GLN . 51.5 mtmt -119.86 141.69 49.34 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 -179.625 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.726 HG22 HG13 ' A' ' 84' ' ' ILE . 62.9 t -121.58 131.51 72.91 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 -177.785 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.25 125.71 50.67 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.152 0.501 . . . . 0.0 110.07 -178.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.428 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -103.23 156.29 17.97 Favored Glycine 0 N--CA 1.432 -1.576 0 C-N-CA 120.332 -0.937 . . . . 0.0 112.139 -179.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.08 -10.9 0.21 Allowed 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 178.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -78.31 -21.64 49.35 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.612 0.72 . . . . 0.0 109.854 178.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 98.72 24.23 11.08 Favored Glycine 0 N--CA 1.443 -0.84 0 N-CA-C 110.196 -1.161 . . . . 0.0 110.196 -177.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.5 t -117.54 131.44 56.7 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.084 -0.558 . . . . 0.0 110.186 -177.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.574 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 3.1 p -124.55 142.61 40.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-O 121.317 0.58 . . . . 0.0 110.912 179.26 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.8 t -125.19 140.91 46.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.486 ' HB3' HD21 ' A' ' 19' ' ' ASN . 0.7 OUTLIER -106.28 140.26 39.5 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 120.844 0.354 . . . . 0.0 110.944 -179.675 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 12.5 m-85 . . . . . 0 C--N 1.328 -0.358 0 CA-C-O 120.851 0.358 . . . . 0.0 110.439 -179.043 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.536 HD13 HD23 ' A' ' 43' ' ' LEU . 24.9 pt . . . . . 0 N--CA 1.464 0.26 0 CA-C-O 120.984 0.421 . . . . 0.0 111.314 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 10.6 mptt -80.82 153.73 27.54 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.023 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.5 ptt180 -71.46 -13.95 61.98 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.217 0.532 . . . . 0.0 111.21 -178.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -105.75 -5.41 19.92 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 122.16 0.981 . . . . 0.0 108.479 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.498 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.8 m -85.77 130.3 51.29 Favored Pre-proline 0 N--CA 1.427 -1.613 0 CA-C-N 114.594 -1.185 . . . . 0.0 109.776 -179.649 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -61.88 123.01 11.82 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.367 2.045 . . . . 0.0 112.198 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.622 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.3 pp -61.42 -16.56 47.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.707 179.221 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.459 ' N ' HD12 ' A' ' 40' ' ' LEU . 47.9 t -50.15 -35.29 25.42 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 123.34 0.656 . . . . 0.0 111.569 179.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -66.59 -42.77 86.43 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 120.985 -0.286 . . . . 0.0 110.902 -178.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.622 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.0 pp -69.98 -33.27 71.84 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.988 0.423 . . . . 0.0 109.991 178.396 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 48.1 mtm -65.75 -48.27 72.44 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.24 0.543 . . . . 0.0 110.731 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 10.8 mmmm -64.31 -38.12 89.9 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 121.002 0.43 . . . . 0.0 110.158 177.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.62 -40.59 97.47 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.196 178.35 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -58.26 -54.56 45.65 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.615 178.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.612 ' SG ' HD11 ' A' ' 58' ' ' ILE . 31.4 m -58.92 -44.16 91.25 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.881 0.372 . . . . 0.0 110.976 -178.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -62.01 -42.42 99.14 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.014 0.375 . . . . 0.0 112.014 -179.35 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -78.8 -36.9 42.07 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.177 0.513 . . . . 0.0 111.732 -177.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.439 ' CB ' HD23 ' A' ' 53' ' ' LEU . 24.9 mm-40 -79.09 -20.38 48.91 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 112.403 0.52 . . . . 0.0 112.403 -177.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.51 42.29 6.98 Favored Glycine 0 N--CA 1.429 -1.792 0 C-N-CA 119.926 -1.13 . . . . 0.0 110.856 -177.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.439 HD23 ' CB ' ' A' ' 51' ' ' GLN . 4.0 mm? -124.01 163.66 20.94 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.405 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.403 ' HB2' ' HB2' ' A' ' 57' ' ' GLN . 48.6 m -116.59 151.37 36.35 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 178.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 10.0 mmt -60.39 -28.01 67.89 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.321 0.581 . . . . 0.0 111.382 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.509 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -84.81 -17.33 38.48 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.529 0.681 . . . . 0.0 110.503 177.923 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.403 ' HB2' ' HB2' ' A' ' 54' ' ' SER . 1.0 OUTLIER -90.43 -22.96 21.17 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.215 -178.277 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.612 HD11 ' SG ' ' A' ' 48' ' ' CYS . 16.1 pt -136.49 177.84 5.73 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 CA-C-O 121.513 0.673 . . . . 0.0 111.944 -178.738 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.445 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 17.0 mmt-85 -151.82 140.01 20.3 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.344 178.126 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -96.18 142.7 28.04 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.249 179.035 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -142.42 144.99 33.34 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-O 121.112 0.482 . . . . 0.0 110.888 -176.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.507 ' HB2' HD11 ' A' ' 67' ' ' ILE . 73.1 t80 -150.72 146.1 26.22 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 178.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 22.7 t70 56.71 23.42 7.86 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 121.772 0.796 . . . . 0.0 110.836 -178.163 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.01 -19.81 28.41 Favored Glycine 0 N--CA 1.428 -1.84 0 C-N-CA 121.055 -0.593 . . . . 0.0 112.312 -178.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.481 HE21 HD23 ' A' ' 76' ' ' LEU . 12.5 pt20 -97.21 149.5 35.78 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-O 120.833 0.349 . . . . 0.0 111.199 -178.189 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.56 142.68 36.81 Favored 'Trans proline' 0 C--O 1.237 0.474 0 C-N-CA 122.651 2.234 . . . . 0.0 112.285 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.507 HD11 ' HB2' ' A' ' 62' ' ' PHE . 23.7 mt -95.69 149.68 4.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.104 0.478 . . . . 0.0 110.16 -179.442 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -127.03 173.01 10.0 Favored 'General case' 0 CA--C 1.5 -0.947 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 178.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -75.31 -9.68 58.77 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.399 0.619 . . . . 0.0 110.041 177.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 22.1 p -92.22 -4.76 53.66 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.585 -179.084 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -95.76 143.57 26.88 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-O 121.608 0.718 . . . . 0.0 112.229 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.95 152.13 43.43 Favored Pre-proline 0 C--N 1.312 -1.055 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.377 177.354 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.477 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 18.8 Cg_endo -58.64 -29.62 89.79 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.538 2.159 . . . . 0.0 112.251 -177.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -77.27 -13.37 59.95 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.952 -178.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -76.39 -37.54 57.02 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.374 0.607 . . . . 0.0 110.545 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.481 HD23 HE21 ' A' ' 65' ' ' GLN . 0.7 OUTLIER -91.15 9.68 30.07 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.99 -179.688 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 44.16 36.87 1.64 Allowed 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.253 1.021 . . . . 0.0 111.857 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.477 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 7.0 ptm -76.36 159.71 30.26 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.554 -178.485 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.559 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 7.4 pt-20 -115.03 167.92 10.38 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.446 -176.705 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.429 ' O ' ' HB2' ' A' ' 81' ' ' GLU . 6.8 p-10 -59.49 144.97 45.66 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-O 121.017 0.436 . . . . 0.0 111.202 175.221 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 80' ' ' ASP . 56.3 mm-40 74.39 14.74 3.6 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.181 0.992 . . . . 0.0 111.7 -179.58 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.559 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 0.6 OUTLIER -74.52 154.23 38.74 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.293 178.627 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 18.1 m -112.33 131.67 55.4 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.597 0.713 . . . . 0.0 112.919 -175.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.726 HG13 HG22 ' A' ' 22' ' ' VAL . 22.8 mm -94.92 142.78 12.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.838 178.208 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -101.84 116.14 32.06 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.935 0.398 . . . . 0.0 110.547 179.017 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.445 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 44.7 t -111.19 135.98 48.69 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.085 0 CA-C-O 121.302 0.572 . . . . 0.0 110.91 178.279 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.2 p90 -135.5 160.09 39.55 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.781 -179.103 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -88.47 120.87 30.25 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.411 0.624 . . . . 0.0 111.698 -176.13 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 . . . . . 0 C--N 1.319 -0.747 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.333 177.581 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.517 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 42.5 p-80 . . . . . 0 N--CA 1.436 -1.133 0 CA-C-O 121.363 0.602 . . . . 0.0 110.474 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.419 HD11 ' HB2' ' A' ' 73' ' ' PRO . 35.3 pt -123.33 168.46 15.82 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.563 0 CA-C-O 121.466 0.65 . . . . 0.0 111.211 -176.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -105.65 135.86 46.3 Favored 'General case' 0 C--N 1.307 -1.278 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 179.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -125.96 134.03 51.64 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.075 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -120.21 141.63 49.74 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.722 HG22 HG13 ' A' ' 84' ' ' ILE . 61.5 t -124.27 134.77 65.75 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.388 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 -176.663 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.72 130.13 55.65 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.035 0.445 . . . . 0.0 110.574 -177.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -102.6 174.1 23.41 Favored Glycine 0 N--CA 1.436 -1.341 0 N-CA-C 111.446 -0.662 . . . . 0.0 111.446 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -72.57 -18.73 61.59 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.353 0.597 . . . . 0.0 111.185 -177.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -71.11 -16.91 62.59 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.868 177.511 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 96.46 16.37 37.39 Favored Glycine 0 CA--C 1.496 -1.124 0 N-CA-C 110.836 -0.906 . . . . 0.0 110.836 179.11 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.1 m -106.68 132.11 53.05 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 115.257 -0.471 . . . . 0.0 111.032 -177.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.563 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.2 p -122.48 139.03 50.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 121.199 0.523 . . . . 0.0 111.292 178.492 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.411 HG11 ' HD3' ' A' ' 50' ' ' ARG . 6.2 t -118.99 137.48 52.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.303 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -104.79 140.49 38.02 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.904 0.383 . . . . 0.0 111.022 -179.063 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.448 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 15.1 m-85 . . . . . 0 N--CA 1.465 0.303 0 CA-C-O 121.01 0.433 . . . . 0.0 110.974 -178.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 36.8 pt . . . . . 0 N--CA 1.466 0.372 0 CA-C-O 120.762 0.315 . . . . 0.0 110.514 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.517 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 30.8 mtmm -78.26 154.14 31.24 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.808 0.337 . . . . 0.0 110.69 178.148 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -69.03 -18.13 63.99 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.084 0.468 . . . . 0.0 111.024 -179.26 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 -102.51 1.78 35.5 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.833 0.825 . . . . 0.0 109.045 -179.087 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 m -96.24 133.48 24.95 Favored Pre-proline 0 N--CA 1.437 -1.119 0 CA-C-N 114.959 -1.018 . . . . 0.0 109.569 179.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -65.97 134.88 38.76 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.517 2.145 . . . . 0.0 112.63 -177.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.606 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -68.55 -16.04 63.74 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -178.863 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.503 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 3.8 p -50.99 -31.31 17.61 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.8 mtpt -61.39 -47.88 83.82 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.241 0.543 . . . . 0.0 110.084 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.6 pp -73.93 -32.32 63.46 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.78 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 46.0 mtm -64.55 -45.47 86.97 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 121.19 0.519 . . . . 0.0 110.743 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? -69.86 -34.94 74.27 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.401 178.276 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.06 -37.38 87.22 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.308 0.575 . . . . 0.0 109.801 179.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -59.92 -55.55 32.71 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.907 177.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.68 ' SG ' HD11 ' A' ' 58' ' ' ILE . 33.1 m -60.46 -44.32 96.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.403 -178.098 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -66.4 -31.51 72.32 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -177.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.411 ' HD3' HG11 ' A' ' 30' ' ' VAL . 11.6 ptm180 -87.02 -36.68 18.07 Favored 'General case' 0 C--N 1.328 -0.352 0 O-C-N 121.853 -0.529 . . . . 0.0 111.095 178.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -77.79 -22.46 50.1 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-O 121.148 0.499 . . . . 0.0 112.041 -177.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.18 38.76 6.64 Favored Glycine 0 N--CA 1.434 -1.479 0 C-N-CA 120.386 -0.911 . . . . 0.0 111.523 -179.088 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -121.09 159.63 25.35 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.124 0.487 . . . . 0.0 110.32 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.473 ' HB2' ' HB2' ' A' ' 57' ' ' GLN . 51.1 m -108.8 148.21 30.89 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 178.201 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.9 mmt -58.35 -30.18 66.54 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-O 121.16 0.505 . . . . 0.0 111.626 179.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.458 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.68 -10.56 55.51 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.136 0.493 . . . . 0.0 111.662 178.35 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.473 ' HB2' ' HB2' ' A' ' 54' ' ' SER . 2.3 mp0 -98.24 -17.19 19.09 Favored 'General case' 0 CA--C 1.504 -0.809 0 CA-C-O 120.96 0.41 . . . . 0.0 111.497 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.68 HD11 ' SG ' ' A' ' 48' ' ' CYS . 17.0 pt -139.68 179.18 2.98 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 CA-C-O 120.937 0.398 . . . . 0.0 110.506 179.235 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.494 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 19.6 mmt-85 -154.43 144.74 22.07 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.097 0.475 . . . . 0.0 111.03 177.473 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -100.22 141.81 32.55 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.262 178.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -142.22 138.9 31.79 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-O 121.155 0.502 . . . . 0.0 110.701 -177.084 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.497 ' HB2' HD11 ' A' ' 67' ' ' ILE . 71.5 t80 -146.16 147.45 31.51 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 179.717 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 54.93 24.48 5.89 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.172 0.589 . . . . 0.0 111.524 -179.174 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.84 3.3 90.63 Favored Glycine 0 N--CA 1.442 -0.961 0 C-N-CA 120.652 -0.785 . . . . 0.0 113.177 179.335 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -121.88 151.49 57.91 Favored Pre-proline 0 C--N 1.317 -0.84 0 O-C-N 121.846 -0.797 . . . . 0.0 110.798 178.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.56 141.24 54.68 Favored 'Trans proline' 0 N--CA 1.459 -0.542 0 C-N-CA 122.259 1.973 . . . . 0.0 111.121 177.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.497 HD11 ' HB2' ' A' ' 62' ' ' PHE . 45.7 mt -90.63 145.01 7.94 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.94 0 CA-C-O 120.816 0.341 . . . . 0.0 110.102 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.541 HD22 ' HB2' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -111.92 157.53 20.55 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 178.034 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.503 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 16.9 pt-20 -71.01 -19.56 62.5 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 121.644 0.735 . . . . 0.0 110.019 179.257 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.2 p -91.27 5.97 47.08 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.878 -178.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . 0.541 ' HB2' HD22 ' A' ' 68' ' ' ASN . 2.9 t70 -93.35 151.53 19.71 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-O 121.001 0.429 . . . . 0.0 110.365 -178.448 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.509 ' HB ' ' OE1' ' A' ' 75' ' ' GLN . 1.7 m -118.62 140.16 27.99 Favored Pre-proline 0 C--N 1.316 -0.867 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.519 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 12.4 Cg_endo -52.55 -32.28 52.87 Favored 'Trans proline' 0 C--N 1.355 0.872 0 C-N-CA 123.657 2.905 . . . . 0.0 113.146 -176.294 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.43 -20.82 64.67 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.098 -177.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.509 ' OE1' ' HB ' ' A' ' 72' ' ' THR . 1.6 mp0 -73.4 -37.35 65.99 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.919 0.39 . . . . 0.0 111.096 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.437 ' H ' HD12 ' A' ' 76' ' ' LEU . 1.0 OUTLIER -88.43 -2.91 58.86 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.92 0.39 . . . . 0.0 110.541 -178.146 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 58.5 34.14 23.68 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.343 0.592 . . . . 0.0 110.884 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.519 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.7 ptm -75.35 160.07 30.71 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.74 -178.573 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -116.4 168.26 10.31 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.582 -175.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -60.95 141.16 57.5 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.774 0.797 . . . . 0.0 111.636 177.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 70.12 17.98 7.13 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.412 -1.267 . . . . 0.0 112.609 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -70.03 156.83 38.59 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 176.332 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 10.5 m -107.83 132.33 53.53 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -174.055 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.722 HG13 HG22 ' A' ' 22' ' ' VAL . 20.8 mm -97.08 142.67 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.555 178.465 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -100.42 117.96 35.67 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 120.637 0.256 . . . . 0.0 110.406 178.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.494 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 47.9 t -112.92 132.92 60.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 CA-C-O 121.124 0.487 . . . . 0.0 110.346 176.069 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 16.6 p90 -131.65 149.04 52.63 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.938 -178.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -73.92 111.34 8.98 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.242 0.544 . . . . 0.0 111.344 -178.559 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.466 ' H ' ' HA ' ' A' ' 58' ' ' ILE . 8.9 mm-40 . . . . . 0 C--N 1.314 -0.963 0 CA-C-O 121.357 0.599 . . . . 0.0 110.444 176.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 52.5 p-80 . . . . . 0 N--CA 1.445 -0.705 0 CA-C-O 121.39 0.614 . . . . 0.0 111.757 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.457 HG13 HD21 ' A' ' 20' ' ' LEU . 32.1 pt -130.87 170.75 19.03 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.297 -179.176 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.429 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 26.3 t-20 -107.12 125.09 50.62 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 116.272 -0.422 . . . . 0.0 109.862 179.181 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.468 HD23 HG12 ' A' ' 34' ' ' ILE . 2.7 mm? -114.72 141.66 47.53 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.824 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -128.37 142.24 51.18 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 -178.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.745 HG22 HG13 ' A' ' 84' ' ' ILE . 57.7 t -122.79 132.75 70.7 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.364 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 -178.049 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.47 124.58 47.96 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 -179.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.516 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -102.66 169.13 19.0 Favored Glycine 0 N--CA 1.431 -1.643 0 C-N-CA 120.086 -1.054 . . . . 0.0 112.737 -178.306 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -61.43 -5.6 1.82 Allowed 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.205 0.602 . . . . 0.0 112.514 178.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -86.36 -21.66 27.09 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.62 0.724 . . . . 0.0 109.683 178.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 104.73 -16.46 47.46 Favored Glycine 0 CA--C 1.491 -1.409 0 N-CA-C 109.957 -1.257 . . . . 0.0 109.957 -178.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.9 m -76.72 131.91 39.02 Favored 'General case' 0 N--CA 1.429 -1.516 0 CA-C-N 114.639 -0.781 . . . . 0.0 111.233 -178.395 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.504 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.1 p -122.17 140.81 44.92 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.896 178.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.466 HG11 ' HD3' ' A' ' 50' ' ' ARG . 10.9 t -121.99 138.46 52.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 -179.192 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -107.18 140.11 40.56 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.041 0.448 . . . . 0.0 111.139 -179.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.496 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 15.5 m-85 . . . . . 0 C--N 1.328 -0.344 0 CA-C-O 121.128 0.49 . . . . 0.0 110.727 -177.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.468 HG12 HD23 ' A' ' 20' ' ' LEU . 24.5 pt . . . . . 0 N--CA 1.465 0.309 0 CA-C-O 121.052 0.453 . . . . 0.0 110.933 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 7.1 mtmp? -80.92 144.87 31.6 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 120.81 0.338 . . . . 0.0 110.693 178.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -68.73 -14.12 62.82 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.186 0.517 . . . . 0.0 111.475 -177.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 -101.76 -3.27 28.4 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-O 122.247 1.022 . . . . 0.0 108.367 -178.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.463 ' HB ' ' O ' ' A' ' 35' ' ' LYS . 1.5 m -93.96 140.33 22.91 Favored Pre-proline 0 N--CA 1.437 -1.082 0 CA-C-N 114.244 -1.343 . . . . 0.0 110.796 -178.715 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.557 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 35.5 Cg_endo -59.71 126.11 19.64 Favored 'Trans proline' 0 C--O 1.238 0.478 0 C-N-CA 122.98 2.453 . . . . 0.0 112.29 -179.346 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.657 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.9 OUTLIER -69.92 -16.55 63.24 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.378 0.609 . . . . 0.0 111.346 179.579 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.474 ' N ' HD12 ' A' ' 40' ' ' LEU . 0.7 OUTLIER -50.53 -31.79 16.57 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 123.919 0.887 . . . . 0.0 111.742 -179.597 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.557 ' HE3' ' HG2' ' A' ' 39' ' ' PRO . 90.6 mttt -59.08 -50.63 73.34 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.431 0.634 . . . . 0.0 109.982 179.293 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.657 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.7 pp -70.17 -32.25 70.12 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.049 -178.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 45.2 mtm -64.71 -50.63 66.18 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 120.786 0.327 . . . . 0.0 111.305 -178.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.474 ' HA ' ' SG ' ' A' ' 48' ' ' CYS . 24.4 mmmt -65.61 -33.81 76.76 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 120.911 0.386 . . . . 0.0 110.469 178.104 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.77 -37.5 87.82 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.136 0.493 . . . . 0.0 109.979 178.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -60.08 -56.41 21.96 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.464 177.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.474 ' SG ' ' HA ' ' A' ' 45' ' ' LYS . 24.5 p -61.88 -35.63 78.89 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 111.814 0.301 . . . . 0.0 111.814 -178.167 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 48.3 mt-10 -66.72 -43.52 84.06 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 122.214 -0.303 . . . . 0.0 111.525 179.59 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.466 ' HD3' HG11 ' A' ' 30' ' ' VAL . 14.0 ptm180 -76.66 -37.28 56.52 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.117 0.484 . . . . 0.0 111.483 -178.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.505 ' HB3' HD23 ' A' ' 53' ' ' LEU . 21.1 mm-40 -74.29 -21.92 59.52 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 120.967 0.413 . . . . 0.0 111.914 -178.561 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.96 42.14 7.78 Favored Glycine 0 N--CA 1.428 -1.882 0 C-N-CA 119.767 -1.206 . . . . 0.0 110.995 -177.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.505 HD23 ' HB3' ' A' ' 51' ' ' GLN . 4.0 mm? -125.05 167.0 15.37 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 51.1 m -116.88 151.67 36.11 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 178.076 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.3 mmt -59.62 -28.12 66.93 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-O 121.197 0.522 . . . . 0.0 111.779 178.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.498 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -84.67 -13.87 50.2 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.58 0.705 . . . . 0.0 110.587 177.646 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -93.48 -17.2 23.7 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.026 -178.618 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 14.3 pt -141.49 179.66 2.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 121.176 0.512 . . . . 0.0 111.426 -179.163 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.469 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 6.1 mmt180 -155.23 140.23 17.35 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.689 177.725 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -97.83 143.02 28.87 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.732 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? -141.8 135.98 30.2 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.556 0.693 . . . . 0.0 111.402 -178.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.459 ' HB2' HD11 ' A' ' 67' ' ' ILE . 78.6 t80 -142.87 146.93 34.57 Favored 'General case' 0 N--CA 1.433 -1.302 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 177.343 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.4 ' C ' ' H ' ' A' ' 65' ' ' GLN . 13.0 t70 50.45 40.69 23.69 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 121.254 0.549 . . . . 0.0 109.906 -176.639 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 66.2 -20.9 0.17 Allowed Glycine 0 CA--C 1.532 1.152 0 N-CA-C 115.462 0.945 . . . . 0.0 115.462 -176.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.537 HE21 HD23 ' A' ' 76' ' ' LEU . 12.6 pt20 -92.81 147.11 33.43 Favored Pre-proline 0 C--N 1.316 -0.867 0 CA-C-N 117.516 0.658 . . . . 0.0 110.944 -177.597 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -69.68 142.51 48.46 Favored 'Trans proline' 0 N--CA 1.452 -0.919 0 C-N-CA 122.146 1.898 . . . . 0.0 110.912 179.34 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.459 HD11 ' HB2' ' A' ' 62' ' ' PHE . 34.4 mt -91.52 144.12 9.86 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.184 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 -178.727 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -121.42 162.7 19.97 Favored 'General case' 0 CA--C 1.499 -0.986 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -178.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -72.73 -13.75 61.4 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 121.244 0.545 . . . . 0.0 110.49 178.339 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 22.0 p -95.07 4.7 53.43 Favored 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 179.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -105.45 154.61 20.1 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.4 0.619 . . . . 0.0 112.01 178.719 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.46 155.49 48.52 Favored Pre-proline 0 C--N 1.319 -0.738 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.978 177.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.615 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 13.2 Cg_endo -57.28 -30.92 89.29 Favored 'Trans proline' 0 C--O 1.236 0.381 0 C-N-CA 122.835 2.357 . . . . 0.0 112.253 -179.329 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.95 -16.57 60.64 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.75 -178.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -73.2 -39.64 65.4 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.375 0.607 . . . . 0.0 110.314 178.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.537 HD23 HE21 ' A' ' 65' ' ' GLN . 1.1 mp -86.05 -2.57 58.44 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.682 179.047 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 59.33 30.84 20.62 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.261 179.077 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.615 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 5.7 ptm -76.55 168.21 20.48 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.031 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -136.59 -178.62 5.25 Favored 'General case' 0 C--N 1.313 -1.004 0 O-C-N 122.167 -0.333 . . . . 0.0 110.65 -177.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.431 ' O ' ' HB2' ' A' ' 81' ' ' GLU . 8.0 p-10 -61.56 141.08 57.99 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.553 0.692 . . . . 0.0 112.121 179.174 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.431 ' HB2' ' O ' ' A' ' 80' ' ' ASP . 4.6 mm-40 80.31 15.93 0.73 Allowed 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.278 1.431 . . . . 0.0 111.531 178.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.412 ' OD2' HD12 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -62.24 146.11 51.76 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.857 176.897 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 17.6 m -114.17 111.73 22.04 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-O 121.822 0.82 . . . . 0.0 112.332 175.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.745 HG13 HG22 ' A' ' 22' ' ' VAL . 14.3 mm -80.82 144.39 10.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 114.955 -1.021 . . . . 0.0 109.741 179.283 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -107.43 123.48 48.46 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 120.962 0.411 . . . . 0.0 110.982 178.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.516 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 86.7 t -113.46 139.04 40.95 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-O 121.205 0.526 . . . . 0.0 110.998 177.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.6 p90 -133.61 150.12 51.6 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.052 179.34 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.55 127.53 33.31 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.741 0.782 . . . . 0.0 112.102 -177.35 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.465 ' HG3' ' HG2' ' A' ' 59' ' ' ARG . 28.2 mm-40 . . . . . 0 C--N 1.315 -0.933 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.563 176.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.423 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 6.0 t-160 . . . . . 0 CA--C 1.493 -1.247 0 CA-C-O 122.139 0.971 . . . . 0.0 108.853 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 45.2 pt -121.52 170.55 11.48 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.215 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.952 -173.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -105.5 135.43 46.91 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.37 178.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.409 HD23 HG12 ' A' ' 34' ' ' ILE . 3.1 mm? -127.25 134.42 50.07 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 177.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -118.51 146.54 44.46 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-O 121.23 0.538 . . . . 0.0 110.14 179.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.571 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 4.8 p -125.09 128.93 73.32 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.897 0 CA-C-N 116.108 -0.497 . . . . 0.0 109.992 -179.705 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -119.52 131.34 55.54 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.223 0.535 . . . . 0.0 109.906 -178.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -107.08 158.02 15.3 Favored Glycine 0 N--CA 1.432 -1.615 0 C-N-CA 120.41 -0.9 . . . . 0.0 111.355 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.19 -18.71 6.3 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 177.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -69.26 -21.88 63.87 Favored 'General case' 0 C--O 1.224 -0.288 0 O-C-N 121.961 -0.462 . . . . 0.0 110.574 177.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 103.79 2.77 46.25 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.043 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.0 t -93.7 159.39 15.23 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 179.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.571 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.6 p -148.97 136.91 14.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.05 0.452 . . . . 0.0 110.662 -179.445 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.8 t -118.93 135.54 59.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -106.72 143.14 35.25 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.824 0.345 . . . . 0.0 110.733 -179.384 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.564 ' HE1' HG12 ' A' ' 22' ' ' VAL . 14.0 m-85 . . . . . 0 N--CA 1.467 0.392 0 CA-C-O 121.167 0.508 . . . . 0.0 110.83 -178.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.409 HG12 HD23 ' A' ' 20' ' ' LEU . 19.4 pt . . . . . 0 N--CA 1.457 -0.111 0 CA-C-O 121.1 0.476 . . . . 0.0 110.826 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.423 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 32.7 mtmm -83.51 150.33 26.06 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 176.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -71.73 -11.07 60.64 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.269 0.556 . . . . 0.0 111.082 -178.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 18.8 t60 -99.16 -2.01 37.93 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.535 0.683 . . . . 0.0 109.636 -178.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -99.33 148.17 34.29 Favored Pre-proline 0 N--CA 1.442 -0.864 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.006 -178.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -65.12 131.53 28.91 Favored 'Trans proline' 0 C--O 1.239 0.553 0 C-N-CA 122.582 2.188 . . . . 0.0 112.509 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.486 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.2 pp -70.28 -16.93 63.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.131 0.491 . . . . 0.0 111.628 179.444 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.486 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 9.0 p -53.16 -28.25 25.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.076 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.0 mtmt -66.1 -42.98 88.55 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 120.861 0.362 . . . . 0.0 110.907 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.7 pp -71.89 -34.3 69.05 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 121.17 0.509 . . . . 0.0 109.794 178.382 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 47.9 mtm -65.07 -46.62 80.39 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 120.997 0.427 . . . . 0.0 110.722 -179.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.488 ' HA ' ' SG ' ' A' ' 48' ' ' CYS . 80.8 mttt -66.76 -36.15 81.77 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 120.855 0.36 . . . . 0.0 110.796 177.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.463 ' O ' ' HG2' ' A' ' 50' ' ' ARG . . . -63.34 -37.88 88.98 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.232 0.539 . . . . 0.0 109.666 178.732 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -61.14 -56.4 21.28 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.945 178.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.488 ' SG ' ' HA ' ' A' ' 45' ' ' LYS . 24.3 p -62.52 -38.65 90.8 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.727 0.298 . . . . 0.0 111.436 -177.435 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -65.95 -37.4 85.93 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 -179.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . 0.463 ' HG2' ' O ' ' A' ' 46' ' ' ALA . 14.7 ptm180 -83.26 -33.25 26.07 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 121.87 -0.519 . . . . 0.0 111.438 -179.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.405 ' HB3' HD23 ' A' ' 53' ' ' LEU . 26.7 mm-40 -78.61 -21.85 47.89 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-O 120.998 0.428 . . . . 0.0 112.053 -178.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.71 39.83 7.46 Favored Glycine 0 N--CA 1.433 -1.531 0 C-N-CA 120.167 -1.016 . . . . 0.0 111.24 -178.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.405 HD23 ' HB3' ' A' ' 51' ' ' GLN . 3.4 mm? -126.37 168.2 14.48 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.013 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.6 m -120.61 157.22 30.01 Favored 'General case' 0 C--N 1.312 -1.041 0 O-C-N 122.264 -0.273 . . . . 0.0 110.647 179.038 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 15.5 mmt -63.13 -26.76 68.97 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.422 0.63 . . . . 0.0 111.457 179.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.493 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.53 -12.99 50.34 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 121.548 0.689 . . . . 0.0 110.437 177.74 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -96.48 -26.03 15.44 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.911 -178.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.3 pt -135.29 176.37 8.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 120.819 0.342 . . . . 0.0 110.714 -179.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.413 ' HD3' ' HA ' ' A' ' 59' ' ' ARG . 17.4 mmt180 -152.88 146.57 25.12 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.209 0.528 . . . . 0.0 111.07 179.018 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -104.6 143.25 33.32 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.439 -177.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.445 ' HG2' ' O ' ' A' ' 65' ' ' GLN . 7.7 tmm_? -143.03 141.31 31.29 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-O 121.172 0.511 . . . . 0.0 110.859 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.536 ' HB2' HD11 ' A' ' 67' ' ' ILE . 69.5 t80 -146.8 147.42 30.87 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 178.45 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 24.8 t70 58.59 23.19 10.62 Favored 'General case' 0 N--CA 1.483 1.182 0 CA-C-O 121.869 0.842 . . . . 0.0 110.728 -178.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.2 1.32 85.48 Favored Glycine 0 N--CA 1.428 -1.835 0 C-N-CA 120.939 -0.648 . . . . 0.0 112.849 -179.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.445 ' O ' ' HG2' ' A' ' 61' ' ' ARG . 12.0 pt20 -116.72 147.44 39.9 Favored Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 122.148 -0.619 . . . . 0.0 110.599 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -67.62 141.05 53.71 Favored 'Trans proline' 0 C--O 1.237 0.431 0 C-N-CA 122.602 2.202 . . . . 0.0 111.824 -179.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.536 HD11 ' HB2' ' A' ' 62' ' ' PHE . 24.1 mt -98.79 141.24 16.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-O 121.049 0.452 . . . . 0.0 110.088 -179.183 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -112.39 170.61 8.05 Favored 'General case' 0 CA--C 1.497 -1.08 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 177.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.486 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 8.9 pt-20 -73.76 -17.01 61.15 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.564 0.697 . . . . 0.0 110.119 177.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 17.6 p -82.96 -21.62 33.97 Favored 'General case' 0 N--CA 1.434 -1.225 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.707 -177.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.64 154.08 32.55 Favored 'General case' 0 N--CA 1.437 -1.11 0 N-CA-C 112.999 0.741 . . . . 0.0 112.999 -178.079 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.412 ' OG1' ' HG2' ' A' ' 75' ' ' GLN . 0.9 OUTLIER -115.31 154.22 47.5 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.892 175.5 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_endo -57.88 -29.3 85.85 Favored 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.981 2.454 . . . . 0.0 111.915 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.83 -20.24 60.51 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.673 -178.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.412 ' HG2' ' OG1' ' A' ' 72' ' ' THR . 27.4 mm-40 -69.52 -37.06 76.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.363 0.602 . . . . 0.0 111.146 179.6 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.438 ' H ' HD12 ' A' ' 76' ' ' LEU . 1.1 mp -88.76 -2.15 58.45 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.204 -178.677 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 53.87 38.14 28.04 Favored 'General case' 0 C--N 1.345 0.388 0 CA-C-O 121.772 0.796 . . . . 0.0 110.985 179.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.1 ptm -77.79 169.49 18.2 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.631 -178.543 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -117.68 169.15 9.81 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -177.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -62.58 142.63 57.92 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 121.64 0.733 . . . . 0.0 111.439 176.481 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 74.71 16.77 3.03 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 124.847 1.259 . . . . 0.0 111.953 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.69 155.4 40.58 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.769 0.318 . . . . 0.0 110.276 176.365 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 84.3 m -111.0 132.15 54.45 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.696 0.76 . . . . 0.0 112.708 -175.543 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.429 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 41.5 mm -96.7 141.93 14.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.341 -0.845 . . . . 0.0 108.906 177.651 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -103.51 124.12 48.17 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 120.957 0.408 . . . . 0.0 110.919 179.233 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 99.0 t -115.28 136.16 52.94 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-O 121.264 0.555 . . . . 0.0 111.113 178.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.4 p90 -135.98 152.95 51.47 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.916 -179.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -80.04 113.91 18.57 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.339 0.59 . . . . 0.0 112.504 -176.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.401 ' HG3' ' CG ' ' A' ' 59' ' ' ARG . 26.3 mm-40 . . . . . 0 C--N 1.318 -0.787 0 CA-C-O 121.359 0.599 . . . . 0.0 111.303 176.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 55.8 p-80 . . . . . 0 N--CA 1.438 -1.065 0 CA-C-O 121.069 0.461 . . . . 0.0 111.042 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 36.5 pt -131.66 164.02 35.69 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-O 121.376 0.608 . . . . 0.0 111.037 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -96.11 136.92 35.93 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.377 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.487 HD23 HG12 ' A' ' 34' ' ' ILE . 3.0 mm? -129.75 139.66 51.25 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 176.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -125.03 144.98 50.12 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-O 121.213 0.53 . . . . 0.0 110.305 -179.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.604 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 5.2 p -122.72 132.06 72.02 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.532 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.551 -178.496 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.1 119.07 33.64 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.376 0.608 . . . . 0.0 110.151 -179.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -96.33 146.5 18.29 Favored Glycine 0 N--CA 1.428 -1.854 0 C-N-CA 120.836 -0.697 . . . . 0.0 111.493 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.486 ' HG3' ' O ' ' A' ' 86' ' ' VAL . 0.0 OUTLIER -53.29 -16.36 1.28 Allowed 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 178.866 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -71.91 -21.37 61.64 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.206 0.527 . . . . 0.0 110.394 177.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 103.71 27.22 6.45 Favored Glycine 0 N--CA 1.443 -0.855 0 N-CA-C 110.651 -0.98 . . . . 0.0 110.651 -178.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.1 p -122.01 131.84 54.21 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-O 120.977 0.418 . . . . 0.0 111.475 -178.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.604 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.4 p -124.08 137.1 58.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 121.161 0.505 . . . . 0.0 111.525 178.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.1 t -120.79 137.16 55.45 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 179.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -107.15 144.16 34.28 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.934 0.397 . . . . 0.0 111.265 -179.394 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.527 ' HE1' HG12 ' A' ' 22' ' ' VAL . 10.6 m-85 . . . . . 0 N--CA 1.466 0.358 0 CA-C-O 121.282 0.563 . . . . 0.0 110.982 -178.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.487 HG12 HD23 ' A' ' 20' ' ' LEU . 33.7 pt . . . . . 0 CA--C 1.516 -0.337 0 CA-C-O 120.829 0.347 . . . . 0.0 110.44 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.511 ' HB2' ' OG1' ' A' ' 38' ' ' THR . 0.0 OUTLIER -79.39 151.74 30.77 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.184 0.516 . . . . 0.0 110.919 179.584 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 36' ' ' ARG . 5.9 ptt180 -67.05 -18.0 65.15 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.384 0.611 . . . . 0.0 110.723 179.258 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 59.8 t60 -102.93 -3.5 26.06 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 122.186 0.993 . . . . 0.0 108.897 -177.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.511 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 2.3 m -90.16 136.01 29.26 Favored Pre-proline 0 C--N 1.306 -1.311 0 CA-C-N 114.502 -1.227 . . . . 0.0 110.473 -178.711 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.45 125.26 15.26 Favored 'Trans proline' 0 C--O 1.24 0.578 0 C-N-CA 122.447 2.098 . . . . 0.0 111.979 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.485 HD12 ' N ' ' A' ' 41' ' ' SER . 1.2 pp -62.61 -17.34 60.04 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.445 0.64 . . . . 0.0 111.303 179.247 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.485 ' N ' HD12 ' A' ' 40' ' ' LEU . 0.7 OUTLIER -51.42 -29.49 16.1 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 124.11 0.964 . . . . 0.0 111.37 179.312 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -62.85 -49.1 76.2 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.618 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.8 pp -68.83 -34.78 76.07 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 120.968 0.413 . . . . 0.0 110.058 179.57 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 48.1 mtm -61.36 -45.92 92.39 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 121.059 0.457 . . . . 0.0 110.447 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.688 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 7.9 mtpm? -69.28 -40.44 77.75 Favored 'General case' 0 C--O 1.212 -0.897 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.642 177.802 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.64 -40.17 82.66 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-O 121.444 0.64 . . . . 0.0 109.83 -179.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 58.8 t80 -56.89 -55.67 31.56 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.224 176.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.664 ' SG ' HD11 ' A' ' 58' ' ' ILE . 21.7 m -61.16 -39.94 91.98 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.87 0.367 . . . . 0.0 110.698 -179.231 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.688 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 69.2 mm-40 -58.75 -49.91 75.89 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 121.274 0.559 . . . . 0.0 111.098 178.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 -77.71 -36.83 50.61 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.805 -176.187 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.465 ' HB3' HD23 ' A' ' 53' ' ' LEU . 23.0 mm-40 -76.25 -22.14 55.51 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -177.506 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.401 ' C ' HD22 ' A' ' 53' ' ' LEU . . . 85.22 42.52 7.0 Favored Glycine 0 N--CA 1.431 -1.659 0 C-N-CA 119.523 -1.323 . . . . 0.0 110.782 -176.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.465 HD23 ' HB3' ' A' ' 51' ' ' GLN . 4.1 mm? -125.16 164.15 20.89 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-O 121.149 0.5 . . . . 0.0 110.157 -179.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.8 m -117.0 154.15 31.41 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.0 mmt -63.88 -25.59 68.23 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-O 121.336 0.589 . . . . 0.0 111.093 179.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.85 -17.89 36.58 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.42 0.628 . . . . 0.0 110.772 177.554 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -88.78 -25.74 22.1 Favored 'General case' 0 CA--C 1.507 -0.697 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.352 -178.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.664 HD11 ' SG ' ' A' ' 48' ' ' CYS . 15.1 pt -136.08 -178.02 2.21 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.088 0 CA-C-O 121.022 0.439 . . . . 0.0 111.344 -179.204 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.438 ' HD3' ' HA ' ' A' ' 59' ' ' ARG . 19.3 mmt180 -157.89 146.9 19.46 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.505 177.222 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -102.77 146.34 28.39 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.151 -178.437 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 8.0 tmm_? -143.58 142.32 31.03 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.545 0.688 . . . . 0.0 111.326 -179.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.58 ' HB2' HD11 ' A' ' 67' ' ' ILE . 65.7 t80 -148.59 148.11 29.78 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 18.5 t70 57.59 22.7 8.47 Favored 'General case' 0 N--CA 1.484 1.273 0 CA-C-O 121.667 0.746 . . . . 0.0 110.978 -177.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.05 11.61 84.66 Favored Glycine 0 N--CA 1.43 -1.744 0 C-N-CA 120.477 -0.868 . . . . 0.0 112.627 -179.005 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -126.87 147.08 59.77 Favored Pre-proline 0 CA--C 1.534 0.338 0 O-C-N 122.222 -0.575 . . . . 0.0 109.891 178.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -66.21 143.34 70.65 Favored 'Trans proline' 0 CA--C 1.532 0.42 0 C-N-CA 122.314 2.01 . . . . 0.0 111.959 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.58 HD11 ' HB2' ' A' ' 62' ' ' PHE . 28.7 mt -97.7 148.84 5.43 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-O 120.95 0.405 . . . . 0.0 110.244 -178.484 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -125.79 169.96 12.08 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 178.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -77.19 -8.72 58.02 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-O 121.316 0.579 . . . . 0.0 110.311 177.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 41.0 p -91.12 -3.65 56.9 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.34 179.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -100.52 148.4 24.83 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.413 0.625 . . . . 0.0 112.173 -179.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -111.8 157.26 40.01 Favored Pre-proline 0 C--N 1.323 -0.559 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.766 178.137 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.583 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 18.0 Cg_endo -60.32 -31.24 92.59 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.733 2.289 . . . . 0.0 111.595 178.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -77.91 -11.02 59.86 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.555 -179.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . 0.471 ' NE2' ' HA ' ' A' ' 75' ' ' GLN . 8.6 tp60 -71.44 -48.37 49.95 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 121.638 0.732 . . . . 0.0 110.118 -179.465 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.498 ' H ' HD12 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -86.11 0.46 53.45 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.364 -178.169 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 51.98 44.17 29.71 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 121.731 0.777 . . . . 0.0 110.674 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.583 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.0 ptm -76.35 158.81 31.1 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.956 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -108.84 167.11 10.31 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-O 120.804 0.335 . . . . 0.0 110.577 -176.008 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -52.08 137.63 27.11 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.326 0.584 . . . . 0.0 111.443 174.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 67.65 23.76 8.66 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.083 -0.962 . . . . 0.0 112.482 178.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.98 150.41 47.72 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 175.307 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 28.8 m -106.31 126.75 52.62 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 121.558 0.694 . . . . 0.0 112.807 -174.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.439 HD11 ' HE1' ' A' ' 78' ' ' MET . 42.0 mm -93.06 140.93 15.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 176.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -106.36 123.33 47.9 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-O 121.054 0.454 . . . . 0.0 110.916 179.102 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.486 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 85.9 t -111.38 137.08 45.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.029 0.442 . . . . 0.0 111.193 179.682 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.2 p90 -134.3 152.87 52.05 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.855 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -77.31 118.56 19.91 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.516 0.674 . . . . 0.0 111.507 -178.106 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.434 ' HG3' ' CG ' ' A' ' 59' ' ' ARG . 55.5 mm-40 . . . . . 0 C--N 1.313 -0.998 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.075 178.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.9 tpt . . . . . 0 N--CA 1.479 0.975 0 CA-C-O 120.697 0.284 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.543 ' HA ' ' O ' ' A' ' 5' ' ' LYS . . . -78.38 -8.58 58.61 Favored 'General case' 0 N--CA 1.466 0.333 0 O-C-N 121.701 -0.624 . . . . 0.0 111.637 -178.025 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -83.24 -2.2 55.0 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.714 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -136.27 -29.52 0.98 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.162 0.506 . . . . 0.0 111.366 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.543 ' O ' ' HA ' ' A' ' 2' ' ' ALA . 59.2 tttp -136.95 129.93 17.37 Favored Pre-proline 0 C--N 1.314 -0.937 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -64.94 171.77 8.23 Favored 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.42 2.08 . . . . 0.0 111.758 177.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.518 ' HD2' ' H ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -70.55 -3.91 20.39 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.109 178.424 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -66.44 162.96 19.39 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-O 121.142 0.496 . . . . 0.0 110.897 -178.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -90.81 -67.45 1.18 Allowed Glycine 0 N--CA 1.437 -1.294 0 C-N-CA 120.415 -0.898 . . . . 0.0 111.912 -177.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 38.3 t -98.75 108.12 21.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 120.952 0.406 . . . . 0.0 111.277 -178.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.453 ' HD3' ' HA ' ' A' ' 11' ' ' LYS . 24.0 mmtp -150.58 143.95 24.98 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 121.029 0.442 . . . . 0.0 109.959 176.443 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.6 t -154.35 158.9 40.79 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.153 -177.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.5 mm-40 -132.97 75.61 1.63 Allowed 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.128 0.49 . . . . 0.0 110.214 178.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -87.2 12.14 12.41 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-O 121.6 0.714 . . . . 0.0 109.794 178.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 -61.87 170.82 1.89 Allowed 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.275 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -84.37 90.75 7.64 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-O 121.801 0.81 . . . . 0.0 109.191 -178.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.559 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 43.7 p-80 -109.8 134.44 52.03 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.465 -179.268 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 40.5 pt -119.26 162.14 17.75 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.838 0 CA-C-O 121.634 0.73 . . . . 0.0 111.375 -176.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.513 ' HA ' ' O ' ' A' ' 32' ' ' PHE . 23.7 t-20 -100.11 132.88 45.21 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.27 178.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -122.6 134.56 54.51 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-O 121.102 0.477 . . . . 0.0 109.793 177.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.412 ' HG2' ' HG3' ' A' ' 31' ' ' GLN . 48.3 mtmt -117.39 144.41 44.99 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.695 HG22 HG13 ' A' ' 84' ' ' ILE . 90.5 t -124.86 134.98 65.48 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.705 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -177.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -117.08 130.11 56.43 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.171 0.51 . . . . 0.0 110.819 -178.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -101.69 178.32 27.32 Favored Glycine 0 N--CA 1.43 -1.71 0 C-N-CA 121.036 -0.602 . . . . 0.0 111.896 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.673 ' H ' ' NE2' ' A' ' 25' ' ' GLN . 0.5 OUTLIER -60.52 -31.74 70.8 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.76 0.791 . . . . 0.0 110.592 -179.002 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -71.33 -16.0 62.42 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.285 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 90.31 5.95 69.27 Favored Glycine 0 N--CA 1.446 -0.684 0 N-CA-C 110.944 -0.862 . . . . 0.0 110.944 -175.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 9.2 t -80.84 126.45 31.36 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.622 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 28.3 t -120.42 138.84 49.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 CA-C-O 121.272 0.558 . . . . 0.0 110.878 -178.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.8 t -122.12 136.85 57.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 177.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.413 ' HB3' HD21 ' A' ' 19' ' ' ASN . 0.4 OUTLIER -104.74 143.82 32.58 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.742 0.306 . . . . 0.0 110.562 -179.586 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.513 ' O ' ' HA ' ' A' ' 19' ' ' ASN . 14.4 m-85 -137.32 151.52 48.72 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 120.808 0.337 . . . . 0.0 110.702 -179.138 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.458 HD13 HD23 ' A' ' 43' ' ' LEU . 36.6 pt -132.28 167.03 27.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 O-C-N 122.06 -0.4 . . . . 0.0 111.007 -178.038 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.559 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 0.0 OUTLIER -80.7 153.28 27.95 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 121.123 0.487 . . . . 0.0 110.641 178.456 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 23.5 ptt180 -63.43 -19.37 64.64 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.762 -179.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 67.1 t60 -104.3 -3.55 24.07 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 122.161 0.981 . . . . 0.0 108.728 -176.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 m -86.68 132.32 42.81 Favored Pre-proline 0 N--CA 1.43 -1.441 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.96 179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -59.91 122.07 10.83 Favored 'Trans proline' 0 C--O 1.239 0.565 0 C-N-CA 122.482 2.121 . . . . 0.0 112.413 -178.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.658 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.9 OUTLIER -63.37 -17.23 62.4 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.375 0.607 . . . . 0.0 111.102 179.075 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.491 ' N ' HD12 ' A' ' 40' ' ' LEU . 0.8 OUTLIER -50.69 -34.68 27.62 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 123.974 0.91 . . . . 0.0 111.211 179.193 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.3 mtpm? -59.15 -51.42 70.11 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.361 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.658 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.3 pp -68.72 -34.54 75.81 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.738 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 48.2 mtm -63.01 -51.18 67.8 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-O 121.152 0.501 . . . . 0.0 110.863 -179.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -66.58 -34.59 78.22 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-O 121.021 0.438 . . . . 0.0 110.932 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.23 -36.52 84.36 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.08 0.467 . . . . 0.0 110.022 177.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -59.92 -55.63 31.68 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.672 178.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 26.5 p -65.12 -34.98 79.69 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 122.097 -0.377 . . . . 0.0 111.557 -177.098 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -65.89 -38.64 89.3 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.93 0.395 . . . . 0.0 111.751 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -85.27 -30.18 24.0 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.009 0.433 . . . . 0.0 111.165 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -82.66 -21.65 34.91 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -177.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 87.9 40.45 6.66 Favored Glycine 0 N--CA 1.437 -1.272 0 C-N-CA 119.882 -1.152 . . . . 0.0 111.198 -177.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.406 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 4.0 mm? -123.34 161.88 23.82 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.879 0.371 . . . . 0.0 110.262 179.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.459 ' HB2' ' HB2' ' A' ' 57' ' ' GLN . 48.3 m -114.79 150.07 35.99 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 110.346 -0.242 . . . . 0.0 110.346 178.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.2 mmt -64.44 -23.95 67.46 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.216 0.532 . . . . 0.0 111.508 178.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.425 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -84.41 -17.48 39.15 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.306 0.574 . . . . 0.0 110.368 176.922 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.459 ' HB2' ' HB2' ' A' ' 54' ' ' SER . 2.4 mp0 -93.31 -30.13 15.29 Favored 'General case' 0 CA--C 1.507 -0.696 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.896 -178.286 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.7 pt -128.57 178.35 5.06 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.249 0 CA-C-O 121.39 0.614 . . . . 0.0 111.862 -178.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.405 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 15.5 mmt180 -156.55 142.54 18.0 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.394 177.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -97.36 148.3 23.3 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -147.65 134.75 20.39 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-O 121.245 0.545 . . . . 0.0 111.087 -176.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.492 ' HB2' HD11 ' A' ' 67' ' ' ILE . 69.2 t80 -141.41 147.86 38.66 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.44 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 17.3 t70 55.94 23.52 6.71 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-O 121.826 0.822 . . . . 0.0 110.32 -176.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.58 -21.63 21.09 Favored Glycine 0 N--CA 1.423 -2.21 0 CA-C-N 115.7 -0.682 . . . . 0.0 112.638 -179.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.427 HE21 HD23 ' A' ' 76' ' ' LEU . 12.4 pt20 -95.31 149.07 35.64 Favored Pre-proline 0 C--N 1.324 -0.54 0 O-C-N 122.518 -0.401 . . . . 0.0 111.502 -177.572 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -70.96 142.95 43.84 Favored 'Trans proline' 0 C--O 1.235 0.351 0 C-N-CA 122.776 2.317 . . . . 0.0 112.138 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.492 HD11 ' HB2' ' A' ' 62' ' ' PHE . 15.9 mt -99.0 147.28 7.16 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-O 120.983 0.421 . . . . 0.0 110.825 -179.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -128.24 172.95 10.56 Favored 'General case' 0 CA--C 1.507 -0.673 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 178.356 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -75.01 -8.08 55.5 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.235 0.541 . . . . 0.0 110.984 177.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 26.2 p -93.45 -4.17 51.77 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.276 0.56 . . . . 0.0 111.141 178.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -94.68 144.51 25.56 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.487 0.661 . . . . 0.0 112.006 179.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -117.46 149.41 44.72 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.686 177.119 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.403 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 17.8 Cg_endo -59.71 -31.32 94.0 Favored 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.939 2.426 . . . . 0.0 113.469 -175.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.28 -23.05 63.78 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -178.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 6.1 mp0 -69.86 -37.35 76.09 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.098 0.475 . . . . 0.0 111.125 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.439 ' H ' HD12 ' A' ' 76' ' ' LEU . 1.2 mp -86.48 -5.21 59.21 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 -178.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 55.96 44.48 25.57 Favored 'General case' 0 C--N 1.344 0.332 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.514 179.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.403 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 5.8 ptm -86.12 161.35 18.93 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.003 -177.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -112.18 164.94 12.61 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 -178.112 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.452 ' CB ' ' H ' ' A' ' 19' ' ' ASN . 6.2 p-10 -62.48 144.77 55.59 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.654 0.74 . . . . 0.0 112.137 176.565 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 73.82 17.9 3.47 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.282 -1.326 . . . . 0.0 112.109 179.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.5 t0 -78.19 164.42 24.95 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 120.303 -0.559 . . . . 0.0 109.731 176.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 21.0 m -114.21 138.15 50.84 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.611 0.72 . . . . 0.0 112.868 -175.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.695 HG13 HG22 ' A' ' 22' ' ' VAL . 19.7 mm -99.18 139.34 21.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.443 -0.798 . . . . 0.0 109.858 178.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -98.32 116.78 31.26 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 120.981 0.42 . . . . 0.0 110.76 179.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.438 HG12 HE22 ' A' ' 25' ' ' GLN . 73.4 t -111.03 137.87 41.68 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.12 0 CA-C-O 121.189 0.519 . . . . 0.0 110.133 177.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.8 p90 -136.52 156.7 48.22 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.858 -178.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.95 116.05 23.94 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.436 0.636 . . . . 0.0 111.443 -177.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -100.8 20.04 16.04 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.604 177.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -61.57 110.5 1.5 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.866 -178.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 85.7 m -151.49 112.76 4.33 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.004 0.431 . . . . 0.0 110.487 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 158.42 -130.08 2.45 Favored Glycine 0 N--CA 1.444 -0.827 0 C-N-CA 120.824 -0.703 . . . . 0.0 111.712 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.121 0 CA-C-O 118.461 -1.188 . . . . 0.0 111.396 179.083 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.7 ttt . . . . . 0 N--CA 1.48 1.026 0 CA-C-O 120.963 0.411 . . . . 0.0 111.814 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -133.05 90.36 2.74 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -97.81 -18.27 18.85 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -175.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.48 127.07 31.67 Favored 'General case' 0 C--N 1.318 -0.772 0 O-C-N 122.039 -0.413 . . . . 0.0 111.2 178.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt 70.31 101.61 0.04 OUTLIER Pre-proline 0 N--CA 1.467 0.378 0 C-N-CA 123.598 0.759 . . . . 0.0 111.729 178.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.503 ' HD2' ' HG3' ' A' ' 11' ' ' LYS . 56.6 Cg_endo -91.22 -158.81 0.07 OUTLIER 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 123.191 2.594 . . . . 0.0 111.155 178.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.423 ' HD2' ' N ' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -55.38 -18.25 6.36 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 176.185 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.423 ' N ' ' HD2' ' A' ' 7' ' ' LYS . 44.1 mt-10 -74.47 162.22 29.03 Favored 'General case' 0 C--O 1.234 0.279 0 O-C-N 122.065 -0.397 . . . . 0.0 110.339 177.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -84.4 -85.23 0.93 Allowed Glycine 0 N--CA 1.441 -0.984 0 C-N-CA 120.293 -0.956 . . . . 0.0 113.911 -174.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 46.9 t -81.57 97.47 3.69 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.012 0 CA-C-O 121.485 0.66 . . . . 0.0 111.794 -174.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.503 ' HG3' ' HD2' ' A' ' 6' ' ' PRO . 69.8 mmtt -120.35 98.66 6.16 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 121.391 0.615 . . . . 0.0 110.287 176.624 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 5.7 t -147.32 144.8 29.05 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.523 -178.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.06 14.26 20.44 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.49 0.662 . . . . 0.0 111.127 -177.48 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -74.67 -17.0 60.75 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.302 0.573 . . . . 0.0 109.937 179.486 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -92.21 4.35 53.42 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.683 0.754 . . . . 0.0 109.541 178.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.492 ' OD1' ' HG3' ' A' ' 36' ' ' ARG . 6.1 t70 -140.74 -165.06 1.86 Allowed 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 108.558 -0.905 . . . . 0.0 108.558 -179.293 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 0.3 OUTLIER 76.26 137.14 0.06 Allowed 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.261 1.424 . . . . 0.0 112.341 177.062 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.525 HG13 HD21 ' A' ' 20' ' ' LEU . 39.6 pt -131.95 171.03 18.71 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.212 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.159 -177.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.519 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 24.8 t-20 -102.52 126.96 49.76 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-O 120.881 0.372 . . . . 0.0 110.162 179.096 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.609 HD23 HG12 ' A' ' 34' ' ' ILE . 2.7 mm? -118.84 141.54 48.55 Favored 'General case' 0 C--N 1.301 -1.518 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 177.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.422 ' HE2' ' HA ' ' A' ' 81' ' ' GLU . 49.4 mtmt -128.78 141.25 51.37 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-O 121.725 0.774 . . . . 0.0 110.814 -178.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.624 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 3.6 p -120.8 127.61 75.96 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.943 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.262 -177.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -120.83 131.91 54.71 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-O 121.19 0.519 . . . . 0.0 110.052 -179.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -109.19 148.01 16.94 Favored Glycine 0 N--CA 1.426 -1.98 0 C-N-CA 120.519 -0.848 . . . . 0.0 111.241 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.51 ' HG3' ' O ' ' A' ' 86' ' ' VAL . 0.0 OUTLIER -53.56 -12.31 0.46 Allowed 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 179.261 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -73.55 -21.88 60.24 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.505 0.669 . . . . 0.0 110.219 176.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.86 30.15 4.66 Favored Glycine 0 CA--C 1.501 -0.812 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.398 176.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 12.0 p -124.25 157.93 33.69 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 120.857 0.36 . . . . 0.0 110.735 179.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.624 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.7 p -149.55 139.2 15.87 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-O 121.116 0.484 . . . . 0.0 111.266 -178.263 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.468 HG11 ' HD3' ' A' ' 50' ' ' ARG . 6.4 t -122.88 138.03 54.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.204 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -108.17 144.83 35.05 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.827 0.346 . . . . 0.0 110.553 179.766 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.548 ' HE1' HG12 ' A' ' 22' ' ' VAL . 7.0 m-85 -139.54 152.11 46.65 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 120.898 0.38 . . . . 0.0 110.567 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.609 HG12 HD23 ' A' ' 20' ' ' LEU . 21.2 pt -126.52 166.3 23.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.837 0.351 . . . . 0.0 110.514 -176.502 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 9.5 mptt -75.6 150.8 37.95 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.492 ' HG3' ' OD1' ' A' ' 16' ' ' ASP . 4.2 ppt_? -71.79 -12.91 61.53 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 121.194 0.521 . . . . 0.0 110.951 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 75.5 t60 -103.1 -4.44 24.5 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 122.115 0.96 . . . . 0.0 108.669 179.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.533 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.8 m -86.39 135.23 36.77 Favored Pre-proline 0 C--N 1.304 -1.386 0 CA-C-N 114.799 -1.092 . . . . 0.0 110.241 -178.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -59.48 124.21 15.01 Favored 'Trans proline' 0 C--O 1.236 0.399 0 C-N-CA 122.668 2.245 . . . . 0.0 112.326 -179.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.6 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.2 pp -66.13 -17.19 64.56 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.298 0.571 . . . . 0.0 111.688 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.478 ' N ' HD12 ' A' ' 40' ' ' LEU . 3.3 p -54.25 -29.34 46.4 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.895 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -64.24 -40.99 97.16 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.461 -179.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.0 pp -73.28 -33.66 65.36 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.055 0.455 . . . . 0.0 110.074 178.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 51.6 mtm -65.66 -49.81 67.25 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.941 -178.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.41 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 38.0 mttp -67.75 -35.4 78.66 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 120.545 -0.462 . . . . 0.0 110.624 178.714 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.22 -32.02 73.44 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 121.146 0.498 . . . . 0.0 109.988 178.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -64.11 -55.95 18.35 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.609 178.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 17.6 p -63.16 -36.11 82.54 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.841 0.353 . . . . 0.0 111.194 -177.451 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 43.9 mt-10 -67.12 -40.35 86.8 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.92 0.391 . . . . 0.0 111.711 -179.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.468 ' HD3' HG11 ' A' ' 30' ' ' VAL . 10.3 ptm180 -84.64 -31.28 24.3 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 122.02 -0.425 . . . . 0.0 111.84 -177.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.3 mm-40 -80.7 -22.53 40.27 Favored 'General case' 0 CA--C 1.508 -0.672 0 CA-C-O 121.006 0.431 . . . . 0.0 111.747 -178.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.401 ' C ' HD22 ' A' ' 53' ' ' LEU . . . 88.32 40.98 6.3 Favored Glycine 0 N--CA 1.431 -1.691 0 C-N-CA 120.153 -1.022 . . . . 0.0 111.249 -178.124 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.454 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 3.9 mm? -125.09 166.38 16.51 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.878 -0.415 . . . . 0.0 109.878 179.404 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 57.4 m -117.03 152.95 33.57 Favored 'General case' 0 C--N 1.316 -0.856 0 O-C-N 122.218 -0.301 . . . . 0.0 110.285 178.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 12.9 mmt -61.28 -27.44 68.47 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-O 121.213 0.53 . . . . 0.0 111.566 178.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.76 -12.34 53.92 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.518 0.675 . . . . 0.0 110.49 176.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -96.82 -16.87 20.57 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.159 -178.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.6 pt -140.37 176.75 4.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-O 121.204 0.526 . . . . 0.0 111.32 -179.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.553 ' CG ' ' HG3' ' A' ' 89' ' ' GLN . 3.3 mmt85 -151.53 140.15 20.7 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.914 178.539 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -101.39 138.77 37.96 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.415 -178.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 4.9 ttt180 -140.11 146.96 39.55 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.055 -178.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.532 ' HB2' HD11 ' A' ' 67' ' ' ILE . 78.3 t80 -152.57 143.82 23.22 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 178.253 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 54.71 24.87 5.92 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 121.351 0.596 . . . . 0.0 111.355 -178.193 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 91.38 -21.96 32.44 Favored Glycine 0 N--CA 1.443 -0.896 0 CA-C-N 116.161 -0.472 . . . . 0.0 113.141 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.532 HE21 HD23 ' A' ' 76' ' ' LEU . 8.6 pt20 -98.84 151.59 37.47 Favored Pre-proline 0 C--N 1.321 -0.639 0 O-C-N 122.434 -0.45 . . . . 0.0 111.52 -177.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -71.27 139.61 35.47 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.499 2.132 . . . . 0.0 111.36 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.532 HD11 ' HB2' ' A' ' 62' ' ' PHE . 39.0 mt -89.58 147.22 5.35 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-O 120.839 0.352 . . . . 0.0 110.418 -179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.461 HD22 ' HB2' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -114.84 156.83 24.2 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 178.0 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.461 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 14.6 pt-20 -73.25 -12.08 60.73 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.547 0.689 . . . . 0.0 110.997 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 16.4 p -97.61 14.24 27.34 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.344 177.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.461 ' HB2' HD22 ' A' ' 68' ' ' ASN . 2.8 t70 -98.04 151.69 20.08 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.123 0.487 . . . . 0.0 110.817 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.452 ' CG2' ' HD2' ' A' ' 73' ' ' PRO . 1.6 m -113.57 141.02 25.26 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 109.376 -0.602 . . . . 0.0 109.376 178.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.484 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 16.2 Cg_endo -54.39 -34.03 79.33 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 123.01 2.474 . . . . 0.0 112.263 -178.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.69 -16.14 63.29 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.865 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 24.8 mm-40 -74.62 -37.49 62.8 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.093 0.473 . . . . 0.0 111.079 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.532 HD23 HE21 ' A' ' 65' ' ' GLN . 1.0 OUTLIER -86.86 -1.24 57.65 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.222 -178.24 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 60.0 mm-40 58.4 33.56 23.23 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.562 0.696 . . . . 0.0 110.887 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.484 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.1 ptm -78.83 161.28 26.89 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.967 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -125.17 174.4 8.1 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 -178.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.519 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 7.0 p-10 -57.11 144.01 36.38 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 121.438 0.637 . . . . 0.0 112.08 177.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.422 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 58.2 mm-40 77.44 19.64 1.22 Allowed 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 124.901 1.28 . . . . 0.0 111.526 178.091 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -62.27 150.57 38.83 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.109 177.404 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 16.5 m -112.61 114.21 26.72 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 121.271 0.557 . . . . 0.0 112.053 175.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.499 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 28.9 mm -81.54 142.16 14.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.322 177.223 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -100.07 116.23 31.61 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-O 120.615 0.245 . . . . 0.0 111.102 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.51 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 67.6 t -114.71 135.66 53.86 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-O 121.041 0.448 . . . . 0.0 110.762 177.225 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.434 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 10.7 p90 -135.5 153.77 51.63 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.931 -179.248 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.35 120.92 23.04 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.456 0.646 . . . . 0.0 112.11 -175.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.553 ' HG3' ' CG ' ' A' ' 59' ' ' ARG . 30.3 mm-40 -110.43 19.14 19.09 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.686 177.329 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -51.09 -39.42 56.05 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.124 0.487 . . . . 0.0 110.8 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 86.4 m -87.36 112.26 21.93 Favored 'General case' 0 N--CA 1.437 -1.1 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 176.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 71.61 62.77 3.3 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 121.125 -0.56 . . . . 0.0 112.315 -177.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.177 0 CA-C-O 118.679 -1.067 . . . . 0.0 111.814 -179.186 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.6 ptt? . . . . . 0 N--CA 1.483 1.185 0 CA-C-O 120.871 0.367 . . . . 0.0 111.431 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -107.64 37.37 2.44 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.707 0.765 . . . . 0.0 109.658 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -68.42 -28.39 67.03 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.358 -177.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -64.92 -67.97 0.4 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.682 -178.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -160.2 154.11 19.46 Favored Pre-proline 0 C--N 1.311 -1.105 0 CA-C-N 116.651 -0.249 . . . . 0.0 110.879 -178.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -81.72 -166.02 0.37 Allowed 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.616 2.21 . . . . 0.0 112.073 176.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -123.5 20.19 9.56 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.48 0.657 . . . . 0.0 110.717 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -131.75 176.5 8.29 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.887 -177.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 86.9 -81.66 1.67 Allowed Glycine 0 N--CA 1.435 -1.377 0 N-CA-C 109.84 -1.304 . . . . 0.0 109.84 -178.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 58.1 t -136.29 122.46 30.21 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.58 0 N-CA-C 108.288 -1.004 . . . . 0.0 108.288 177.269 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.489 ' C ' ' HD2' ' A' ' 11' ' ' LYS . 3.4 tmmm? -137.95 138.89 39.4 Favored 'General case' 0 N--CA 1.428 -1.542 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 -175.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.474 ' N ' ' HD2' ' A' ' 11' ' ' LYS . 0.5 OUTLIER -145.17 139.73 27.45 Favored 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 177.534 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -151.27 163.06 39.76 Favored 'General case' 0 C--N 1.309 -1.173 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 179.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -89.66 11.99 18.18 Favored 'General case' 0 C--N 1.317 -0.834 0 O-C-N 122.106 -0.371 . . . . 0.0 111.081 -174.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 12.8 m120 63.4 25.89 14.73 Favored 'General case' 0 CA--C 1.515 -0.375 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 -174.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -74.78 103.66 5.12 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 113.635 -1.621 . . . . 0.0 109.008 -179.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.591 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 38.8 p-80 -123.37 161.38 24.83 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.609 -173.074 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.483 HG13 HD21 ' A' ' 20' ' ' LEU . 29.7 pt -132.86 170.13 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.244 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.64 178.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.499 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 27.5 t-20 -105.2 129.42 53.58 Favored 'General case' 0 C--N 1.306 -1.313 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 178.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.557 HD23 HG12 ' A' ' 34' ' ' ILE . 2.7 mm? -117.38 142.48 47.06 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -127.56 140.59 52.02 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-O 121.477 0.655 . . . . 0.0 110.155 -179.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.618 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 2.7 p -120.89 126.12 74.85 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.035 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.808 -176.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -115.2 128.22 56.02 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.263 0.554 . . . . 0.0 110.154 -178.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.458 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -99.87 158.66 19.65 Favored Glycine 0 N--CA 1.43 -1.714 0 C-N-CA 120.335 -0.936 . . . . 0.0 111.312 179.421 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.67 -16.49 1.66 Allowed 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 177.668 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -77.38 -21.6 52.97 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.458 0.647 . . . . 0.0 110.844 178.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.01 -8.55 45.77 Favored Glycine 0 N--CA 1.444 -0.796 0 C-N-CA 120.915 -0.659 . . . . 0.0 111.928 -178.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 30.9 t -78.85 153.99 30.17 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.618 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.7 p -149.75 140.57 16.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 120.875 0.369 . . . . 0.0 111.071 -177.404 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.55 HG11 ' HD3' ' A' ' 50' ' ' ARG . 4.7 t -123.2 139.59 49.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -108.82 142.34 39.54 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.842 0.353 . . . . 0.0 110.674 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.556 ' HE1' HG12 ' A' ' 22' ' ' VAL . 16.7 m-85 -136.4 154.05 50.92 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 121.289 0.566 . . . . 0.0 111.293 -177.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.557 HG12 HD23 ' A' ' 20' ' ' LEU . 27.2 pt -134.0 162.37 39.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 120.844 0.354 . . . . 0.0 110.097 -178.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.591 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 0.0 OUTLIER -77.34 150.01 35.22 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.553 179.843 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 3.4 ppt_? -70.41 -8.35 50.15 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.673 0.749 . . . . 0.0 110.211 179.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 30.1 t-80 -104.48 -8.22 19.25 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 -179.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.406 ' HB ' ' O ' ' A' ' 35' ' ' LYS . 1.2 m -87.16 137.9 32.72 Favored Pre-proline 0 N--CA 1.44 -0.956 0 CA-C-N 114.784 -1.098 . . . . 0.0 110.108 179.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -60.7 126.48 19.9 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.374 2.05 . . . . 0.0 112.176 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.512 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.3 pp -67.21 -17.75 64.95 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -178.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.469 ' N ' HD12 ' A' ' 40' ' ' LEU . 2.8 p -55.89 -28.86 58.63 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.886 0.374 . . . . 0.0 111.831 -179.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -60.29 -46.24 90.54 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 120.928 0.394 . . . . 0.0 110.375 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.8 pp -71.83 -35.65 69.95 Favored 'General case' 0 CA--C 1.52 -0.193 0 CA-C-O 121.043 0.449 . . . . 0.0 110.436 179.27 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 47.6 mtm -63.07 -46.01 89.46 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.18 0.514 . . . . 0.0 110.863 -178.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.5 mtpm? -69.84 -37.05 76.05 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.44 178.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.415 ' O ' ' HG2' ' A' ' 50' ' ' ARG . . . -62.27 -37.76 86.72 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.157 0.503 . . . . 0.0 109.945 178.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -58.42 -55.64 32.44 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.184 177.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.611 ' SG ' HD11 ' A' ' 58' ' ' ILE . 22.5 m -60.24 -44.93 94.81 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.339 0.59 . . . . 0.0 110.741 -177.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -67.32 -30.85 70.8 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 112.824 0.676 . . . . 0.0 112.824 -176.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.55 ' HD3' HG11 ' A' ' 30' ' ' VAL . 13.8 ptm180 -90.65 -34.06 15.58 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.823 -0.548 . . . . 0.0 111.551 179.141 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 21.4 mm-40 -78.52 -21.82 48.27 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 121.154 0.502 . . . . 0.0 111.924 -178.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.82 39.83 6.45 Favored Glycine 0 N--CA 1.432 -1.614 0 C-N-CA 119.947 -1.12 . . . . 0.0 110.933 -177.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -123.81 166.18 16.04 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 9.7 m -118.31 155.27 30.93 Favored 'General case' 0 C--N 1.307 -1.254 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 178.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.6 mmt -61.93 -28.16 69.34 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-O 121.451 0.644 . . . . 0.0 111.185 177.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.27 -17.89 38.19 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.44 0.638 . . . . 0.0 110.841 177.537 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.402 ' OE1' ' HB2' ' A' ' 90' ' ' GLN . 2.8 mp0 -88.58 -25.8 22.28 Favored 'General case' 0 CA--C 1.504 -0.807 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.815 -177.512 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.611 HD11 ' SG ' ' A' ' 48' ' ' CYS . 12.0 pt -133.27 178.65 5.32 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.157 0 CA-C-O 121.497 0.665 . . . . 0.0 112.532 -178.273 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 6.7 mmt180 -148.4 139.4 23.13 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.303 177.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -99.69 141.68 32.17 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.886 179.224 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -142.33 143.79 32.91 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-O 121.006 0.431 . . . . 0.0 110.937 -176.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.454 ' HB2' HD11 ' A' ' 67' ' ' ILE . 73.0 t80 -149.28 146.21 27.45 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.646 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 17.9 t70 56.82 22.83 7.39 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-O 121.778 0.799 . . . . 0.0 110.481 -178.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.19 -21.05 26.44 Favored Glycine 0 N--CA 1.429 -1.817 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.562 -179.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -95.72 156.46 37.34 Favored Pre-proline 0 C--N 1.329 -0.313 0 O-C-N 122.575 -0.368 . . . . 0.0 111.131 -178.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -77.17 142.04 21.24 Favored 'Trans proline' 0 N--CA 1.456 -0.728 0 C-N-CA 122.496 2.131 . . . . 0.0 111.589 178.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.454 HD11 ' HB2' ' A' ' 62' ' ' PHE . 38.8 mt -90.04 153.41 3.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 120.949 0.404 . . . . 0.0 110.589 -178.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.57 HD22 ' HB2' ' A' ' 71' ' ' ASP . 0.1 OUTLIER -116.38 162.82 16.95 Favored 'General case' 0 CA--C 1.498 -1.038 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 178.889 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.496 ' H ' ' CD ' ' A' ' 69' ' ' GLU . 0.8 OUTLIER -75.27 -18.82 59.99 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-O 121.39 0.614 . . . . 0.0 110.349 178.984 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 8.3 t -98.96 11.97 37.33 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.375 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.57 ' HB2' HD22 ' A' ' 68' ' ' ASN . 0.9 OUTLIER -95.53 154.09 17.38 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-O 120.959 0.409 . . . . 0.0 110.596 -179.594 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -114.03 147.83 38.66 Favored Pre-proline 0 C--N 1.316 -0.891 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.249 178.575 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.547 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 18.6 Cg_endo -58.91 -28.65 88.1 Favored 'Trans proline' 0 C--O 1.238 0.514 0 C-N-CA 122.79 2.327 . . . . 0.0 112.018 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -77.91 -14.77 59.44 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.506 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.8 tp60 -68.32 -42.35 79.5 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.653 0.74 . . . . 0.0 109.56 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.449 ' H ' HD12 ' A' ' 76' ' ' LEU . 0.4 OUTLIER -91.05 -1.8 57.74 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.262 -0.881 . . . . 0.0 110.146 -179.472 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 56.94 34.75 25.37 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.277 179.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.547 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 4.7 ptm -68.92 159.8 31.99 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.012 0.434 . . . . 0.0 110.851 -178.357 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -115.98 166.53 11.89 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.173 -176.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.499 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 9.7 p-10 -61.1 141.37 57.47 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.39 0.614 . . . . 0.0 111.775 177.014 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 81.83 17.06 0.43 Allowed 'General case' 0 C--O 1.236 0.355 0 C-N-CA 125.419 1.487 . . . . 0.0 110.877 -179.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.41 ' OD1' HD12 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -61.52 148.73 41.12 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.523 178.496 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 29.4 m -111.07 110.52 21.1 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 121.419 0.628 . . . . 0.0 112.252 176.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.475 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 28.1 mm -79.45 139.37 18.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.523 177.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -98.12 113.86 25.88 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.915 0.388 . . . . 0.0 110.541 -179.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.458 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 82.0 t -111.55 134.72 53.03 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 CA-C-O 121.292 0.568 . . . . 0.0 111.019 178.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.4 p90 -131.27 166.78 20.43 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.546 -179.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.526 ' NE2' HG22 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -95.1 133.02 39.37 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.597 0.713 . . . . 0.0 111.93 -174.387 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 -110.14 14.07 22.98 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.717 177.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.442 ' H ' ' HG3' ' A' ' 88' ' ' GLN . 4.9 tp-100 -110.19 115.51 29.86 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.115 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.9 t -159.01 144.86 16.5 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.701 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 150.88 121.39 1.0 Allowed Glycine 0 N--CA 1.443 -0.895 0 N-CA-C 111.253 -0.739 . . . . 0.0 111.253 179.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.332 0 CA-C-O 118.192 -1.338 . . . . 0.0 110.967 -178.236 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ptt? . . . . . 0 N--CA 1.485 1.276 0 CA-C-O 121.207 0.527 . . . . 0.0 110.857 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -128.35 12.54 6.51 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.473 0.654 . . . . 0.0 109.661 177.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -95.45 -12.02 26.6 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 121.703 0.763 . . . . 0.0 109.273 -178.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -85.11 47.81 1.47 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.78 -179.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 49.4 mtpt 57.28 102.57 0.03 OUTLIER Pre-proline 0 CA--C 1.534 0.36 0 C-N-CA 123.593 0.757 . . . . 0.0 112.862 -177.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -81.33 -177.95 3.98 Favored 'Trans proline' 0 N--CA 1.453 -0.904 0 C-N-CA 122.598 2.199 . . . . 0.0 111.138 177.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.448 ' HG2' ' HG2' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -48.91 -35.58 15.24 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 120.928 0.394 . . . . 0.0 110.872 175.918 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.448 ' HG2' ' HG2' ' A' ' 7' ' ' LYS . 12.8 pt-20 -172.77 167.85 5.19 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 122.887 0.475 . . . . 0.0 110.046 175.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -74.73 -42.18 32.47 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 121.232 -0.509 . . . . 0.0 113.654 -177.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.0 p -77.35 127.32 38.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.569 0.7 . . . . 0.0 111.25 -178.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 34.5 mtmm -100.95 141.83 33.28 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.365 179.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.9 t -148.92 139.38 22.51 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.14 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 69.2 mm-40 -92.72 -71.59 0.64 Allowed 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -176.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.8 m-80 59.42 19.78 8.11 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-O 121.185 0.517 . . . . 0.0 110.505 -176.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.8 p30 -132.61 176.27 8.59 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.055 0.455 . . . . 0.0 110.362 -177.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -111.84 106.18 14.84 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.838 0.828 . . . . 0.0 110.443 177.526 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.51 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 11.4 p-80 -120.54 154.25 35.59 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.682 -178.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.447 HG13 HD21 ' A' ' 20' ' ' LEU . 29.2 pt -127.53 170.91 16.62 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.122 0 CA-C-O 121.295 0.569 . . . . 0.0 110.725 -178.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.452 ' HA ' ' O ' ' A' ' 32' ' ' PHE . 25.3 t-20 -107.28 122.5 46.67 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.838 179.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.447 HD21 HG13 ' A' ' 18' ' ' ILE . 2.8 mm? -113.16 139.58 48.64 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 178.558 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 48.2 mtmt -125.01 141.29 52.22 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 -178.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.73 HG22 HG13 ' A' ' 84' ' ' ILE . 85.6 t -120.7 130.31 74.69 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.697 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.121 -177.118 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -116.37 123.81 48.53 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-O 121.293 0.568 . . . . 0.0 110.295 -179.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.505 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -96.13 158.72 21.84 Favored Glycine 0 N--CA 1.426 -2.001 0 C-N-CA 120.238 -0.982 . . . . 0.0 110.98 178.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -52.57 -16.42 0.92 Allowed 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 178.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -76.14 -22.13 55.8 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.387 0.613 . . . . 0.0 110.854 178.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 99.33 9.93 49.54 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 -177.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 35.4 t -96.45 125.05 40.67 Favored 'General case' 0 N--CA 1.44 -0.94 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.555 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 16.3 t -118.08 141.16 38.53 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 121.062 0.458 . . . . 0.0 110.953 -179.008 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.599 HG11 ' HD3' ' A' ' 50' ' ' ARG . 16.2 t -124.56 138.7 53.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 178.163 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.407 ' HB3' HD21 ' A' ' 19' ' ' ASN . 0.4 OUTLIER -107.89 142.41 38.01 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.748 0.308 . . . . 0.0 110.591 -179.766 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.504 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 15.9 m-85 -134.83 151.63 51.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.99 0.424 . . . . 0.0 110.687 -178.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.493 HD13 HD23 ' A' ' 43' ' ' LEU . 22.3 pt -132.75 167.52 26.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 O-C-N 122.139 -0.35 . . . . 0.0 110.48 -178.35 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.51 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 86.3 mttt -77.28 150.36 35.3 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 178.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.4 ptt180 -69.37 -18.47 63.78 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.302 0.573 . . . . 0.0 111.092 -179.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 49.3 t-80 -103.33 -1.14 29.2 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 122.329 1.061 . . . . 0.0 108.867 -176.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.434 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.7 m -91.17 138.21 25.94 Favored Pre-proline 0 C--N 1.304 -1.381 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.46 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -58.0 120.06 7.71 Favored 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.676 2.251 . . . . 0.0 112.085 -179.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.601 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.3 pt? -66.93 -15.95 64.02 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.21 0.529 . . . . 0.0 111.364 -179.022 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.533 ' HB2' ' O ' ' A' ' 69' ' ' GLU . 44.4 t -49.71 -32.87 14.41 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.219 177.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 39.2 mtmt -60.57 -47.48 86.02 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 120.978 0.418 . . . . 0.0 110.305 179.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.2 pp -72.67 -35.75 67.77 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.468 -179.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 63.3 mtm -62.61 -48.0 81.29 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 120.997 0.427 . . . . 0.0 110.831 179.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.441 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 47.9 mttp -66.72 -35.57 80.42 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.144 0.497 . . . . 0.0 110.344 177.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.83 -35.31 80.19 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.297 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -63.5 -54.38 37.18 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.788 178.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 22.5 p -64.01 -36.4 83.86 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 120.726 0.298 . . . . 0.0 111.314 -176.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 44.3 mt-10 -66.6 -42.05 87.51 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.749 0.309 . . . . 0.0 111.673 -179.172 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.599 ' HD3' HG11 ' A' ' 30' ' ' VAL . 9.9 ptm180 -79.21 -27.03 42.52 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.251 0.548 . . . . 0.0 110.77 -178.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 23.4 mm-40 -84.03 -20.64 32.39 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 94.29 7.04 61.01 Favored Glycine 0 N--CA 1.444 -0.803 0 C-N-CA 120.339 -0.934 . . . . 0.0 112.817 -179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -98.13 174.27 6.61 Favored 'General case' 0 C--N 1.321 -0.672 0 O-C-N 122.071 -0.664 . . . . 0.0 111.199 -179.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.403 ' HB2' ' OE1' ' A' ' 57' ' ' GLN . 16.8 m -125.1 158.84 32.86 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.617 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.0 mmt -62.87 -27.21 69.19 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.134 0.492 . . . . 0.0 111.954 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.501 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.18 -14.38 47.08 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.482 0.658 . . . . 0.0 110.527 177.485 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.403 ' OE1' ' HB2' ' A' ' 54' ' ' SER . 1.2 mp0 -92.1 -25.87 18.55 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.779 -178.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.409 HG22 ' NE2' ' A' ' 88' ' ' GLN . 12.8 pt -136.42 178.93 4.34 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.181 0.515 . . . . 0.0 111.442 -178.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.445 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 7.8 mmt180 -154.74 140.9 18.49 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.708 177.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -97.91 142.35 29.76 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.639 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.01 137.98 28.06 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-O 121.119 0.485 . . . . 0.0 111.029 -176.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.437 ' HB2' HD11 ' A' ' 67' ' ' ILE . 85.5 t80 -143.64 147.48 34.39 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 29.9 t70 59.43 21.2 9.58 Favored 'General case' 0 N--CA 1.482 1.16 0 CA-C-O 122.181 0.991 . . . . 0.0 109.701 -178.069 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 86.15 -20.36 21.65 Favored Glycine 0 N--CA 1.42 -2.394 0 CA-C-N 115.532 -0.758 . . . . 0.0 112.299 -178.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.452 HE21 HD23 ' A' ' 76' ' ' LEU . 12.6 pt20 -95.6 149.53 36.21 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-O 121.124 0.488 . . . . 0.0 111.336 -177.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_exo -66.57 138.08 48.58 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.787 2.325 . . . . 0.0 111.823 177.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.545 HG21 HD11 ' A' ' 40' ' ' LEU . 53.2 mt -89.04 150.57 3.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 N-CA-C 110.17 -0.307 . . . . 0.0 110.17 179.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.629 HD22 ' HB2' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -120.2 152.99 36.91 Favored 'General case' 0 CA--C 1.502 -0.897 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 177.865 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.533 ' O ' ' HB2' ' A' ' 41' ' ' SER . 7.3 pt-20 -72.59 -18.07 61.64 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-O 121.296 0.57 . . . . 0.0 111.569 -177.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.9 t -92.98 7.7 42.96 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-O 120.934 0.397 . . . . 0.0 111.383 -178.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.629 ' HB2' HD22 ' A' ' 68' ' ' ASN . 0.9 OUTLIER -101.05 171.77 7.42 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.204 0.526 . . . . 0.0 111.335 -179.678 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.404 ' O ' ' HB2' ' A' ' 75' ' ' GLN . 0.6 OUTLIER -124.29 149.8 62.08 Favored Pre-proline 0 C--N 1.319 -0.758 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.877 177.901 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.6 -31.39 92.17 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.056 2.504 . . . . 0.0 112.684 -178.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.63 -18.9 63.63 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.938 0.399 . . . . 0.0 111.346 -179.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.404 ' HB2' ' O ' ' A' ' 72' ' ' THR . 26.4 mm-40 -70.67 -37.85 73.69 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.212 0.529 . . . . 0.0 110.685 178.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.467 ' H ' HD12 ' A' ' 76' ' ' LEU . 0.9 OUTLIER -90.52 5.9 45.82 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 179.433 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 45.43 33.68 1.37 Allowed 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.004 1.322 . . . . 0.0 112.213 -179.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.1 ptm -69.6 160.89 30.71 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.366 -179.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -119.76 166.96 12.56 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.258 -176.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.451 ' O ' ' HB2' ' A' ' 81' ' ' GLU . 5.9 p-10 -59.84 145.61 44.96 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.119 0.485 . . . . 0.0 111.579 177.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.451 ' HB2' ' O ' ' A' ' 80' ' ' ASP . 3.4 mm-40 79.8 16.3 0.82 Allowed 'General case' 0 C--O 1.233 0.213 0 C-N-CA 124.862 1.265 . . . . 0.0 110.936 -178.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.414 ' OD2' HD12 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -63.84 147.97 50.52 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.161 177.956 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 11.7 m -110.87 110.33 20.88 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.43 0.633 . . . . 0.0 111.748 176.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.73 HG13 HG22 ' A' ' 22' ' ' VAL . 13.2 mm -80.02 139.67 17.89 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.216 178.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -96.79 113.07 24.59 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.887 0.375 . . . . 0.0 110.582 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.505 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 43.9 t -111.02 134.82 52.09 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 CA-C-O 121.55 0.69 . . . . 0.0 110.808 177.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.6 p90 -134.2 153.89 51.57 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.81 -178.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.409 ' NE2' HG22 ' A' ' 58' ' ' ILE . 4.9 tp60 -78.49 114.12 17.11 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.044 0.45 . . . . 0.0 110.824 -177.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 -106.36 18.93 21.28 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.479 0.657 . . . . 0.0 110.061 178.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -65.03 -25.36 67.8 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.591 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 2.9 t -108.09 129.88 55.13 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 121.062 0.458 . . . . 0.0 110.749 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -128.5 119.49 3.07 Favored Glycine 0 N--CA 1.444 -0.809 0 C-N-CA 120.824 -0.703 . . . . 0.0 111.36 178.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.136 0 CA-C-O 118.545 -1.142 . . . . 0.0 111.463 -179.328 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ttt . . . . . 0 N--CA 1.48 1.07 0 CA-C-O 120.993 0.425 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -95.3 66.63 2.9 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 176.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -84.44 -38.76 19.77 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.055 -175.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -89.92 105.85 18.08 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-O 120.981 0.419 . . . . 0.0 111.454 -176.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 10.0 ptpp? -65.72 148.63 98.09 Favored Pre-proline 0 C--N 1.326 -0.453 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 176.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_endo -60.11 -172.93 0.08 OUTLIER 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.522 2.148 . . . . 0.0 113.45 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.495 ' HD3' ' H ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -90.44 18.22 6.45 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.721 -178.725 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -97.73 81.11 2.86 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-O 121.058 0.456 . . . . 0.0 111.028 -178.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 175.16 84.13 0.06 OUTLIER Glycine 0 C--N 1.301 -1.372 0 C-N-CA 120.661 -0.78 . . . . 0.0 111.154 177.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 13.0 p -77.25 49.84 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 CA-C-O 123.135 1.445 . . . . 0.0 112.083 -178.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -128.37 107.59 9.88 Favored 'General case' 0 C--N 1.281 -2.393 0 N-CA-C 107.513 -1.291 . . . . 0.0 107.513 176.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 4.2 t -114.54 137.05 52.34 Favored 'General case' 0 N--CA 1.427 -1.605 0 O-C-N 121.608 -0.682 . . . . 0.0 109.987 -177.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -69.39 -8.81 49.89 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-O 121.246 0.545 . . . . 0.0 111.824 178.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -91.28 64.36 5.16 Favored 'General case' 0 C--N 1.316 -0.858 0 O-C-N 121.907 -0.496 . . . . 0.0 112.218 -177.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -160.24 138.46 10.09 Favored 'General case' 0 N--CA 1.468 0.475 0 O-C-N 122.127 -0.358 . . . . 0.0 110.937 177.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.458 ' O ' ' HA ' ' A' ' 35' ' ' LYS . 28.6 t70 61.06 35.23 18.86 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 121.537 0.684 . . . . 0.0 111.121 172.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 30.5 p-80 -122.2 151.4 41.06 Favored 'General case' 0 C--N 1.323 -0.586 0 O-C-N 121.327 -0.858 . . . . 0.0 112.613 -176.019 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 35.0 pt -133.19 170.74 19.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 114.976 -1.011 . . . . 0.0 109.94 179.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.483 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 11.2 m120 -97.29 138.57 34.55 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 178.091 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.495 HD23 HG12 ' A' ' 34' ' ' ILE . 3.2 mm? -130.14 138.26 50.56 Favored 'General case' 0 C--N 1.307 -1.247 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 174.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -126.25 142.4 51.54 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-O 121.175 0.512 . . . . 0.0 110.334 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.691 HG22 HG13 ' A' ' 84' ' ' ILE . 90.4 t -124.02 133.91 67.99 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.147 -177.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -111.46 129.13 56.13 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 121.211 0.529 . . . . 0.0 110.945 -177.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -100.47 167.28 20.05 Favored Glycine 0 N--CA 1.435 -1.397 0 C-N-CA 121.238 -0.505 . . . . 0.0 111.874 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.696 ' H ' ' NE2' ' A' ' 25' ' ' GLN . 0.2 OUTLIER -65.64 -30.19 70.86 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.44 0.638 . . . . 0.0 110.487 -177.075 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -73.67 -12.78 60.84 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.1 -178.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 102.3 0.61 50.69 Favored Glycine 0 C--O 1.227 -0.327 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.167 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.9 t -82.52 149.08 27.73 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 120.895 0.379 . . . . 0.0 110.202 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.554 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 47.5 t -142.7 135.28 26.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 -177.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.471 HG11 ' HD3' ' A' ' 50' ' ' ARG . 13.8 t -120.79 136.24 58.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -104.36 140.34 38.03 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.75 0.309 . . . . 0.0 110.266 178.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.404 ' O ' ' HA ' ' A' ' 19' ' ' ASN . 19.8 m-85 -130.3 157.29 42.94 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.016 0.436 . . . . 0.0 111.215 -178.406 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ALY . . . . . 0.439 ' HD2' ' ND2' ' A' ' 19' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.539 HD13 HD23 ' A' ' 43' ' ' LEU . 20.9 pt -134.43 165.46 31.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 120.945 0.402 . . . . 0.0 111.013 -176.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 23.8 mtpp -77.7 146.23 36.11 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.995 0.426 . . . . 0.0 110.632 178.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.414 ' HA ' ' HG2' ' A' ' 73' ' ' PRO . 1.4 ppt_? -71.8 -13.71 61.77 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.314 0.578 . . . . 0.0 111.025 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 32.0 t60 -98.91 -5.38 30.87 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.487 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.8 m -91.66 136.17 26.86 Favored Pre-proline 0 C--N 1.305 -1.341 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.321 -178.42 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.402 ' HB2' ' OG ' ' A' ' 41' ' ' SER . 19.4 Cg_endo -60.91 126.19 19.03 Favored 'Trans proline' 0 N--CA 1.459 -0.527 0 C-N-CA 122.473 2.115 . . . . 0.0 111.83 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.569 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.2 pp -64.78 -16.55 63.19 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.777 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.54 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 4.0 p -51.8 -31.96 29.35 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 122.873 0.469 . . . . 0.0 111.679 179.338 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -61.67 -49.13 77.75 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.01 0.433 . . . . 0.0 110.342 179.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.6 pp -67.48 -35.08 78.46 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 121.053 0.454 . . . . 0.0 110.142 179.357 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 48.3 mtm -63.55 -49.3 73.98 Favored 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 121.087 0.47 . . . . 0.0 110.896 -179.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.41 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 16.5 mtpp -67.54 -36.94 81.96 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.269 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.418 ' O ' ' HG2' ' A' ' 50' ' ' ARG . . . -62.03 -38.8 90.06 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.128 0.489 . . . . 0.0 109.851 178.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -58.74 -53.71 55.33 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.108 177.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 29.6 p -65.99 -36.51 83.48 Favored 'General case' 0 N--CA 1.453 -0.285 0 O-C-N 121.981 -0.449 . . . . 0.0 111.184 -177.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 45.2 mt-10 -66.11 -40.2 90.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.797 0.332 . . . . 0.0 111.547 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.471 ' HD3' HG11 ' A' ' 30' ' ' VAL . 13.9 ptm180 -80.29 -30.5 38.26 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.052 0.453 . . . . 0.0 111.117 -179.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 -83.97 -16.13 45.23 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -178.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 92.61 6.77 63.76 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 119.955 -1.117 . . . . 0.0 112.954 179.065 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -98.94 175.22 6.01 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.444 0.64 . . . . 0.0 111.197 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.432 ' HB2' ' OE1' ' A' ' 57' ' ' GLN . 68.7 m -126.06 159.89 31.58 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.652 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.6 mmt -66.43 -25.16 66.62 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.3 0.572 . . . . 0.0 111.428 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.46 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.32 -18.34 34.14 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.677 0.751 . . . . 0.0 110.285 176.448 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.558 ' HA ' ' HG2' ' A' ' 90' ' ' GLN . 1.3 mp0 -89.2 -28.15 20.17 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.812 -179.399 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 11.2 pt -136.46 177.29 6.44 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 CA-C-O 121.354 0.597 . . . . 0.0 112.007 -177.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.463 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 15.9 mmt180 -151.9 143.43 23.5 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.65 178.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -99.01 144.73 27.82 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.71 179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.612 ' HG2' ' N ' ' A' ' 62' ' ' PHE . 0.8 OUTLIER -142.14 151.0 41.84 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-O 121.224 0.535 . . . . 0.0 111.211 -177.521 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.612 ' N ' ' HG2' ' A' ' 61' ' ' ARG . 66.7 t80 -155.77 146.81 22.38 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 177.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 22.5 t70 56.72 23.88 8.39 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-O 121.795 0.807 . . . . 0.0 110.251 -177.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.38 -16.41 29.75 Favored Glycine 0 N--CA 1.431 -1.638 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.945 -178.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.487 HE21 HD23 ' A' ' 76' ' ' LEU . 12.7 pt20 -97.99 147.41 33.03 Favored Pre-proline 0 C--N 1.326 -0.44 0 O-C-N 122.414 -0.462 . . . . 0.0 110.716 -179.44 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -70.97 138.77 34.65 Favored 'Trans proline' 0 CA--C 1.533 0.465 0 C-N-CA 122.544 2.163 . . . . 0.0 112.091 179.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.455 HD11 ' HB2' ' A' ' 62' ' ' PHE . 31.6 mt -88.14 151.96 3.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 120.889 0.376 . . . . 0.0 110.285 -178.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -128.79 172.08 11.62 Favored 'General case' 0 CA--C 1.499 -1.003 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.54 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 7.1 pt-20 -78.77 -8.43 58.75 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 121.508 0.671 . . . . 0.0 110.064 177.197 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 23.5 p -93.29 -1.77 55.68 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.158 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -104.0 144.03 32.08 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.299 0.571 . . . . 0.0 112.277 178.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.533 ' OG1' ' HG2' ' A' ' 75' ' ' GLN . 0.6 OUTLIER -111.65 157.95 37.87 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.981 176.612 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.53 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 17.9 Cg_endo -58.59 -28.62 86.52 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.755 2.303 . . . . 0.0 112.16 -179.696 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -78.87 -10.74 59.9 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.907 -178.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.533 ' HG2' ' OG1' ' A' ' 72' ' ' THR . 23.5 mm-40 -79.26 -38.88 34.42 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.1 0.476 . . . . 0.0 111.683 -178.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.563 ' H ' HD12 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -93.59 1.01 56.81 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 179.621 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 54.01 48.64 20.66 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.815 0.817 . . . . 0.0 110.705 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.53 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.4 ptm -82.42 152.96 25.93 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.283 -179.325 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.532 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 13.3 pt-20 -99.34 163.97 12.31 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.142 -177.274 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.483 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 7.3 p-10 -57.37 143.93 38.11 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 121.36 0.6 . . . . 0.0 110.737 173.481 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 68.07 20.98 8.9 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.821 -179.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.532 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 0.5 OUTLIER -69.56 155.39 40.56 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 120.414 -0.514 . . . . 0.0 109.976 179.218 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 24.4 m -102.1 119.93 39.61 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 112.76 0.652 . . . . 0.0 112.76 -174.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.691 HG13 HG22 ' A' ' 22' ' ' VAL . 19.8 mm -90.5 136.53 23.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.292 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -100.67 118.59 37.11 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 121.064 0.459 . . . . 0.0 110.676 178.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.463 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 76.1 t -111.14 140.39 30.64 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.518 0 CA-C-O 121.051 0.453 . . . . 0.0 110.0 177.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.3 p90 -136.31 153.66 51.09 Favored 'General case' 0 C--N 1.308 -1.229 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -83.46 117.48 23.1 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 121.144 0.497 . . . . 0.0 110.714 -176.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.482 ' HA ' ' OE1' ' A' ' 89' ' ' GLN . 11.6 mm-40 -90.43 20.86 4.22 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.437 0.637 . . . . 0.0 111.293 178.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.558 ' HG2' ' HA ' ' A' ' 57' ' ' GLN . 5.9 mm100 -106.53 107.88 19.11 Favored 'General case' 0 C--N 1.314 -0.977 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 177.406 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 20.6 m -87.96 99.19 11.96 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-O 121.212 0.529 . . . . 0.0 110.716 -178.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -171.87 167.44 40.46 Favored Glycine 0 N--CA 1.442 -0.953 0 C-N-CA 121.005 -0.617 . . . . 0.0 111.859 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.913 0 CA-C-O 118.575 -1.125 . . . . 0.0 111.782 179.515 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 pmm? . . . . . 0 N--CA 1.477 0.916 0 CA-C-O 120.994 0.426 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -98.07 2.2 48.48 Favored 'General case' 0 C--N 1.33 -0.255 0 O-C-N 122.015 -0.428 . . . . 0.0 111.804 -177.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -97.15 12.73 31.73 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 122.047 0.927 . . . . 0.0 110.0 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -72.85 86.2 1.26 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.884 178.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.426 ' HE2' ' HA ' ' A' ' 5' ' ' LYS . 6.8 mmpt? 44.58 73.34 0.98 Allowed Pre-proline 0 N--CA 1.472 0.675 0 C-N-CA 123.894 0.877 . . . . 0.0 112.283 -179.08 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.485 ' HB2' ' OE2' ' A' ' 8' ' ' GLU . 58.5 Cg_endo -75.82 169.37 22.36 Favored 'Trans proline' 0 N--CA 1.458 -0.584 0 C-N-CA 122.199 1.933 . . . . 0.0 112.202 179.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.422 ' H ' ' HG3' ' A' ' 7' ' ' LYS . 1.0 OUTLIER -67.01 -3.81 8.12 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 179.518 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.485 ' OE2' ' HB2' ' A' ' 6' ' ' PRO . 1.4 mp0 -74.16 158.67 33.75 Favored 'General case' 0 C--N 1.321 -0.636 0 O-C-N 121.988 -0.445 . . . . 0.0 110.512 178.342 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 113.67 -13.14 22.78 Favored Glycine 0 N--CA 1.444 -0.796 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 -178.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 59.2 t -76.35 152.01 6.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 178.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.72 114.61 3.4 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.126 0.489 . . . . 0.0 110.415 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -130.12 103.99 7.06 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-O 121.058 0.456 . . . . 0.0 111.059 -179.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -137.27 153.68 50.28 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.798 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 69.51 25.86 5.26 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-O 122.044 0.926 . . . . 0.0 109.166 176.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 19.0 p-10 -113.58 15.39 18.94 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.173 -176.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.4 t70 71.99 57.68 0.16 Allowed 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 121.717 0.77 . . . . 0.0 111.501 176.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 22.0 p-80 -126.79 158.6 36.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.233 177.538 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.412 HG13 HD21 ' A' ' 20' ' ' LEU . 42.8 pt -136.87 170.65 17.82 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.443 -179.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.405 ' C ' HD22 ' A' ' 20' ' ' LEU . 23.2 t-20 -105.51 134.2 49.01 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.179 179.065 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.61 HD23 HG12 ' A' ' 34' ' ' ILE . 2.7 mm? -126.41 145.07 50.62 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 177.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -129.86 144.24 51.21 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-O 121.297 0.57 . . . . 0.0 110.402 -178.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.64 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 4.7 p -125.01 132.25 71.54 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.874 -176.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -122.33 138.74 54.41 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.18 0.514 . . . . 0.0 110.662 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -112.98 160.4 13.14 Favored Glycine 0 N--CA 1.437 -1.275 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -62.71 -19.13 63.6 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 121.677 0.751 . . . . 0.0 110.02 -179.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -81.27 11.01 4.66 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.871 -177.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 71.45 39.52 61.25 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 119.893 -1.146 . . . . 0.0 113.186 179.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 10.5 t -132.06 147.37 52.44 Favored 'General case' 0 C--N 1.31 -1.114 0 O-C-N 122.038 -0.683 . . . . 0.0 110.287 179.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.64 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.5 p -146.72 137.16 17.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 121.124 0.488 . . . . 0.0 111.523 -178.327 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 t -123.85 138.05 54.86 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 178.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -107.8 140.73 40.45 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.819 0.342 . . . . 0.0 110.939 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.528 ' HE1' HG12 ' A' ' 22' ' ' VAL . 19.4 m-85 -133.65 160.43 37.53 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.125 0.488 . . . . 0.0 111.31 -177.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.61 HG12 HD23 ' A' ' 20' ' ' LEU . 21.2 pt -127.53 179.14 3.89 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.646 0 O-C-N 122.147 -0.346 . . . . 0.0 110.309 -178.209 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 1.7 mtpm? -94.82 151.11 19.51 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-O 120.903 0.383 . . . . 0.0 110.269 -178.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 18.9 ptt180 -67.08 -23.95 65.91 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.043 0.449 . . . . 0.0 111.762 -177.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -103.13 3.15 35.54 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 122.341 1.067 . . . . 0.0 109.044 -176.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.478 ' OG1' ' HD3' ' A' ' 35' ' ' LYS . 1.8 m -95.87 138.26 21.73 Favored Pre-proline 0 N--CA 1.428 -1.57 0 CA-C-N 114.523 -1.217 . . . . 0.0 110.186 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.428 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 27.3 Cg_endo -58.46 122.37 11.56 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.777 2.318 . . . . 0.0 112.149 -178.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.533 HD11 HG21 ' A' ' 67' ' ' ILE . 1.0 OUTLIER -70.37 -16.17 62.94 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.328 0.585 . . . . 0.0 111.242 -179.318 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.485 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 4.2 p -50.68 -29.75 11.95 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.554 178.286 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.428 ' HE3' ' HG2' ' A' ' 39' ' ' PRO . 96.4 mttt -60.49 -47.93 83.99 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.21 0.528 . . . . 0.0 110.016 177.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.0 OUTLIER -69.6 -37.74 77.01 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.019 179.089 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 57.4 mtm -61.95 -46.78 87.81 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 120.941 0.401 . . . . 0.0 111.287 -179.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.407 ' HE2' ' HB3' ' A' ' 45' ' ' LYS . 30.7 mtpt -67.3 -38.1 84.43 Favored 'General case' 0 CA--C 1.511 -0.529 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.578 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.39 -34.66 77.16 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.174 0.512 . . . . 0.0 109.947 179.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 58.6 t80 -62.5 -56.54 17.13 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.771 177.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 25.8 p -65.42 -37.07 85.82 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 122.091 -0.38 . . . . 0.0 111.512 -176.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -70.72 -29.78 66.15 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 -178.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 50' ' ' ARG . 10.2 ptm85 -89.77 -30.88 17.7 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 121.961 -0.462 . . . . 0.0 111.13 178.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -80.61 -22.53 40.53 Favored 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -178.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.68 40.07 6.07 Favored Glycine 0 N--CA 1.434 -1.483 0 C-N-CA 120.012 -1.089 . . . . 0.0 110.949 -177.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.417 HD13 ' HA ' ' A' ' 53' ' ' LEU . 3.5 mm? -126.21 166.27 17.39 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 178.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 72.0 m -119.54 153.31 35.58 Favored 'General case' 0 C--N 1.309 -1.169 0 O-C-N 122.188 -0.32 . . . . 0.0 110.66 178.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.3 mmt -61.52 -25.67 67.43 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.149 0.499 . . . . 0.0 112.08 179.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.2 -13.46 49.9 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.563 0.697 . . . . 0.0 110.409 176.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.422 HE21 ' HG2' ' A' ' 90' ' ' GLN . 1.0 OUTLIER -94.3 -28.27 15.67 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.648 -0.706 . . . . 0.0 112.188 -177.911 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.475 HG22 ' NE2' ' A' ' 88' ' ' GLN . 13.0 pt -133.35 175.29 11.69 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.025 0 CA-C-O 121.206 0.527 . . . . 0.0 111.149 -177.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.425 ' HD3' ' HA ' ' A' ' 59' ' ' ARG . 14.9 mmt180 -149.95 144.32 25.79 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.803 178.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -102.37 141.54 35.04 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.009 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.461 ' HG2' ' O ' ' A' ' 65' ' ' GLN . 8.3 tmm_? -142.92 141.63 31.53 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.362 0.601 . . . . 0.0 111.381 -179.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.472 ' HB2' HD11 ' A' ' 67' ' ' ILE . 85.9 t80 -144.56 147.49 33.25 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.492 178.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 2.5 t70 58.06 24.45 11.19 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-O 121.728 0.775 . . . . 0.0 110.34 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.401 ' HA2' ' HD3' ' A' ' 61' ' ' ARG . . . 76.55 6.66 84.78 Favored Glycine 0 N--CA 1.433 -1.514 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.93 -179.525 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.562 HE21 HD23 ' A' ' 76' ' ' LEU . 12.8 pt20 -122.01 147.05 47.93 Favored Pre-proline 0 CA--C 1.536 0.425 0 O-C-N 122.224 -0.574 . . . . 0.0 110.48 179.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -66.69 138.44 49.26 Favored 'Trans proline' 0 C--O 1.236 0.42 0 C-N-CA 122.492 2.128 . . . . 0.0 112.223 -178.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.533 HG21 HD11 ' A' ' 40' ' ' LEU . 45.2 mt -91.54 146.47 6.22 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-O 120.952 0.406 . . . . 0.0 110.099 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.635 HD22 ' HB2' ' A' ' 71' ' ' ASP . 0.2 OUTLIER -114.42 165.9 12.25 Favored 'General case' 0 CA--C 1.492 -1.282 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 177.634 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.518 ' H ' ' CD ' ' A' ' 69' ' ' GLU . 0.4 OUTLIER -77.95 -19.81 53.89 Favored 'General case' 0 C--N 1.291 -1.97 0 CA-C-O 121.44 0.638 . . . . 0.0 109.693 178.659 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 36.2 p -92.38 4.04 54.22 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.893 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.635 ' HB2' HD22 ' A' ' 68' ' ' ASN . 20.8 t0 -98.96 159.82 14.69 Favored 'General case' 0 C--N 1.32 -0.714 0 O-C-N 121.899 -0.5 . . . . 0.0 110.568 -178.656 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -118.39 154.2 52.05 Favored Pre-proline 0 C--N 1.316 -0.864 0 O-C-N 122.24 -0.287 . . . . 0.0 111.664 177.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -60.17 -30.96 92.49 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.94 2.427 . . . . 0.0 112.276 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.17 -19.68 62.38 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.145 0.497 . . . . 0.0 111.129 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.43 ' NE2' ' HA ' ' A' ' 75' ' ' GLN . 4.0 tp60 -67.84 -37.57 82.05 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.645 0.736 . . . . 0.0 110.152 -179.149 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.562 HD23 HE21 ' A' ' 65' ' ' GLN . 0.5 OUTLIER -93.54 5.19 52.43 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.945 -178.725 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 43.31 40.97 2.81 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.615 1.166 . . . . 0.0 111.94 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 4.3 ptm -74.27 161.89 29.46 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.723 -178.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -110.2 164.14 12.93 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 116.325 -0.398 . . . . 0.0 109.964 -177.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -55.42 138.07 46.82 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.591 0.71 . . . . 0.0 111.999 176.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 77.95 24.92 0.68 Allowed 'General case' 0 CA--C 1.512 -0.518 0 C-N-CA 124.895 1.278 . . . . 0.0 111.835 177.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.469 ' OD1' HD12 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -61.62 154.07 26.1 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.303 176.523 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 30.8 m -110.44 108.89 19.06 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-O 121.411 0.624 . . . . 0.0 112.05 176.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.432 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 25.1 mm -80.49 137.8 20.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.175 177.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -101.35 124.33 46.86 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.144 0.497 . . . . 0.0 110.423 178.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.419 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 91.0 t -114.19 131.58 65.75 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.08 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.716 178.152 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.4 p90 -133.85 152.06 51.74 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 116.248 -0.433 . . . . 0.0 109.93 -175.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.475 ' NE2' HG22 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -76.91 112.12 13.18 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-O 121.358 0.599 . . . . 0.0 112.369 -176.414 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 78.2 mm-40 -111.27 24.77 12.45 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.572 177.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.422 ' HG2' HE21 ' A' ' 57' ' ' GLN . 20.9 tm0? -60.77 -47.66 85.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.991 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.3 m -99.18 140.65 33.04 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.802 179.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 177.57 -41.52 0.09 OUTLIER Glycine 0 N--CA 1.443 -0.879 0 C-N-CA 120.4 -0.905 . . . . 0.0 112.212 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.129 0 CA-C-O 118.965 -0.908 . . . . 0.0 111.256 -179.412 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.1 ptt? . . . . . 0 N--CA 1.477 0.885 0 CA-C-O 120.623 0.249 . . . . 0.0 111.131 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -86.39 13.31 8.43 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.442 0.639 . . . . 0.0 110.74 179.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -76.29 -9.05 58.34 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.621 0.724 . . . . 0.0 110.017 178.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -117.47 118.11 31.29 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.499 176.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 36.8 ttmt -57.59 124.87 70.23 Favored Pre-proline 0 C--N 1.322 -0.601 0 CA-C-O 121.096 0.474 . . . . 0.0 111.708 -177.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.424 ' HB2' ' H ' ' A' ' 7' ' ' LYS . 72.4 Cg_endo -73.84 -149.37 0.03 OUTLIER 'Trans proline' 0 CA--C 1.539 0.766 0 C-N-CA 123.552 2.835 . . . . 0.0 112.392 -179.475 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.424 ' H ' ' HB2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER -100.45 18.08 19.94 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 122.023 0.916 . . . . 0.0 109.796 179.424 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -141.09 173.76 11.17 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 114.962 -1.017 . . . . 0.0 108.884 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -137.11 -49.81 0.07 OUTLIER Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 119.585 -1.293 . . . . 0.0 113.884 -176.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 40.3 t -87.88 82.3 2.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.511 0.672 . . . . 0.0 111.498 -177.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.3 tttp -145.17 133.23 21.42 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.882 176.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 13.6 t -76.95 169.37 18.45 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.077 0.465 . . . . 0.0 110.709 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.493 ' C ' ' H ' ' A' ' 15' ' ' ASN . 30.0 mt-10 -108.68 125.91 52.41 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.094 0.473 . . . . 0.0 111.569 -177.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.403 ' H ' ' ND2' ' A' ' 14' ' ' ASN . 4.2 p30 -67.78 32.99 0.03 OUTLIER 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.39 0.614 . . . . 0.0 111.854 172.401 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.493 ' H ' ' C ' ' A' ' 13' ' ' GLU . 50.9 m-20 -89.91 103.62 16.27 Favored 'General case' 0 N--CA 1.444 -0.751 0 CA-C-O 121.181 0.515 . . . . 0.0 110.204 179.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -75.77 99.38 4.4 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.461 0.648 . . . . 0.0 109.979 -178.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.575 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 55.4 p-80 -121.64 146.13 47.3 Favored 'General case' 0 N--CA 1.436 -1.127 0 CA-C-O 121.459 0.647 . . . . 0.0 111.485 -178.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 39.7 pt -127.12 167.65 21.57 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.206 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.33 -178.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.504 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 23.7 t-20 -100.62 137.86 38.44 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.381 178.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.406 HD23 HG12 ' A' ' 34' ' ' ILE . 3.0 mm? -127.85 135.9 50.68 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 176.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -119.65 145.02 46.84 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-O 121.301 0.572 . . . . 0.0 110.12 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.635 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 6.7 p -123.66 134.35 66.66 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.937 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.955 -178.435 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -117.93 117.99 30.77 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-O 121.241 0.543 . . . . 0.0 110.081 -178.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.403 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -84.12 155.14 31.11 Favored Glycine 0 N--CA 1.426 -2.012 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.092 -179.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.18 -15.31 9.31 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 178.014 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -93.48 -11.19 32.6 Favored 'General case' 0 C--N 1.319 -0.718 0 O-C-N 122.015 -0.428 . . . . 0.0 110.828 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.99 7.58 35.53 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.648 -0.786 . . . . 0.0 112.737 178.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 74.5 m -91.36 124.94 35.93 Favored 'General case' 0 C--N 1.313 -0.988 0 O-C-N 122.363 -0.493 . . . . 0.0 111.118 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.635 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.2 p -119.91 132.31 69.97 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 CA-C-O 121.292 0.568 . . . . 0.0 111.605 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.5 t -119.19 135.26 60.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.044 179.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -104.89 142.18 35.22 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.707 0.289 . . . . 0.0 110.696 179.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.5 ' HE1' HG12 ' A' ' 22' ' ' VAL . 16.2 m-85 -134.93 162.55 32.1 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.179 0.514 . . . . 0.0 111.149 -178.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.406 HG12 HD23 ' A' ' 20' ' ' LEU . 24.7 pt -132.95 169.41 22.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-O 120.916 0.389 . . . . 0.0 110.347 -177.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.575 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 44.6 mtpt -86.58 152.96 22.16 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-O 121.134 0.492 . . . . 0.0 110.887 179.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 28.1 ptt180 -64.49 -24.06 67.49 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.172 -0.467 . . . . 0.0 112.0 -178.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 55.7 t60 -104.22 -2.26 25.94 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 122.086 0.946 . . . . 0.0 108.817 -176.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.475 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.5 m -87.15 137.87 32.76 Favored Pre-proline 0 N--CA 1.427 -1.587 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.355 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_endo -58.92 122.7 12.05 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.672 2.248 . . . . 0.0 112.469 -178.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.461 HD12 ' N ' ' A' ' 41' ' ' SER . 1.2 pp -68.0 -16.47 64.06 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.427 179.225 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.5 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 10.1 p -52.14 -30.31 25.95 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.247 0.619 . . . . 0.0 111.899 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -64.24 -42.66 96.42 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.675 -179.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.469 ' C ' HD12 ' A' ' 43' ' ' LEU . 1.0 OUTLIER -70.83 -35.91 72.67 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.05 0.453 . . . . 0.0 110.233 178.519 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 44.0 mtm -63.32 -49.28 74.59 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.015 0.436 . . . . 0.0 110.765 -178.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.422 ' HD2' ' HE2' ' A' ' 55' ' ' MET . 12.4 mmmm -66.55 -37.71 85.56 Favored 'General case' 0 N--CA 1.441 -0.878 0 O-C-N 122.267 -0.271 . . . . 0.0 110.48 177.178 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.34 -43.41 88.26 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.378 0.608 . . . . 0.0 110.04 178.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.406 ' CD1' HG11 ' A' ' 22' ' ' VAL . 63.1 t80 -56.38 -55.08 37.96 Favored 'General case' 0 N--CA 1.446 -0.675 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.619 177.575 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.659 ' SG ' HD11 ' A' ' 58' ' ' ILE . 33.2 m -63.08 -42.71 99.69 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.926 0.393 . . . . 0.0 111.174 -177.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.45 -35.95 81.56 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -177.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -84.98 -34.2 22.43 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.555 -0.458 . . . . 0.0 110.92 -179.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -83.17 -13.57 55.21 Favored 'General case' 0 C--N 1.334 -0.096 0 N-CA-C 113.083 0.772 . . . . 0.0 113.083 -178.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.42 6.49 73.95 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.152 -1.023 . . . . 0.0 113.203 178.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -92.18 169.94 10.21 Favored 'General case' 0 C--N 1.32 -0.675 0 O-C-N 121.975 -0.721 . . . . 0.0 110.925 178.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 71.6 m -120.77 154.38 35.75 Favored 'General case' 0 N--CA 1.437 -1.084 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.319 179.234 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.422 ' HE2' ' HD2' ' A' ' 45' ' ' LYS . 12.5 mmt -62.01 -28.19 69.4 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-O 121.375 0.607 . . . . 0.0 111.592 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.552 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.08 -14.85 45.91 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.438 0.637 . . . . 0.0 110.818 178.397 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -90.18 -31.64 16.97 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.586 -179.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.659 HD11 ' SG ' ' A' ' 48' ' ' CYS . 12.0 pt -128.84 175.95 9.16 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.151 0 CA-C-O 121.296 0.569 . . . . 0.0 111.678 -177.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.455 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 25.0 mmt180 -148.51 138.77 22.53 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.341 179.378 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 41.8 m-85 -96.71 139.6 32.54 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.308 179.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.444 ' HD2' ' HB2' ' A' ' 85' ' ' ASP . 0.2 OUTLIER -141.62 137.71 32.05 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-O 121.04 0.448 . . . . 0.0 111.063 -176.755 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.556 ' HB2' HD11 ' A' ' 67' ' ' ILE . 67.2 t80 -143.33 145.15 32.45 Favored 'General case' 0 C--O 1.214 -0.801 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 177.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 23.7 t70 54.02 23.75 4.24 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 121.895 0.855 . . . . 0.0 110.871 -177.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.437 ' HA2' ' NE ' ' A' ' 61' ' ' ARG . . . 85.08 -18.03 29.49 Favored Glycine 0 N--CA 1.434 -1.469 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.997 -178.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.489 HE21 HD23 ' A' ' 76' ' ' LEU . 12.4 pt20 -96.11 149.94 36.59 Favored Pre-proline 0 C--N 1.318 -0.765 0 O-C-N 122.532 -0.393 . . . . 0.0 111.071 -179.355 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -71.92 141.98 37.97 Favored 'Trans proline' 0 C--O 1.235 0.344 0 C-N-CA 122.53 2.153 . . . . 0.0 111.751 -179.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.556 HD11 ' HB2' ' A' ' 62' ' ' PHE . 23.9 mt -94.53 148.15 5.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 120.979 0.419 . . . . 0.0 110.19 -179.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -129.24 166.72 18.86 Favored 'General case' 0 CA--C 1.498 -1.042 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 179.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.5 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 12.6 pt-20 -75.16 -12.48 60.31 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 121.341 0.591 . . . . 0.0 110.479 178.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.8 t -91.71 -1.33 57.45 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 121.221 0.534 . . . . 0.0 111.171 -178.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -103.93 147.12 27.72 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 120.9 0.381 . . . . 0.0 111.022 177.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.56 153.72 42.73 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.46 179.533 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -60.7 -31.27 91.81 Favored 'Trans proline' 0 C--N 1.349 0.572 0 C-N-CA 122.701 2.268 . . . . 0.0 112.551 -177.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -70.83 -20.78 62.52 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.79 -179.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -67.21 -37.22 83.27 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.153 0.502 . . . . 0.0 111.127 -178.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.489 HD23 HE21 ' A' ' 65' ' ' GLN . 0.6 OUTLIER -94.51 11.24 31.54 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.564 -178.023 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 43.73 36.97 1.41 Allowed 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 124.147 0.979 . . . . 0.0 112.202 -179.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.8 ptm -73.53 158.47 34.8 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.901 -178.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -109.33 165.43 11.63 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 120.916 0.389 . . . . 0.0 110.534 -178.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.504 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 10.3 p-10 -61.55 142.73 56.9 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.339 0.59 . . . . 0.0 111.196 175.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 72.83 17.33 4.36 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 124.42 1.088 . . . . 0.0 111.721 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -75.48 161.54 29.11 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 176.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 6.7 m -109.95 131.86 54.68 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -174.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 45.9 mm -97.62 134.01 37.33 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.517 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 175.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.444 ' HB2' ' HD2' ' A' ' 61' ' ' ARG . 43.3 m-20 -97.39 124.65 41.64 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-O 121.07 0.462 . . . . 0.0 110.967 179.474 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.455 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 87.3 t -115.61 139.09 43.78 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 CA-C-O 120.99 0.424 . . . . 0.0 110.329 177.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 9.7 p90 -134.9 155.87 49.94 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -88.63 116.38 26.84 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.541 0.686 . . . . 0.0 111.48 -175.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 75.0 mm-40 -104.69 23.74 12.9 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.524 178.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -79.65 84.43 5.48 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.434 0.635 . . . . 0.0 110.621 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 17.5 m -99.57 86.48 3.36 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 121.239 0.543 . . . . 0.0 110.227 179.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 139.19 -146.13 17.64 Favored Glycine 0 N--CA 1.436 -1.318 0 N-CA-C 110.96 -0.856 . . . . 0.0 110.96 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.727 -1.041 . . . . 0.0 112.229 179.516 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.3 ptt? . . . . . 0 N--CA 1.484 1.275 0 CA-C-O 121.103 0.478 . . . . 0.0 111.086 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.14 19.09 21.2 Favored 'General case' 0 CA--C 1.509 -0.604 0 CA-C-O 121.775 0.798 . . . . 0.0 109.438 179.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -71.52 -44.65 64.25 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.397 -178.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 30.0 mp0 -91.89 9.92 30.94 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.72 -179.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 54.8 tptt -146.02 78.75 11.3 Favored Pre-proline 0 N--CA 1.441 -0.907 0 CA-C-O 121.156 0.503 . . . . 0.0 109.876 -178.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -90.0 -172.8 0.62 Allowed 'Trans proline' 0 N--CA 1.446 -1.267 0 C-N-CA 122.916 2.411 . . . . 0.0 111.438 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -2.12 24.23 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.132 0.491 . . . . 0.0 111.528 179.567 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -68.04 167.44 13.91 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.892 -0.411 . . . . 0.0 109.892 178.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 153.4 29.18 0.04 OUTLIER Glycine 0 C--N 1.311 -0.847 0 C-N-CA 120.09 -1.053 . . . . 0.0 112.895 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.3 p -80.18 135.67 24.93 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.955 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 178.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 49.81 54.0 11.79 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.427 0.632 . . . . 0.0 110.213 -173.087 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.8 t -77.37 50.89 0.82 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 122.58 1.181 . . . . 0.0 111.232 -178.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.486 ' HG3' ' H ' ' A' ' 14' ' ' ASN . 8.9 pt-20 -174.6 -61.89 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.693 0 CA-C-N 114.128 -1.396 . . . . 0.0 108.746 -178.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.486 ' H ' ' HG3' ' A' ' 13' ' ' GLU . 0.9 OUTLIER -85.27 48.7 1.62 Allowed 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 175.776 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -81.01 -41.26 22.97 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.415 -0.812 . . . . 0.0 110.73 -176.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.7 t70 67.57 46.9 1.28 Allowed 'General case' 0 C--O 1.238 0.485 0 CA-C-O 121.68 0.753 . . . . 0.0 111.461 175.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 5.9 p-80 -117.98 152.18 36.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.403 0.62 . . . . 0.0 111.409 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 29.2 pt -128.96 171.12 17.36 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.128 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.028 178.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.451 ' HB2' ' NZ ' ' A' ' 33' ' ' ALY . 19.2 t-20 -107.27 133.91 51.13 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -124.35 135.35 53.26 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 177.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.46 ' HG2' ' HG3' ' A' ' 31' ' ' GLN . 49.8 mtmt -121.95 144.42 48.88 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 121.155 0.503 . . . . 0.0 110.099 -179.279 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.622 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 2.5 p -121.62 127.45 75.58 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.527 -177.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -117.44 126.69 53.05 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.294 0.568 . . . . 0.0 110.09 -178.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -104.13 152.95 17.71 Favored Glycine 0 N--CA 1.429 -1.812 0 C-N-CA 120.439 -0.886 . . . . 0.0 111.548 -179.303 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.05 -16.2 1.03 Allowed 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 177.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -70.26 -22.8 62.84 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.507 0.67 . . . . 0.0 110.51 177.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 102.56 9.66 40.29 Favored Glycine 0 N--CA 1.448 -0.501 0 N-CA-C 111.338 -0.705 . . . . 0.0 111.338 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 39.9 t -101.89 157.15 17.06 Favored 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 122.492 0.317 . . . . 0.0 110.224 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.622 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 3.7 p -149.51 140.59 16.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.0 0.428 . . . . 0.0 110.616 -179.197 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.9 t -125.18 139.71 50.37 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 179.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.46 ' HG3' ' HG2' ' A' ' 21' ' ' LYS . 0.4 OUTLIER -108.63 144.55 36.22 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.951 0.405 . . . . 0.0 111.049 -179.46 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.549 ' HE1' HG12 ' A' ' 22' ' ' VAL . 14.1 m-85 -140.42 153.49 46.32 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.171 0.51 . . . . 0.0 111.142 -178.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ALY . . . . . 0.451 ' NZ ' ' HB2' ' A' ' 19' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 37.8 pt -137.63 166.73 24.02 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 -177.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 3.9 mppt? -77.99 151.88 33.38 Favored 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.187 177.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 22.1 ptt180 -68.06 -14.37 62.92 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 121.378 0.609 . . . . 0.0 110.9 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 76.4 t60 -107.34 -1.62 21.44 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-O 122.289 1.042 . . . . 0.0 108.645 -178.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.53 ' OG1' ' HE2' ' A' ' 35' ' ' LYS . 1.3 m -86.63 139.34 33.41 Favored Pre-proline 0 N--CA 1.432 -1.362 0 CA-C-N 114.548 -1.205 . . . . 0.0 109.73 178.702 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -59.99 119.31 6.44 Favored 'Trans proline' 0 N--CA 1.462 -0.342 0 C-N-CA 122.356 2.038 . . . . 0.0 112.397 -179.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.599 HD11 HG21 ' A' ' 67' ' ' ILE . 1.7 pt? -67.82 -16.74 64.25 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.515 0.674 . . . . 0.0 110.58 179.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 14.4 p -52.25 -28.83 20.22 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.223 177.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.2 mtpt -62.25 -46.96 86.47 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 121.101 0.477 . . . . 0.0 109.739 178.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.8 pp -72.88 -37.52 67.28 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 120.881 0.372 . . . . 0.0 110.265 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 62.7 mtm -61.49 -43.78 98.25 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 120.922 0.391 . . . . 0.0 111.363 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.523 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 43.3 mttp -69.53 -37.63 77.2 Favored 'General case' 0 CA--C 1.514 -0.422 0 O-C-N 122.071 -0.393 . . . . 0.0 110.751 177.607 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.93 -35.49 80.85 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.146 0.498 . . . . 0.0 109.824 -179.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.412 ' CZ ' ' HG3' ' A' ' 51' ' ' GLN . 69.3 t80 -61.73 -54.74 38.48 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.602 178.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.629 ' SG ' HD11 ' A' ' 58' ' ' ILE . 19.5 m -58.77 -39.18 80.26 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.054 0.454 . . . . 0.0 110.447 -179.115 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.523 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 67.2 mt-10 -62.09 -49.33 76.38 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.115 0.483 . . . . 0.0 111.729 179.241 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -74.89 -36.63 62.24 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.087 0.402 . . . . 0.0 112.087 -176.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.412 ' HG3' ' CZ ' ' A' ' 47' ' ' TYR . 26.7 mm-40 -78.09 -21.19 50.86 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -178.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.405 ' C ' HD22 ' A' ' 53' ' ' LEU . . . 86.46 41.65 6.83 Favored Glycine 0 N--CA 1.431 -1.686 0 C-N-CA 119.905 -1.14 . . . . 0.0 111.271 -178.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.405 HD22 ' C ' ' A' ' 52' ' ' GLY . 3.6 mm? -127.64 170.38 12.74 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.47 ' HB2' ' OE1' ' A' ' 57' ' ' GLN . 50.0 m -124.71 157.56 35.36 Favored 'General case' 0 C--N 1.311 -1.088 0 O-C-N 122.303 -0.248 . . . . 0.0 110.491 177.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 12.1 mmt -60.73 -28.91 69.04 Favored 'General case' 0 C--O 1.22 -0.487 0 CA-C-O 121.327 0.584 . . . . 0.0 111.784 -179.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.554 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.36 -16.07 41.12 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.401 0.62 . . . . 0.0 110.634 178.694 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.47 ' OE1' ' HB2' ' A' ' 54' ' ' SER . 1.3 mp0 -90.82 -25.13 20.07 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.782 -177.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.629 HD11 ' SG ' ' A' ' 48' ' ' CYS . 12.7 pt -135.27 177.94 6.02 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.069 0 CA-C-O 120.933 0.397 . . . . 0.0 110.761 -178.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.433 ' CG ' ' HG3' ' A' ' 89' ' ' GLN . 15.0 mmt180 -150.54 139.61 21.08 Favored 'General case' 0 CA--C 1.501 -0.924 0 CA-C-O 121.341 0.591 . . . . 0.0 111.081 178.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -97.91 141.23 31.14 Favored 'General case' 0 N--CA 1.438 -1.033 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.685 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.446 ' HG2' ' N ' ' A' ' 62' ' ' PHE . 8.4 tmm_? -143.48 145.58 32.71 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 121.247 0.546 . . . . 0.0 110.94 -179.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.525 ' HB2' HD11 ' A' ' 67' ' ' ILE . 86.1 t80 -151.13 148.74 28.65 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.657 179.029 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 19.5 t70 58.4 22.08 9.09 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-O 121.753 0.787 . . . . 0.0 110.123 -178.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.0 4.44 88.73 Favored Glycine 0 N--CA 1.43 -1.765 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.662 -178.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -121.39 143.58 37.98 Favored Pre-proline 0 N--CA 1.444 -0.738 0 O-C-N 122.071 -0.664 . . . . 0.0 110.11 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -61.71 141.1 89.56 Favored 'Trans proline' 0 C--N 1.329 -0.457 0 C-N-CA 122.848 2.366 . . . . 0.0 112.091 179.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.599 HG21 HD11 ' A' ' 40' ' ' LEU . 41.2 mt -96.78 146.84 6.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 120.859 0.362 . . . . 0.0 110.146 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -114.5 163.01 15.96 Favored 'General case' 0 CA--C 1.5 -0.959 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 176.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -79.04 -11.22 59.99 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 120.106 -0.638 . . . . 0.0 110.597 179.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 35.0 p -84.76 -11.99 54.64 Favored 'General case' 0 N--CA 1.44 -0.934 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.72 179.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.56 165.74 16.82 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -178.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -121.54 153.37 59.25 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.217 173.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.417 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 12.2 Cg_endo -57.38 -30.2 87.03 Favored 'Trans proline' 0 C--O 1.236 0.424 0 C-N-CA 122.779 2.319 . . . . 0.0 112.137 -179.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -71.27 -20.73 62.19 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.163 0.506 . . . . 0.0 111.64 -179.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -69.16 -39.1 78.99 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.318 0.58 . . . . 0.0 110.863 179.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.457 ' H ' HD12 ' A' ' 76' ' ' LEU . 1.1 mp -86.92 2.86 47.89 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.143 -178.283 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 57.02 31.08 19.28 Favored 'General case' 0 C--N 1.349 0.567 0 CA-C-O 121.51 0.671 . . . . 0.0 111.193 178.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.546 ' HE1' HD11 ' A' ' 84' ' ' ILE . 6.8 ptm -79.06 164.73 24.09 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.769 -178.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -121.89 172.69 8.0 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.578 -176.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -63.06 145.31 55.73 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-O 121.528 0.68 . . . . 0.0 111.835 177.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 71.16 16.33 6.3 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 114.57 -1.196 . . . . 0.0 111.492 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.4 ' OD1' ' CE1' ' A' ' 62' ' ' PHE . 11.2 t70 -70.79 153.95 42.29 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.156 175.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 19.7 m -112.99 134.99 54.25 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-O 121.454 0.645 . . . . 0.0 112.367 -177.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.546 HD11 ' HE1' ' A' ' 78' ' ' MET . 39.2 mm -98.48 145.28 10.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 C-N-CA 123.372 0.669 . . . . 0.0 110.089 -179.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -100.27 117.04 33.65 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 122.316 0.246 . . . . 0.0 110.852 179.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 86.4 t -115.37 136.02 53.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-O 121.298 0.57 . . . . 0.0 111.285 177.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -134.05 153.18 51.97 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.061 -178.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.462 ' HG3' ' H ' ' A' ' 90' ' ' GLN . 0.1 OUTLIER -79.47 115.33 19.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.312 0.577 . . . . 0.0 111.623 -178.273 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.433 ' HG3' ' CG ' ' A' ' 59' ' ' ARG . 51.8 mm-40 -104.02 22.09 15.26 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-O 121.485 0.659 . . . . 0.0 110.716 177.144 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.462 ' H ' ' HG3' ' A' ' 88' ' ' GLN . 5.7 tp60 -94.79 138.66 32.31 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.521 179.027 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 6.4 p -78.51 154.83 30.15 Favored 'General case' 0 N--CA 1.434 -1.233 0 CA-C-O 121.05 0.452 . . . . 0.0 111.397 -179.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 71.87 71.79 1.01 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.014 -179.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.766 0 CA-C-O 118.66 -1.078 . . . . 0.0 112.231 178.737 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.7 ptp . . . . . 0 N--CA 1.476 0.874 0 CA-C-O 120.881 0.372 . . . . 0.0 110.782 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 55.95 65.33 1.47 Allowed 'General case' 0 CA--C 1.53 0.186 0 CA-C-O 121.274 0.559 . . . . 0.0 112.273 178.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -100.61 -5.44 26.72 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.817 0.818 . . . . 0.0 109.079 177.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -109.3 31.13 5.98 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.152 -0.931 . . . . 0.0 108.733 178.566 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 51.7 tptt -103.75 127.89 28.49 Favored Pre-proline 0 C--N 1.319 -0.741 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.898 -175.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.504 ' HB2' ' OE1' ' A' ' 8' ' ' GLU . 95.4 Cg_endo -78.75 -167.07 0.45 Allowed 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.155 1.903 . . . . 0.0 111.737 178.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -121.5 4.03 10.18 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 121.729 0.776 . . . . 0.0 109.849 -179.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.504 ' OE1' ' HB2' ' A' ' 6' ' ' PRO . 2.5 mp0 -89.07 19.82 4.0 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.74 -178.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -83.25 61.67 4.74 Favored Glycine 0 C--N 1.308 -1.0 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.87 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 41.4 t -116.06 126.37 73.53 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 -179.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -59.12 97.99 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.603 0.716 . . . . 0.0 112.057 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.7 t -101.92 -165.15 1.16 Allowed 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.096 178.173 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -92.95 -165.55 1.36 Allowed 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.289 0.566 . . . . 0.0 110.48 179.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -95.91 18.16 13.84 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.541 0.686 . . . . 0.0 110.495 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.9 p30 -111.26 29.65 7.62 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.609 0.719 . . . . 0.0 110.403 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -87.58 -7.32 57.66 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.765 0.793 . . . . 0.0 110.695 -178.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.403 ' HB2' ' O ' ' A' ' 34' ' ' ILE . 33.2 p-80 -124.58 159.31 30.96 Favored 'General case' 0 C--N 1.299 -1.605 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.54 -175.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 31.0 pt -130.29 170.85 18.54 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.908 -177.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -105.21 136.23 45.09 Favored 'General case' 0 C--N 1.312 -1.022 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 178.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -128.21 136.6 51.31 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 121.01 0.433 . . . . 0.0 109.879 178.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.462 ' O ' ' HA ' ' A' ' 83' ' ' THR . 52.2 mtmt -120.29 146.46 46.07 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.016 0.436 . . . . 0.0 109.911 179.666 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.616 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 3.8 p -124.56 132.6 71.1 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.615 0 CA-C-N 116.637 -0.256 . . . . 0.0 110.832 -178.28 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -119.26 127.67 53.46 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 121.234 0.54 . . . . 0.0 110.36 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -103.0 147.39 16.89 Favored Glycine 0 N--CA 1.433 -1.556 0 C-N-CA 121.019 -0.61 . . . . 0.0 111.943 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.521 ' HG3' ' HA ' ' A' ' 87' ' ' PHE . 0.0 OUTLIER -51.93 -24.49 6.49 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 177.89 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -75.04 -18.17 60.37 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.218 0.532 . . . . 0.0 110.734 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 106.01 27.4 5.67 Favored Glycine 0 CA--C 1.499 -0.965 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.088 175.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.419 ' HB3' ' OE1' ' A' ' 51' ' ' GLN . 71.0 m -111.29 147.63 34.67 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 120.656 0.265 . . . . 0.0 110.491 179.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.616 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.4 p -145.81 132.33 14.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 121.188 0.518 . . . . 0.0 111.667 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.2 t -124.15 139.66 49.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -108.03 142.4 38.26 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.816 0.341 . . . . 0.0 110.771 179.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.513 ' HE1' HG12 ' A' ' 22' ' ' VAL . 20.8 m-85 -136.39 152.96 51.19 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.37 0.605 . . . . 0.0 111.797 -177.566 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.403 ' O ' ' HB2' ' A' ' 17' ' ' HIS . 29.1 pt -133.49 162.77 39.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.014 0.435 . . . . 0.0 111.063 -176.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.403 ' HB2' ' HB ' ' A' ' 38' ' ' THR . 36.0 mtmm -74.72 147.15 41.64 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 110.083 -0.34 . . . . 0.0 110.083 178.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.9 ptt180 -71.24 -13.16 61.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.682 0.753 . . . . 0.0 110.243 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 -100.52 -5.64 26.64 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -178.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.403 ' HB ' ' HB2' ' A' ' 35' ' ' LYS . 1.0 OUTLIER -94.8 141.89 23.95 Favored Pre-proline 0 N--CA 1.445 -0.719 0 CA-C-N 114.763 -1.108 . . . . 0.0 109.73 179.758 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -63.09 128.92 24.14 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.257 1.971 . . . . 0.0 112.375 -179.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.533 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.1 pt? -69.26 -17.29 63.74 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.692 0.758 . . . . 0.0 110.446 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.416 ' N ' HD23 ' A' ' 40' ' ' LEU . 0.9 OUTLIER -51.73 -28.96 16.72 Favored 'General case' 0 C--N 1.31 -1.111 0 C-N-CA 124.43 1.092 . . . . 0.0 111.204 178.57 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 51.5 mtpt -63.38 -43.14 98.47 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.897 179.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.3 pp -73.04 -38.64 66.43 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 120.938 0.399 . . . . 0.0 109.985 178.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 59.7 mtm -60.74 -49.41 77.59 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-O 121.049 0.452 . . . . 0.0 111.108 -179.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.439 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 47.7 mtpt -68.67 -35.36 77.12 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.821 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.488 ' O ' ' HG2' ' A' ' 50' ' ' ARG . . . -63.86 -38.03 89.58 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.055 0.455 . . . . 0.0 110.004 178.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -57.02 -56.34 22.98 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.849 178.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.49 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 26.1 p -63.46 -37.62 87.99 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.869 0.366 . . . . 0.0 111.45 -177.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.439 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 44.8 mt-10 -67.61 -36.45 80.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.788 0.328 . . . . 0.0 111.732 -179.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.54 ' HG3' HE21 ' A' ' 51' ' ' GLN . 14.2 ptm180 -85.23 -37.39 20.14 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 121.96 -0.462 . . . . 0.0 111.695 -179.382 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.54 HE21 ' HG3' ' A' ' 50' ' ' ARG . 21.5 mm-40 -77.67 -21.88 51.44 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -176.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 92.45 37.14 5.96 Favored Glycine 0 N--CA 1.439 -1.165 0 C-N-CA 120.281 -0.962 . . . . 0.0 111.173 -178.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.49 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 4.0 mm? -122.25 162.99 20.42 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -179.641 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.428 ' HB2' ' HB2' ' A' ' 57' ' ' GLN . 16.6 m -116.72 152.83 33.49 Favored 'General case' 0 C--N 1.312 -1.036 0 O-C-N 122.017 -0.427 . . . . 0.0 110.556 178.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 11.9 mmt -63.73 -25.9 68.41 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.542 0.687 . . . . 0.0 111.283 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.613 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.56 -16.79 38.25 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.325 0.583 . . . . 0.0 110.735 177.133 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.601 ' NE2' ' HG2' ' A' ' 56' ' ' ARG . 2.7 mp0 -93.31 -27.04 17.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.8 -179.357 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.6 pt -129.86 -179.12 2.92 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.918 0 CA-C-O 121.062 0.458 . . . . 0.0 111.266 -179.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.452 ' HA ' ' HD3' ' A' ' 59' ' ' ARG . 8.3 mmt180 -158.17 143.29 16.57 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.851 177.609 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -100.74 145.55 28.35 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.621 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.2 ttt180 -142.48 148.08 37.11 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 120.884 0.373 . . . . 0.0 110.547 -178.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.524 ' HB2' HD11 ' A' ' 67' ' ' ILE . 73.8 t80 -152.72 143.69 23.01 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 178.292 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 3.0 t70 54.92 23.91 5.42 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.509 0.724 . . . . 0.0 111.244 -178.162 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 89.92 -23.34 20.91 Favored Glycine 0 N--CA 1.435 -1.427 0 C-N-CA 120.906 -0.664 . . . . 0.0 112.679 -178.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.504 HE21 HD23 ' A' ' 76' ' ' LEU . 9.7 pt20 -94.18 150.4 38.3 Favored Pre-proline 0 C--N 1.315 -0.912 0 O-C-N 122.516 -0.402 . . . . 0.0 110.954 -178.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -72.47 143.32 38.36 Favored 'Trans proline' 0 N--CA 1.462 -0.326 0 C-N-CA 122.434 2.089 . . . . 0.0 111.575 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.524 HD11 ' HB2' ' A' ' 62' ' ' PHE . 38.4 mt -93.31 143.08 12.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-O 120.977 0.417 . . . . 0.0 110.296 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -114.07 157.5 22.47 Favored 'General case' 0 CA--C 1.499 -0.985 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 178.037 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -74.11 -12.04 60.48 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-O 121.24 0.543 . . . . 0.0 110.445 178.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 11.6 p -95.11 6.28 49.5 Favored 'General case' 0 N--CA 1.438 -1.033 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 178.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -100.13 162.12 13.17 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.974 0.416 . . . . 0.0 111.238 178.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -116.18 155.34 48.31 Favored Pre-proline 0 C--N 1.318 -0.765 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.149 176.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -61.12 -34.6 89.27 Favored 'Trans proline' 0 C--N 1.348 0.526 0 C-N-CA 122.715 2.277 . . . . 0.0 111.779 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.72 -10.94 60.0 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.288 -179.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -77.05 -40.74 45.19 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 121.351 0.596 . . . . 0.0 109.758 179.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.504 HD23 HE21 ' A' ' 65' ' ' GLN . 0.3 OUTLIER -85.47 12.22 8.9 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.197 -179.604 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 43.61 43.69 4.86 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.293 1.037 . . . . 0.0 112.134 178.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.2 ptm -86.81 164.89 16.4 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.461 -178.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -117.68 167.82 11.0 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.86 0.362 . . . . 0.0 110.399 -178.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -60.96 142.74 56.23 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.639 0.733 . . . . 0.0 112.171 177.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 73.82 16.51 3.74 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 124.856 1.263 . . . . 0.0 111.506 178.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -77.47 162.09 27.44 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 177.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . 0.462 ' HA ' ' O ' ' A' ' 21' ' ' LYS . 37.1 m -116.34 139.01 50.86 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 121.661 0.743 . . . . 0.0 112.953 -175.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 44.6 mm -98.48 143.02 13.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.538 178.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -102.39 122.08 43.58 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.847 0.356 . . . . 0.0 110.702 178.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.473 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 76.7 t -115.0 137.86 47.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.717 0 CA-C-O 121.17 0.51 . . . . 0.0 110.932 178.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.521 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 5.3 p90 -136.26 153.04 51.31 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.458 -179.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -80.98 113.56 19.27 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.354 0.597 . . . . 0.0 111.479 -177.189 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 75.9 mm-40 -104.67 21.96 15.92 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-O 121.359 0.599 . . . . 0.0 110.083 176.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -61.96 138.49 58.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.05 -179.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 15.2 p -66.64 -44.53 81.69 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.171 0.51 . . . . 0.0 111.875 -178.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 104.61 -61.93 0.38 Allowed Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.818 -0.706 . . . . 0.0 111.5 -179.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.441 -0.968 0 CA-C-O 118.79 -1.006 . . . . 0.0 111.604 177.974 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 ptm . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 120.957 0.408 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -114.29 17.62 17.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.908 0.861 . . . . 0.0 109.273 179.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.3 p-10 -81.99 -7.32 59.6 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.083 -178.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -117.83 12.29 13.8 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.101 0.476 . . . . 0.0 110.51 178.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.402 ' HB3' ' HD2' ' A' ' 6' ' ' PRO . 38.7 mmtm -143.17 169.82 9.87 Favored Pre-proline 0 C--N 1.32 -0.686 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 -175.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.402 ' HD2' ' HB3' ' A' ' 5' ' ' LYS . 16.5 Cg_exo -65.9 175.85 4.23 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.344 2.029 . . . . 0.0 112.745 178.417 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.483 ' HD2' ' H ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -74.37 -5.82 44.56 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.312 179.156 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -67.74 133.48 49.34 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.179 0.514 . . . . 0.0 111.037 -178.074 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 125.49 -14.32 7.28 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.665 -177.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 5.1 p -81.18 110.12 16.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 121.464 0.649 . . . . 0.0 111.803 -179.143 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -120.75 99.28 6.44 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.067 178.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.0 t -121.93 141.97 50.75 Favored 'General case' 0 C--N 1.306 -1.284 0 O-C-N 122.022 -0.424 . . . . 0.0 109.967 178.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -50.35 147.3 4.46 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.385 0.612 . . . . 0.0 112.239 177.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 23.4 m-80 -139.98 10.88 2.41 Favored 'General case' 0 CA--C 1.509 -0.628 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 175.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -105.74 110.74 23.14 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 113.043 0.757 . . . . 0.0 113.043 -171.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.0 t0 50.51 48.85 21.85 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 114.666 1.358 . . . . 0.0 114.666 169.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 15.9 p-80 -122.37 148.1 45.48 Favored 'General case' 0 C--N 1.319 -0.732 0 O-C-N 121.714 -0.616 . . . . 0.0 110.922 175.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 44.3 pt -129.54 166.95 25.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 121.435 0.636 . . . . 0.0 111.656 -175.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.511 ' HB2' ' OH ' ' A' ' 33' ' ' ALY . 16.5 t-20 -97.29 139.94 32.51 Favored 'General case' 0 CA--C 1.506 -0.712 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.872 178.601 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.402 HD13 ' O ' ' A' ' 19' ' ' ASN . 3.0 mm? -130.93 139.98 50.13 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 176.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 47.3 mtmt -125.38 145.28 50.12 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-O 121.07 0.462 . . . . 0.0 110.515 -179.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.662 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 2.5 p -126.23 131.79 71.17 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.638 -178.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -112.57 131.71 55.48 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-O 121.195 0.522 . . . . 0.0 110.884 -178.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -96.94 176.44 31.97 Favored Glycine 0 N--CA 1.438 -1.178 0 CA-C-N 116.24 -0.437 . . . . 0.0 112.483 -179.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.588 ' H ' ' NE2' ' A' ' 25' ' ' GLN . 0.3 OUTLIER -69.39 -24.58 63.88 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.738 0.78 . . . . 0.0 110.739 -177.894 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 13.1 p-10 -83.93 -4.76 58.95 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.86 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 93.53 3.57 64.61 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.515 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.5 t -77.58 156.02 31.14 Favored 'General case' 0 C--N 1.322 -0.63 0 O-C-N 122.357 -0.496 . . . . 0.0 109.692 178.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.662 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.5 p -149.3 136.61 13.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-O 121.01 0.433 . . . . 0.0 110.587 -179.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.5 t -119.89 136.57 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.72 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 179.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -108.32 143.42 37.22 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.016 0.436 . . . . 0.0 110.785 -179.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.517 ' HE1' HG12 ' A' ' 22' ' ' VAL . 11.4 m-85 -139.4 154.5 47.83 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.085 0.469 . . . . 0.0 110.952 -178.064 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ALY . . . . . 0.511 ' OH ' ' HB2' ' A' ' 19' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 31.9 pt -134.48 165.12 32.33 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.007 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.468 -175.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 32.0 mtmm -75.27 146.85 40.73 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 120.833 0.349 . . . . 0.0 110.604 178.221 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.434 ' HA ' ' HG2' ' A' ' 73' ' ' PRO . 5.7 ppt_? -71.39 -11.1 60.72 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.435 0.636 . . . . 0.0 110.891 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -101.94 -4.07 26.76 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.441 ' HB ' ' O ' ' A' ' 35' ' ' LYS . 1.3 m -92.36 137.33 24.72 Favored Pre-proline 0 N--CA 1.44 -0.94 0 CA-C-N 114.441 -1.254 . . . . 0.0 109.918 178.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -60.45 130.61 34.44 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 122.599 2.2 . . . . 0.0 112.443 -179.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.469 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.2 pp -70.18 -17.34 63.16 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.154 -0.475 . . . . 0.0 112.011 -179.215 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.468 ' N ' HD12 ' A' ' 40' ' ' LEU . 3.8 p -53.49 -28.58 31.64 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.94 -179.645 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 29.5 mtpp -59.6 -47.38 85.79 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.281 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.8 pp -73.75 -36.28 65.11 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.797 -179.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 39.8 mtm -63.03 -49.41 74.7 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-O 121.068 0.461 . . . . 0.0 111.02 -178.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.446 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 42.9 mtpt -69.53 -33.32 72.62 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.919 0.39 . . . . 0.0 110.604 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.0 -36.53 84.29 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.302 0.572 . . . . 0.0 109.659 177.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -59.23 -54.31 48.34 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.762 177.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.496 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 24.2 p -65.18 -35.2 80.34 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 122.15 -0.344 . . . . 0.0 111.211 -177.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 45.0 mt-10 -65.49 -42.1 92.54 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-O 120.762 0.315 . . . . 0.0 111.359 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -80.08 -33.28 38.99 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 120.969 0.414 . . . . 0.0 111.723 -178.683 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.42 ' HB3' HD23 ' A' ' 53' ' ' LEU . 24.9 mm-40 -81.84 -22.13 37.19 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -177.141 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.43 ' C ' HD22 ' A' ' 53' ' ' LEU . . . 88.42 39.57 6.73 Favored Glycine 0 N--CA 1.437 -1.239 0 C-N-CA 119.858 -1.163 . . . . 0.0 111.113 -177.339 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.496 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 4.0 mm? -125.73 168.05 14.31 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.04 0.448 . . . . 0.0 110.104 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.5 m -125.26 158.65 33.6 Favored 'General case' 0 C--N 1.312 -1.025 0 O-C-N 122.142 -0.349 . . . . 0.0 110.72 177.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 18.2 mmt -64.99 -25.29 67.8 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-O 121.367 0.603 . . . . 0.0 111.69 -179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.442 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.97 -14.74 43.71 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.525 0.679 . . . . 0.0 110.819 176.379 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -94.33 -26.62 16.49 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.087 -179.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.7 pt -132.46 179.02 4.79 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-O 121.071 0.462 . . . . 0.0 110.942 179.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.41 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 3.8 mmt85 -153.81 140.54 19.02 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.602 178.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 28.6 m-85 -99.59 139.85 34.64 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.333 -179.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -145.11 136.08 24.73 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.249 0.547 . . . . 0.0 110.607 -177.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.584 ' HB2' HD11 ' A' ' 67' ' ' ILE . 85.7 t80 -141.29 146.86 37.31 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.001 -179.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 52.0 25.79 3.36 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.576 0.75 . . . . 0.0 111.82 -179.077 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.8 -11.67 68.1 Favored Glycine 0 N--CA 1.44 -1.098 0 C-N-CA 120.836 -0.697 . . . . 0.0 113.542 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.522 HE21 HD23 ' A' ' 76' ' ' LEU . 10.8 pt20 -109.01 150.37 40.85 Favored Pre-proline 0 C--N 1.319 -0.733 0 O-C-N 122.118 -0.636 . . . . 0.0 111.075 -179.358 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -71.98 139.81 33.68 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 122.613 2.208 . . . . 0.0 111.724 179.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.584 HD11 ' HB2' ' A' ' 62' ' ' PHE . 21.0 mt -94.75 146.92 6.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-O 120.94 0.4 . . . . 0.0 110.325 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -117.36 162.34 18.08 Favored 'General case' 0 CA--C 1.497 -1.072 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 176.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.456 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 10.0 pt-20 -70.7 -16.16 62.77 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-O 121.473 0.654 . . . . 0.0 110.489 178.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 17.3 p -86.6 -13.93 44.29 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -177.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.06 160.42 19.3 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 121.508 0.67 . . . . 0.0 112.518 -177.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -113.16 154.99 45.03 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.644 178.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.434 ' HG2' ' HA ' ' A' ' 36' ' ' ARG . 19.2 Cg_endo -59.37 -29.57 90.52 Favored 'Trans proline' 0 CA--C 1.531 0.359 0 C-N-CA 123.005 2.47 . . . . 0.0 111.785 178.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -75.78 -19.04 59.29 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.202 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -68.6 -42.64 77.88 Favored 'General case' 0 CA--C 1.51 -0.588 0 CA-C-O 121.726 0.774 . . . . 0.0 109.831 -179.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.522 HD23 HE21 ' A' ' 65' ' ' GLN . 0.4 OUTLIER -85.31 6.84 24.55 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.594 -179.792 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 43.39 43.22 4.2 Favored 'General case' 0 C--N 1.359 1.018 0 C-N-CA 124.381 1.073 . . . . 0.0 111.995 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.4 ptm -83.38 169.64 15.38 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.677 -178.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 12.5 pt-20 -117.2 168.3 10.43 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 110.097 -0.335 . . . . 0.0 110.097 -179.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -58.95 142.86 49.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.52 0.676 . . . . 0.0 111.842 175.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 73.62 16.02 3.97 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 124.674 1.189 . . . . 0.0 111.902 179.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.453 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 1.5 t0 -73.63 155.5 38.97 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.211 -0.596 . . . . 0.0 109.631 178.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 34.7 m -111.58 136.87 50.18 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.636 0.732 . . . . 0.0 112.746 -174.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 43.1 mm -99.52 138.61 23.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.765 178.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -98.22 120.44 38.63 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.817 0.342 . . . . 0.0 110.324 178.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.41 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 96.7 t -113.04 138.73 41.46 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.081 0 CA-C-O 121.064 0.459 . . . . 0.0 109.899 177.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 14.8 p90 -137.28 153.27 50.36 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.016 -179.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -80.03 116.6 20.25 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.364 0.602 . . . . 0.0 112.039 -176.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 71.1 mm-40 -110.54 18.99 19.18 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.63 176.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.539 ' HG2' ' H ' ' A' ' 92' ' ' GLY . 7.9 tt0 -54.64 120.05 6.16 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.819 -179.107 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 7.7 t -97.25 33.16 2.02 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.798 0.809 . . . . 0.0 110.562 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . 0.539 ' H ' ' HG2' ' A' ' 90' ' ' GLN . . . -161.72 43.37 0.38 Allowed Glycine 0 N--CA 1.444 -0.783 0 N-CA-C 111.488 -0.645 . . . . 0.0 111.488 -178.007 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.248 0 CA-C-O 118.293 -1.282 . . . . 0.0 111.477 -179.162 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 ptt? . . . . . 0 N--CA 1.481 1.086 0 CA-C-O 120.831 0.348 . . . . 0.0 111.621 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.6 10.25 13.79 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.585 0.707 . . . . 0.0 110.53 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -81.69 -16.52 51.01 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.766 -179.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -67.2 97.53 0.54 Allowed 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.399 -178.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.1 tmtp? 63.36 83.48 0.2 Allowed Pre-proline 0 CA--C 1.538 0.505 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.874 177.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -84.57 -170.69 0.85 Allowed 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 122.844 2.363 . . . . 0.0 112.301 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.408 ' C ' ' HD2' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -97.05 3.85 51.66 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.291 0.567 . . . . 0.0 111.26 -179.297 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -136.76 175.52 9.53 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.928 -176.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.17 -55.87 0.96 Allowed Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.816 -0.707 . . . . 0.0 111.497 178.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.8 p -111.02 121.31 63.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.27 0.557 . . . . 0.0 110.405 178.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.64 126.01 30.24 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.594 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.2 t -141.31 136.75 31.86 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 121.322 0.582 . . . . 0.0 110.999 -178.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -116.07 106.67 14.01 Favored 'General case' 0 CA--C 1.5 -0.948 0 CA-C-O 121.555 0.693 . . . . 0.0 110.907 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.452 ' N ' HD22 ' A' ' 14' ' ' ASN . 0.9 OUTLIER -106.63 133.73 50.86 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-N 115.347 -0.842 . . . . 0.0 108.902 -179.946 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -68.04 100.36 0.98 Allowed 'General case' 0 C--N 1.295 -1.774 0 CA-C-O 121.573 0.701 . . . . 0.0 111.381 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -78.09 94.94 4.77 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.945 -177.535 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.507 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 56.6 p-80 -122.37 154.53 37.56 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.635 -179.31 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 40.3 pt -131.19 169.39 21.79 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.078 0 CA-C-O 121.364 0.602 . . . . 0.0 110.885 -178.017 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -103.49 139.73 38.45 Favored 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 177.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.405 HD23 HG12 ' A' ' 34' ' ' ILE . 3.2 mm? -126.75 136.97 53.13 Favored 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 177.488 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.48 ' HG2' ' HG3' ' A' ' 31' ' ' GLN . 52.1 mtmt -124.12 139.08 54.28 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.269 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.733 HG22 HG13 ' A' ' 84' ' ' ILE . 61.0 t -124.65 130.58 73.4 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.387 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -175.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -115.56 135.82 53.7 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 -178.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -121.46 162.0 15.35 Favored Glycine 0 N--CA 1.445 -0.763 0 C-N-CA 120.449 -0.881 . . . . 0.0 112.871 -178.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.594 ' HG2' ' HA ' ' A' ' 87' ' ' PHE . 22.8 mm-40 -66.17 -11.73 51.3 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.503 0.668 . . . . 0.0 110.397 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -78.23 6.82 7.35 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.431 179.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 72.82 36.36 57.83 Favored Glycine 0 C--N 1.338 0.658 0 C-N-CA 120.696 -0.764 . . . . 0.0 113.405 178.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.4 t -143.24 160.92 39.57 Favored 'General case' 0 C--N 1.314 -0.948 0 O-C-N 122.14 -0.623 . . . . 0.0 111.35 -179.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.554 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.8 p -149.32 139.12 16.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.39 -179.027 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.516 HG11 ' HD3' ' A' ' 50' ' ' ARG . 7.9 t -124.31 142.46 41.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 O-C-N 122.119 -0.363 . . . . 0.0 110.43 -179.483 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.48 ' HG3' ' HG2' ' A' ' 21' ' ' LYS . 0.7 OUTLIER -107.98 141.15 40.07 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 120.916 0.389 . . . . 0.0 110.997 179.092 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -135.72 153.94 51.42 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.921 0.391 . . . . 0.0 111.111 -178.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.405 HG12 HD23 ' A' ' 20' ' ' LEU . 30.2 pt -137.23 166.52 25.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-O 121.086 0.469 . . . . 0.0 110.263 -178.701 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.507 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 36.9 mtmm -75.73 139.57 41.95 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 177.237 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.426 ' HA ' ' HG2' ' A' ' 73' ' ' PRO . 8.1 ppt_? -69.32 -11.99 61.29 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.448 0.642 . . . . 0.0 110.608 179.383 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 15.2 t-160 -99.23 2.53 45.75 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 122.181 0.991 . . . . 0.0 108.503 179.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.429 ' HB ' ' HB2' ' A' ' 35' ' ' LYS . 0.9 OUTLIER -103.4 143.29 26.32 Favored Pre-proline 0 N--CA 1.447 -0.599 0 CA-C-N 114.805 -1.089 . . . . 0.0 109.831 178.635 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -60.83 130.08 31.59 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 122.691 2.26 . . . . 0.0 112.493 -179.159 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.557 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.3 pp -70.34 -16.25 62.96 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.09 -0.504 . . . . 0.0 112.014 -179.41 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.459 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 0.1 OUTLIER -51.45 -29.6 16.79 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 122.955 0.502 . . . . 0.0 111.847 179.994 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -61.09 -47.85 84.41 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.222 0.534 . . . . 0.0 110.317 179.028 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.4 pp -73.5 -32.31 64.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.821 -178.724 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 46.7 mtm -62.76 -50.28 71.67 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.006 0.432 . . . . 0.0 111.018 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.45 ' HA ' ' SG ' ' A' ' 48' ' ' CYS . 81.0 mttt -66.97 -33.95 76.7 Favored 'General case' 0 N--CA 1.446 -0.646 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.104 178.484 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.72 -35.88 82.47 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.169 0.509 . . . . 0.0 109.936 179.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 55.2 t80 -62.61 -56.63 16.07 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.544 178.17 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.509 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 26.3 p -62.1 -36.25 81.16 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.728 0.299 . . . . 0.0 111.649 -177.326 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -64.23 -44.32 92.22 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 120.905 0.383 . . . . 0.0 111.605 179.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.516 ' HD3' HG11 ' A' ' 30' ' ' VAL . 14.0 ptm180 -80.57 -32.01 36.68 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.047 0.451 . . . . 0.0 111.464 -177.526 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -80.91 -23.32 39.03 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.114 0.483 . . . . 0.0 112.006 -178.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 88.59 36.07 8.18 Favored Glycine 0 C--N 1.306 -1.084 0 C-N-CA 120.321 -0.943 . . . . 0.0 111.483 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.509 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 3.8 mm? -119.86 160.52 22.49 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 178.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.409 ' HB2' ' OE1' ' A' ' 57' ' ' GLN . 67.3 m -114.33 157.69 22.46 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 122.162 -0.336 . . . . 0.0 110.227 179.138 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 16.7 mmt -64.66 -27.57 69.01 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.264 0.554 . . . . 0.0 111.208 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.565 ' O ' ' HA ' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -86.24 -7.59 58.42 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.427 0.632 . . . . 0.0 110.29 177.021 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.433 HE21 ' CB ' ' A' ' 90' ' ' GLN . 0.9 OUTLIER -97.84 -19.83 17.9 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.59 -178.989 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.583 HG22 HE21 ' A' ' 88' ' ' GLN . 14.8 pt -144.88 -177.39 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 CA-C-O 121.102 0.477 . . . . 0.0 111.241 -177.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.409 ' CG ' ' HG3' ' A' ' 89' ' ' GLN . 16.8 mmt180 -155.58 141.45 18.12 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.56 177.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -96.63 139.82 32.14 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 178.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -140.4 139.83 35.37 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.245 0.545 . . . . 0.0 110.905 -178.153 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.53 ' HB2' HD11 ' A' ' 67' ' ' ILE . 64.3 t80 -144.88 147.01 32.29 Favored 'General case' 0 C--O 1.21 -1.017 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.956 178.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 9.8 t70 57.0 23.45 8.36 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 121.633 0.73 . . . . 0.0 110.805 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 83.6 -2.69 86.95 Favored Glycine 0 N--CA 1.429 -1.791 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.816 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.506 HE21 HD23 ' A' ' 76' ' ' LEU . 13.0 pt20 -115.14 148.74 41.3 Favored Pre-proline 0 C--N 1.323 -0.549 0 O-C-N 122.293 -0.534 . . . . 0.0 110.645 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -69.33 142.94 51.29 Favored 'Trans proline' 0 C--O 1.236 0.392 0 C-N-CA 122.323 2.015 . . . . 0.0 111.836 179.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.53 HD11 ' HB2' ' A' ' 62' ' ' PHE . 32.4 mt -96.4 146.24 7.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 120.972 0.415 . . . . 0.0 110.53 -179.422 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -126.21 170.32 11.95 Favored 'General case' 0 CA--C 1.504 -0.81 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 178.399 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.459 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 11.2 pt-20 -70.32 -19.04 63.1 Favored 'General case' 0 C--N 1.31 -1.138 0 CA-C-O 120.982 0.42 . . . . 0.0 111.657 -179.663 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.3 t -90.93 3.67 54.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.193 0.521 . . . . 0.0 111.288 -178.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.7 142.09 28.41 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-O 121.423 0.63 . . . . 0.0 111.412 178.172 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.695 ' HB ' ' OE1' ' A' ' 75' ' ' GLN . 1.1 m -112.48 140.69 24.07 Favored Pre-proline 0 C--N 1.317 -0.82 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.487 ' HD2' HG22 ' A' ' 72' ' ' THR . 15.7 Cg_endo -54.23 -33.75 76.55 Favored 'Trans proline' 0 N--CA 1.481 0.76 0 C-N-CA 123.478 2.785 . . . . 0.0 113.244 -176.699 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.45 -27.12 64.97 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.0 0.429 . . . . 0.0 111.574 -178.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.695 ' OE1' ' HB ' ' A' ' 72' ' ' THR . 5.9 mp0 -68.29 -32.61 72.88 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.053 0.454 . . . . 0.0 111.564 -178.855 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.506 HD23 HE21 ' A' ' 65' ' ' GLN . 0.8 OUTLIER -92.58 10.07 31.94 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.005 0.431 . . . . 0.0 110.045 179.9 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 43.62 41.16 3.32 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.598 1.159 . . . . 0.0 112.264 179.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 5.9 ptm -80.3 163.62 23.8 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.5 -178.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -107.48 165.96 11.02 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.129 -177.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -59.48 143.23 50.58 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 121.448 0.642 . . . . 0.0 110.802 171.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 69.55 19.15 7.55 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.032 -0.985 . . . . 0.0 111.67 -179.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -62.49 149.27 43.28 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.186 176.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 9.0 m -102.05 122.09 43.44 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 121.597 0.713 . . . . 0.0 112.052 -177.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.733 HG13 HG22 ' A' ' 22' ' ' VAL . 14.0 mm -93.22 139.15 18.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.658 179.033 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -97.57 118.79 34.87 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 120.989 0.423 . . . . 0.0 110.687 179.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 43.5 t -114.06 133.11 61.1 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 CA-C-O 121.406 0.622 . . . . 0.0 110.114 176.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.594 ' HA ' ' HG2' ' A' ' 25' ' ' GLN . 24.2 p90 -134.39 153.37 51.94 Favored 'General case' 0 C--N 1.3 -1.587 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.431 -178.355 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.583 HE21 HG22 ' A' ' 58' ' ' ILE . 0.6 OUTLIER -62.27 157.9 18.5 Favored 'General case' 0 C--N 1.309 -1.166 0 CA-C-O 121.12 0.486 . . . . 0.0 110.747 179.711 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.437 ' HG2' ' O ' ' A' ' 88' ' ' GLN . 35.0 mm-40 -163.07 17.4 0.08 Allowed 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.696 -177.197 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.565 ' HA ' ' O ' ' A' ' 56' ' ' ARG . 0.6 OUTLIER -65.85 107.09 1.71 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.764 0.792 . . . . 0.0 111.337 -178.629 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 10.0 m -136.45 117.31 14.15 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.855 -179.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -177.18 155.52 18.18 Favored Glycine 0 N--CA 1.444 -0.817 0 C-N-CA 120.528 -0.844 . . . . 0.0 112.038 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.125 0 CA-C-O 118.674 -1.07 . . . . 0.0 111.744 179.741 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.1 ttt . . . . . 0 N--CA 1.473 0.712 0 CA-C-O 121.076 0.465 . . . . 0.0 112.149 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -101.83 10.46 39.86 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 112.873 0.694 . . . . 0.0 112.873 -175.902 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -78.08 -27.06 48.43 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.049 0.452 . . . . 0.0 111.045 179.044 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -63.09 94.59 0.07 Allowed 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.133 0.492 . . . . 0.0 111.187 179.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -170.42 106.93 0.43 Allowed Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.051 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.405 ' HB2' ' HG2' ' A' ' 8' ' ' GLU . 1.2 Cg_endo -83.76 170.73 11.2 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 122.9 2.4 . . . . 0.0 113.372 -178.407 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.94 -27.88 2.41 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.967 173.182 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.405 ' HG2' ' HB2' ' A' ' 6' ' ' PRO . 6.9 pt-20 -91.51 149.72 21.55 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 120.935 0.397 . . . . 0.0 109.964 179.542 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -67.64 -53.88 21.9 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.955 -0.641 . . . . 0.0 112.362 -177.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 12.2 p -143.71 151.25 16.66 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.172 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 178.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.8 tptt -83.54 154.38 23.86 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 109.851 -0.425 . . . . 0.0 109.851 -177.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.2 t -150.21 164.7 35.01 Favored 'General case' 0 C--N 1.316 -0.865 0 O-C-N 122.139 -0.351 . . . . 0.0 110.453 179.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 67.02 74.82 0.32 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.674 0.79 . . . . 0.0 112.318 -178.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 70.7 85.01 0.14 Allowed 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.788 177.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 71.6 m-20 -102.6 -154.52 0.49 Allowed 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.846 -178.082 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.48 ' O ' ' HG2' ' A' ' 36' ' ' ARG . 7.3 p-10 -75.41 10.17 1.78 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.094 0.473 . . . . 0.0 112.077 -178.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 11.5 p-80 -114.69 136.17 53.35 Favored 'General case' 0 C--N 1.311 -1.089 0 O-C-N 121.893 -0.505 . . . . 0.0 109.681 177.46 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 43.5 pt -128.01 167.47 23.01 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.072 0 CA-C-O 121.105 0.478 . . . . 0.0 111.036 -176.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.51 ' HA ' ' O ' ' A' ' 32' ' ' PHE . 45.1 t-20 -107.18 128.03 54.05 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.719 -0.475 . . . . 0.0 109.719 179.412 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -118.64 134.06 55.39 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 178.156 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.4 mtmp? -115.37 149.18 38.35 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-O 120.999 0.428 . . . . 0.0 109.979 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.701 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 2.7 p -125.15 129.01 73.3 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.011 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.693 -177.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -110.64 120.84 43.72 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.058 0.456 . . . . 0.0 109.836 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.52 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -92.88 156.07 22.81 Favored Glycine 0 N--CA 1.427 -1.946 0 C-N-CA 120.575 -0.822 . . . . 0.0 112.837 -178.673 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.56 -13.42 1.56 Allowed 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 178.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -90.3 -13.3 35.54 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.131 0.491 . . . . 0.0 110.728 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 104.94 6.56 39.82 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 121.01 -0.614 . . . . 0.0 112.225 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 40.1 t -89.83 155.53 19.1 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 120.821 0.343 . . . . 0.0 110.421 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.701 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.7 p -147.95 134.59 13.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 CA-C-O 121.096 0.474 . . . . 0.0 110.714 178.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.5 t -122.22 139.23 49.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -107.74 142.79 37.2 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 120.741 0.305 . . . . 0.0 110.907 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.529 ' HE1' HG12 ' A' ' 22' ' ' VAL . 10.1 m-85 -140.73 146.79 38.22 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-O 121.318 0.58 . . . . 0.0 111.587 -178.422 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 39.9 pt -131.89 173.84 14.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 120.965 0.412 . . . . 0.0 110.594 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 28.9 mtmm -87.66 150.14 23.83 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 120.923 0.392 . . . . 0.0 110.421 178.274 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.48 ' HG2' ' O ' ' A' ' 16' ' ' ASP . 23.8 ptt180 -62.68 -24.33 67.58 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.488 0.661 . . . . 0.0 111.099 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 14.6 t60 -103.11 1.72 33.67 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.883 0.849 . . . . 0.0 109.594 -177.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.1 m -92.56 139.35 23.7 Favored Pre-proline 0 C--N 1.31 -1.123 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.878 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.76 128.64 19.32 Favored 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 121.934 1.756 . . . . 0.0 112.185 -177.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.529 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.0 OUTLIER -66.83 -16.86 64.57 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.844 -0.616 . . . . 0.0 112.01 -179.445 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.562 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 1.0 OUTLIER -52.14 -29.87 24.01 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 120.921 0.391 . . . . 0.0 111.882 179.607 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 35.3 mtpt -62.83 -44.58 95.75 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-O 120.996 0.427 . . . . 0.0 110.417 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.9 pp -73.47 -33.9 65.09 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 120.896 0.379 . . . . 0.0 110.29 178.71 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 47.8 mtm -62.12 -49.31 76.4 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 121.32 0.581 . . . . 0.0 110.411 -179.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -68.65 -35.3 77.07 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.073 178.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.13 -33.13 75.06 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.309 0.576 . . . . 0.0 109.826 178.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 62.3 t80 -63.72 -55.19 25.2 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.797 178.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.427 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 25.3 p -63.13 -35.82 81.56 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.803 0.335 . . . . 0.0 110.922 -178.082 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -61.75 -48.63 79.83 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-O 121.035 0.445 . . . . 0.0 111.422 178.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -76.72 -31.08 56.92 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.967 0.413 . . . . 0.0 111.383 -177.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -82.77 -21.96 34.47 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.4 0.518 . . . . 0.0 112.4 -178.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 93.75 8.13 60.95 Favored Glycine 0 CA--C 1.523 0.561 0 C-N-CA 120.268 -0.968 . . . . 0.0 113.319 179.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.427 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 3.2 mm? -97.98 173.74 6.91 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 122.205 -0.585 . . . . 0.0 111.01 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 71.7 m -122.27 157.8 30.91 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-O 120.719 0.295 . . . . 0.0 111.154 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.7 mmt -63.7 -27.28 69.1 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 121.118 0.485 . . . . 0.0 112.247 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.73 -12.61 53.42 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.636 0.731 . . . . 0.0 109.944 177.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -93.66 -30.97 14.65 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.699 -177.721 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 9.6 pt -132.56 177.34 7.26 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-O 121.132 0.492 . . . . 0.0 111.5 -177.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.403 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 12.9 mmt180 -150.1 143.77 25.3 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.164 179.407 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -100.9 141.44 33.78 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.705 179.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -142.99 139.34 30.59 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-O 121.19 0.519 . . . . 0.0 111.118 -177.002 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.547 ' HB2' HD11 ' A' ' 67' ' ' ILE . 72.5 t80 -144.61 145.92 32.03 Favored 'General case' 0 C--O 1.214 -0.767 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 16.7 t70 57.43 23.44 9.04 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 121.885 0.85 . . . . 0.0 109.962 -178.357 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.77 -25.88 8.05 Favored Glycine 0 N--CA 1.426 -1.977 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.548 -178.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.414 HE21 HD23 ' A' ' 76' ' ' LEU . 12.4 pt20 -90.25 149.26 40.95 Favored Pre-proline 0 C--N 1.323 -0.561 0 O-C-N 122.582 -0.363 . . . . 0.0 111.301 -177.427 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -71.7 141.58 37.98 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 122.206 1.938 . . . . 0.0 111.391 178.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.547 HD11 ' HB2' ' A' ' 62' ' ' PHE . 39.0 mt -91.9 149.27 4.18 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-O 120.964 0.411 . . . . 0.0 110.905 -177.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -115.53 175.57 5.46 Favored 'General case' 0 CA--C 1.502 -0.903 0 N-CA-C 108.725 -0.842 . . . . 0.0 108.725 177.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.562 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 0.2 OUTLIER -77.5 -20.67 53.96 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-O 121.503 0.668 . . . . 0.0 110.223 179.423 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 9.8 t -95.22 8.59 42.6 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.843 0.83 . . . . 0.0 110.529 -178.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -78.49 134.97 37.26 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.0 178.006 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.27 137.42 21.52 Favored Pre-proline 0 C--N 1.311 -1.074 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.035 176.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.593 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 10.9 Cg_endo -55.81 -34.13 90.31 Favored 'Trans proline' 0 C--O 1.236 0.375 0 C-N-CA 123.027 2.485 . . . . 0.0 112.477 -177.622 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.25 -17.39 61.34 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.795 -179.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.6 -33.66 53.7 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.916 0.388 . . . . 0.0 110.98 -179.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.414 HD23 HE21 ' A' ' 65' ' ' GLN . 0.7 OUTLIER -89.86 -2.85 58.29 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.24 0.543 . . . . 0.0 109.974 178.662 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 57.01 36.75 28.18 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.862 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.593 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.9 ptm -76.27 160.83 29.28 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.635 -178.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.491 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 12.3 pt-20 -112.51 166.11 11.62 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-O 120.854 0.359 . . . . 0.0 110.469 -177.285 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -62.76 148.27 47.26 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-O 121.343 0.592 . . . . 0.0 110.975 174.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 73.07 13.52 4.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.424 -179.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.491 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 2.2 t0 -74.66 158.66 33.23 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.798 -0.361 . . . . 0.0 110.154 178.494 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 39.6 m -116.01 136.59 52.89 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.783 0.801 . . . . 0.0 112.982 -176.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.429 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 44.5 mm -97.26 140.94 16.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.371 178.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -99.11 117.38 33.46 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.707 0.289 . . . . 0.0 110.28 179.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.52 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 73.0 t -113.52 136.11 50.95 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 CA-C-O 121.432 0.634 . . . . 0.0 110.671 178.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.5 p90 -137.34 155.26 49.63 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.075 -178.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -80.83 111.91 17.72 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.187 0.517 . . . . 0.0 110.999 -176.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 64.4 mm-40 -109.49 30.95 6.16 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.744 179.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -62.18 96.45 0.07 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.177 0.513 . . . . 0.0 110.329 178.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.4 p -144.02 149.09 36.15 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.296 -179.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 111.02 -33.57 5.81 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.749 -0.738 . . . . 0.0 111.793 -179.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.263 0 CA-C-O 118.59 -1.117 . . . . 0.0 111.333 179.013 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ptt? . . . . . 0 N--CA 1.476 0.859 0 CA-C-O 121.114 0.483 . . . . 0.0 111.403 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -124.42 25.72 7.56 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 122.135 0.969 . . . . 0.0 108.601 178.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -85.25 -0.05 53.44 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.915 -1.038 . . . . 0.0 112.004 -177.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.486 ' O ' ' HG2' ' A' ' 5' ' ' LYS . 36.7 mt-10 -113.84 98.27 6.91 Favored 'General case' 0 C--N 1.321 -0.636 0 O-C-N 122.298 -0.251 . . . . 0.0 110.499 177.624 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.486 ' HG2' ' O ' ' A' ' 4' ' ' GLU . 13.9 pttp 54.91 166.1 0.05 OUTLIER Pre-proline 0 N--CA 1.485 1.286 0 C-N-CA 124.773 1.229 . . . . 0.0 112.201 -178.602 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.411 ' HD2' ' HB2' ' A' ' 5' ' ' LYS . 86.9 Cg_endo -83.33 -177.23 3.15 Favored 'Trans proline' 0 C--O 1.241 0.631 0 C-N-CA 121.995 1.797 . . . . 0.0 111.356 176.358 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.505 ' HD2' ' HG3' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -98.44 -16.6 19.18 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.336 0.588 . . . . 0.0 110.863 178.539 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.505 ' HG3' ' HD2' ' A' ' 7' ' ' LYS . 0.8 OUTLIER -125.84 144.94 50.45 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.858 174.967 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -153.0 86.58 0.14 Allowed Glycine 0 N--CA 1.439 -1.138 0 C-N-CA 120.007 -1.092 . . . . 0.0 112.592 -177.078 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 46.3 t -67.12 131.91 32.57 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 177.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 25.6 tptp -65.76 106.76 1.59 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.478 0.656 . . . . 0.0 111.126 -177.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -140.03 -167.47 2.31 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.688 178.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -78.38 78.33 4.85 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-O 121.487 0.661 . . . . 0.0 109.461 176.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.4 m120 -91.54 -25.02 19.43 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-O 121.223 0.535 . . . . 0.0 111.097 -176.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 39.9 m-80 -103.25 126.21 50.3 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-O 121.142 0.496 . . . . 0.0 110.559 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -80.96 104.75 11.68 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 122.288 1.042 . . . . 0.0 109.448 -179.109 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.498 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 43.9 p-80 -121.11 163.03 19.03 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.753 -175.154 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 31.5 pt -133.5 170.97 18.85 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.835 178.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -107.46 134.03 51.09 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.405 HD23 HG12 ' A' ' 34' ' ' ILE . 2.9 mm? -125.05 139.14 54.06 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 177.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 30' ' ' VAL . 52.3 mtmt -121.8 143.43 49.4 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.281 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.728 HG22 HG13 ' A' ' 84' ' ' ILE . 65.8 t -121.68 128.87 75.86 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -179.238 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -108.51 134.97 50.55 Favored 'General case' 0 C--O 1.245 0.835 0 CA-C-O 121.377 0.608 . . . . 0.0 111.092 -177.096 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -96.18 170.68 27.58 Favored Glycine 0 N--CA 1.428 -1.847 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.899 179.136 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.634 ' H ' ' NE2' ' A' ' 25' ' ' GLN . 0.0 OUTLIER -69.78 -25.46 63.81 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 121.207 0.527 . . . . 0.0 110.498 -176.568 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -84.66 -2.85 58.08 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.161 -178.049 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 94.9 7.61 59.75 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 120.197 -1.002 . . . . 0.0 113.515 179.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 37.0 t -85.45 155.25 21.33 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 177.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.496 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 5.3 p -150.82 143.05 16.91 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-O 121.164 0.507 . . . . 0.0 111.021 -179.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.606 HG11 ' HD3' ' A' ' 50' ' ' ARG . 16.4 t -123.63 140.48 47.04 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 178.614 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -106.2 138.66 42.0 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 120.999 0.428 . . . . 0.0 110.356 179.104 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.403 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 16.4 m-85 -132.3 153.03 51.1 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.047 0.451 . . . . 0.0 110.895 -177.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.541 HD13 HD23 ' A' ' 43' ' ' LEU . 20.9 pt -133.03 167.54 26.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-O 121.17 0.51 . . . . 0.0 110.777 -178.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.533 ' HB2' ' OG1' ' A' ' 38' ' ' THR . 46.6 mtpt -81.83 148.25 28.94 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.267 179.108 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 6.9 ppt_? -69.01 -16.84 63.82 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.829 0.347 . . . . 0.0 111.397 -179.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 11.4 t-80 -100.95 -3.5 29.41 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 122.291 1.043 . . . . 0.0 108.52 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.533 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 2.4 m -90.81 137.28 26.96 Favored Pre-proline 0 N--CA 1.432 -1.334 0 CA-C-N 114.41 -1.268 . . . . 0.0 110.429 -179.184 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_endo -61.6 129.15 26.83 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.39 2.06 . . . . 0.0 112.04 -179.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.734 HD13 ' SD ' ' A' ' 44' ' ' MET . 0.4 OUTLIER -69.36 -17.95 63.74 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.02 -0.537 . . . . 0.0 112.317 -178.868 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.571 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 7.8 p -50.93 -32.46 20.86 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 122.995 0.518 . . . . 0.0 111.658 179.01 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 48.1 mtpt -59.8 -48.34 82.08 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.446 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.6 pp -71.42 -33.78 69.72 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.234 0.54 . . . . 0.0 110.075 179.106 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.734 ' SD ' HD13 ' A' ' 40' ' ' LEU . 38.5 mtp -60.6 -49.28 78.18 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.183 0.516 . . . . 0.0 111.053 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 27.6 mmtp -67.23 -35.89 80.52 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.77 177.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.443 ' O ' ' HG2' ' A' ' 50' ' ' ARG . . . -63.68 -39.26 93.89 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 121.23 0.538 . . . . 0.0 110.186 179.326 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -57.81 -55.37 35.75 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.231 177.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.589 ' SG ' HD11 ' A' ' 58' ' ' ILE . 32.5 m -59.92 -41.26 91.37 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.104 -178.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -65.68 -39.91 91.79 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.184 0.438 . . . . 0.0 112.184 -179.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.606 ' HD3' HG11 ' A' ' 30' ' ' VAL . 14.6 ptm180 -82.08 -35.7 28.38 Favored 'General case' 0 C--N 1.329 -0.313 0 O-C-N 121.912 -0.492 . . . . 0.0 111.578 -178.822 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.425 ' HB3' HD23 ' A' ' 53' ' ' LEU . 24.9 mm-40 -77.67 -22.37 50.67 Favored 'General case' 0 CA--C 1.502 -0.896 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -179.19 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 84.48 42.8 7.21 Favored Glycine 0 N--CA 1.427 -1.957 0 C-N-CA 119.773 -1.203 . . . . 0.0 111.168 -177.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.425 HD23 ' HB3' ' A' ' 51' ' ' GLN . 4.0 mm? -122.8 164.17 18.86 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 178.687 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.8 m -113.58 150.25 33.31 Favored 'General case' 0 N--CA 1.44 -0.968 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 178.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 10.6 mmt -59.32 -29.16 67.44 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-O 121.3 0.571 . . . . 0.0 111.651 178.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.438 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -84.87 -13.58 50.5 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.511 0.672 . . . . 0.0 110.651 178.241 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -91.45 -19.07 23.24 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.77 -178.428 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.589 HD11 ' SG ' ' A' ' 48' ' ' CYS . 16.3 pt -139.41 -176.46 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-O 121.118 0.485 . . . . 0.0 111.026 -178.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.417 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 7.2 mmt180 -157.14 131.68 8.62 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.678 177.228 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -89.38 145.5 25.3 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.514 178.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.598 ' HD3' ' CA ' ' A' ' 64' ' ' GLY . 7.2 tmm_? -150.65 145.52 25.9 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-O 121.137 0.494 . . . . 0.0 110.596 -176.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.422 ' HB2' HD11 ' A' ' 67' ' ' ILE . 68.9 t80 -146.88 147.13 30.5 Favored 'General case' 0 C--O 1.216 -0.709 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.423 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 18.8 t70 55.83 23.75 6.75 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-O 121.753 0.787 . . . . 0.0 110.517 -177.199 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.598 ' CA ' ' HD3' ' A' ' 61' ' ' ARG . . . 83.9 -16.38 32.48 Favored Glycine 0 N--CA 1.428 -1.863 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.698 -179.182 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.575 ' O ' ' HG2' ' A' ' 61' ' ' ARG . 12.2 pt20 -97.1 148.0 33.76 Favored Pre-proline 0 CA--C 1.537 0.474 0 O-C-N 122.619 -0.342 . . . . 0.0 110.603 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -68.58 141.19 49.59 Favored 'Trans proline' 0 CA--C 1.53 0.325 0 C-N-CA 122.572 2.181 . . . . 0.0 112.337 -179.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.422 HD11 ' HB2' ' A' ' 62' ' ' PHE . 50.3 mt -90.25 146.78 5.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 179.46 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.662 HD22 ' HB2' ' A' ' 71' ' ' ASP . 0.2 OUTLIER -116.45 164.67 14.21 Favored 'General case' 0 CA--C 1.498 -1.054 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.463 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.571 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 9.5 pt-20 -75.84 -18.0 59.61 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 121.679 0.752 . . . . 0.0 109.859 177.649 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 23.5 p -93.0 1.65 57.2 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.735 -176.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.662 ' HB2' HD22 ' A' ' 68' ' ' ASN . 14.4 t70 -101.56 159.64 15.13 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 121.817 -0.552 . . . . 0.0 111.103 -177.585 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -114.79 151.31 45.29 Favored Pre-proline 0 C--O 1.219 -0.509 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 178.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.86 -29.86 91.31 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.978 2.452 . . . . 0.0 112.116 -179.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.45 -17.84 61.74 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.214 -179.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -68.25 -41.51 81.04 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-O 121.64 0.733 . . . . 0.0 110.382 -178.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.481 HD23 HE21 ' A' ' 65' ' ' GLN . 0.8 OUTLIER -86.75 2.93 47.05 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.862 -174.634 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 56.55 33.21 22.26 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-O 121.399 0.619 . . . . 0.0 111.044 178.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.414 ' HE1' HD11 ' A' ' 84' ' ' ILE . 6.9 ptm -77.96 156.77 30.03 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.097 -177.766 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.575 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 12.3 pt-20 -107.08 162.61 13.71 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.274 -177.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -58.72 138.49 57.04 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.146 0.498 . . . . 0.0 111.127 174.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 77.21 19.54 1.3 Allowed 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 124.665 1.186 . . . . 0.0 110.613 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.575 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 0.7 OUTLIER -70.54 152.1 44.33 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.145 177.985 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 31.5 m -106.85 121.49 44.51 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.527 0.679 . . . . 0.0 112.694 -176.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.728 HG13 HG22 ' A' ' 22' ' ' VAL . 18.3 mm -85.3 140.53 15.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.232 176.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -102.23 116.18 32.12 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 120.837 0.351 . . . . 0.0 110.926 -179.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.417 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 72.3 t -109.69 138.43 37.26 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.938 0 CA-C-O 120.963 0.411 . . . . 0.0 110.471 177.378 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 7.6 p90 -133.99 149.01 51.2 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 116.092 -0.503 . . . . 0.0 109.817 178.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.417 ' NE2' HG22 ' A' ' 58' ' ' ILE . 0.0 OUTLIER -75.5 131.72 40.28 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.789 0.804 . . . . 0.0 112.168 -176.607 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 -105.78 17.28 23.97 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.162 -0.926 . . . . 0.0 111.772 178.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.462 ' HA ' ' OE1' ' A' ' 90' ' ' GLN . 6.0 tp60 -131.22 125.75 33.73 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.83 -0.433 . . . . 0.0 109.83 -179.316 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 7.8 p -82.89 -47.76 11.47 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 -178.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -66.28 -60.45 6.32 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.947 -0.644 . . . . 0.0 112.373 -179.173 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.246 0 CA-C-O 118.793 -1.004 . . . . 0.0 112.05 179.232 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.1 ptt? . . . . . 0 N--CA 1.485 1.301 0 CA-C-O 121.025 0.44 . . . . 0.0 110.959 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -168.03 22.07 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.888 0.851 . . . . 0.0 109.059 -178.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -108.04 -31.55 7.91 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.164 -176.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -92.96 29.19 1.88 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.617 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.9 ptpp? -148.3 152.76 39.76 Favored Pre-proline 0 N--CA 1.435 -1.189 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 179.191 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_exo -70.14 -168.17 0.28 Allowed 'Trans proline' 0 CA--C 1.533 0.457 0 C-N-CA 122.618 2.212 . . . . 0.0 111.972 178.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.443 ' HD2' ' H ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -63.31 -4.1 2.37 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.832 177.811 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -62.63 97.06 0.09 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.057 0.456 . . . . 0.0 111.552 -179.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 91.86 21.15 34.41 Favored Glycine 0 N--CA 1.446 -0.681 0 C-N-CA 120.851 -0.69 . . . . 0.0 113.017 178.244 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 12.6 p -72.63 131.16 35.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 O-C-N 122.315 -0.521 . . . . 0.0 110.618 179.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -159.1 147.02 17.73 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 120.751 0.31 . . . . 0.0 110.77 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.6 t -72.53 150.47 43.15 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 175.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -109.9 148.74 31.02 Favored 'General case' 0 CA--C 1.501 -0.918 0 CA-C-O 121.577 0.703 . . . . 0.0 112.074 -177.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -66.45 103.7 1.09 Allowed 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.58 178.34 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -121.64 -80.86 0.63 Allowed 'General case' 0 C--N 1.315 -0.918 0 CA-C-O 120.965 0.412 . . . . 0.0 111.535 -179.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -64.72 80.77 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.99 1.107 . . . . 0.0 113.99 -177.198 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.48 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 24.8 p-80 -119.85 143.07 48.1 Favored 'General case' 0 C--N 1.32 -0.703 0 O-C-N 121.967 -0.458 . . . . 0.0 110.813 175.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 42.1 pt -129.65 171.21 17.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.277 0.56 . . . . 0.0 110.416 178.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.523 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 23.4 t-20 -110.5 135.72 50.73 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.099 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -124.65 143.57 50.66 Favored 'General case' 0 C--N 1.306 -1.308 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 177.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.436 ' HG2' ' HG3' ' A' ' 31' ' ' GLN . 54.6 mtmt -126.48 140.74 52.23 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-O 121.22 0.533 . . . . 0.0 109.826 179.262 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.749 HG22 HG13 ' A' ' 84' ' ' ILE . 60.1 t -122.99 131.96 72.31 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 -178.488 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.06 129.25 55.45 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 -178.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.454 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -105.66 156.95 16.41 Favored Glycine 0 N--CA 1.428 -1.872 0 C-N-CA 120.193 -1.003 . . . . 0.0 111.962 -179.388 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.24 -9.48 0.43 Allowed 'General case' 0 CA--C 1.55 0.96 0 N-CA-C 113.552 0.945 . . . . 0.0 113.552 178.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -82.48 -21.22 35.63 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.3 0.571 . . . . 0.0 110.208 178.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 105.51 3.52 40.6 Favored Glycine 0 CA--C 1.508 -0.394 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.7 t -91.03 152.66 20.57 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.514 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 3.2 p -148.35 137.02 15.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.161 0.505 . . . . 0.0 110.145 -178.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.418 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 3.8 t -125.99 141.72 44.82 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 O-C-N 122.108 -0.37 . . . . 0.0 110.516 -177.777 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.44 ' HB3' HD21 ' A' ' 19' ' ' ASN . 0.8 OUTLIER -106.07 141.71 36.98 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.195 179.166 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.449 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 20.1 m-85 -134.4 153.03 52.13 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.172 0.51 . . . . 0.0 110.99 -177.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.435 HD13 HD23 ' A' ' 43' ' ' LEU . 33.7 pt -140.71 175.42 6.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.908 0.385 . . . . 0.0 110.177 -178.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.524 ' HB2' ' OG1' ' A' ' 38' ' ' THR . 22.5 mtpp -85.89 151.23 23.94 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-O 121.131 0.491 . . . . 0.0 110.417 177.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -64.32 -25.1 67.89 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.072 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 19.5 t-160 -102.39 1.07 34.96 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.998 0.904 . . . . 0.0 109.25 -176.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.524 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.6 m -91.8 136.04 26.82 Favored Pre-proline 0 C--N 1.3 -1.575 0 CA-C-N 114.828 -1.078 . . . . 0.0 109.965 -179.26 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -58.23 125.85 19.74 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.597 2.198 . . . . 0.0 112.341 -179.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.583 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.3 pp -68.4 -16.8 64.05 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.039 -179.059 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.459 ' N ' HD12 ' A' ' 40' ' ' LEU . 26.2 t -51.19 -31.95 21.89 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 121.006 0.431 . . . . 0.0 111.125 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 25.3 mtpp -56.52 -50.49 71.68 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.305 0.574 . . . . 0.0 110.802 178.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.6 pp -71.5 -32.74 68.57 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.991 -179.082 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 49.5 mtm -64.0 -42.99 96.99 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.224 0.535 . . . . 0.0 110.731 -179.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.619 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 1.4 mmpt? -68.04 -38.94 83.09 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.54 177.491 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.19 -35.5 80.51 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-O 121.174 0.511 . . . . 0.0 110.068 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.523 ' CE2' ' HG3' ' A' ' 51' ' ' GLN . 64.4 t80 -61.79 -54.9 35.98 Favored 'General case' 0 N--CA 1.438 -1.046 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.081 177.434 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.629 ' SG ' HD11 ' A' ' 58' ' ' ILE . 30.4 m -58.89 -39.04 80.27 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.127 0.489 . . . . 0.0 110.993 -179.146 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.619 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 73.6 mm-40 -59.84 -52.79 63.92 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.006 0.431 . . . . 0.0 111.399 178.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' ' 47' ' ' TYR . 9.6 ptp180 -71.17 -36.05 71.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.993 0.425 . . . . 0.0 111.965 -177.046 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.523 ' HG3' ' CE2' ' A' ' 47' ' ' TYR . 24.3 mm-40 -72.68 -16.95 61.68 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -179.157 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 74.9 38.04 42.56 Favored Glycine 0 N--CA 1.435 -1.381 0 N-CA-C 109.448 -1.461 . . . . 0.0 109.448 -174.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.617 HD23 HG21 ' A' ' 58' ' ' ILE . 3.7 mp -123.41 165.66 16.67 Favored 'General case' 0 N--CA 1.433 -1.292 0 C-N-CA 123.631 0.772 . . . . 0.0 109.376 -175.431 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.426 ' HB2' ' OE1' ' A' ' 57' ' ' GLN . 61.8 m -124.88 158.09 34.34 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-O 120.67 0.272 . . . . 0.0 111.082 178.362 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.8 mmt -61.56 -30.2 70.5 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-O 121.069 0.461 . . . . 0.0 111.998 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.57 -13.36 51.97 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.615 0.721 . . . . 0.0 110.491 177.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.52 HE21 ' HB3' ' A' ' 90' ' ' GLN . 1.2 mp0 -89.95 -20.71 23.0 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.723 -178.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.629 HD11 ' SG ' ' A' ' 48' ' ' CYS . 13.5 pt -142.91 -177.2 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.306 0.574 . . . . 0.0 111.871 -177.701 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.7 mmt180 -157.26 140.83 15.78 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.861 176.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.402 ' HB3' HD12 ' A' ' 67' ' ' ILE . 23.1 m-85 -97.36 145.58 26.01 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.886 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.429 ' NE ' ' HA2' ' A' ' 64' ' ' GLY . 1.2 tmt_? -143.32 138.84 29.79 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-O 121.068 0.461 . . . . 0.0 110.664 -177.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.566 ' HE1' ' OD1' ' A' ' 82' ' ' ASP . 80.6 t80 -143.36 147.42 34.65 Favored 'General case' 0 C--O 1.208 -1.089 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.994 179.46 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 7.0 t70 57.55 22.84 8.55 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 121.73 0.776 . . . . 0.0 110.665 179.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.429 ' HA2' ' NE ' ' A' ' 61' ' ' ARG . . . 80.27 2.74 89.47 Favored Glycine 0 N--CA 1.427 -1.95 0 C-N-CA 120.591 -0.814 . . . . 0.0 112.706 -178.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 62' ' ' PHE . 13.3 pt20 -119.43 149.96 48.73 Favored Pre-proline 0 N--CA 1.442 -0.864 0 O-C-N 122.313 -0.522 . . . . 0.0 109.741 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 65' ' ' GLN . 14.2 Cg_exo -65.06 141.26 69.26 Favored 'Trans proline' 0 C--N 1.327 -0.56 0 C-N-CA 122.245 1.963 . . . . 0.0 111.654 178.269 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.539 HD11 ' HB2' ' A' ' 62' ' ' PHE . 44.2 mt -92.74 146.21 6.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 178.147 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.437 HD22 ' CG ' ' A' ' 71' ' ' ASP . 0.9 OUTLIER -112.85 170.46 8.18 Favored 'General case' 0 CA--C 1.502 -0.87 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.988 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -75.92 -15.72 60.14 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.515 0.674 . . . . 0.0 109.772 176.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 18.9 p -93.86 3.92 54.68 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.313 179.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.479 ' O ' ' HG ' ' A' ' 40' ' ' LEU . 22.4 m-20 -82.09 142.05 32.62 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.477 0.656 . . . . 0.0 111.951 -179.359 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -116.41 139.31 25.19 Favored Pre-proline 0 C--N 1.317 -0.843 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.408 174.391 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.428 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 13.5 Cg_endo -56.76 -33.3 93.86 Favored 'Trans proline' 0 C--O 1.237 0.439 0 C-N-CA 123.036 2.491 . . . . 0.0 113.131 -175.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.83 -27.93 66.28 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.688 -179.089 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -65.05 -37.9 89.06 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.926 0.393 . . . . 0.0 111.296 -179.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.476 HD22 ' HD2' ' A' ' 62' ' ' PHE . 0.5 OUTLIER -93.09 7.14 45.4 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 -179.855 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 43.35 40.21 2.5 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.636 1.174 . . . . 0.0 112.479 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.428 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 5.5 ptm -74.16 157.09 36.58 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.827 -178.409 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -103.39 159.85 15.21 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.013 -176.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.523 ' HA ' ' O ' ' A' ' 19' ' ' ASN . 10.5 p-10 -57.69 141.92 46.84 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.245 0.545 . . . . 0.0 111.057 174.423 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' A' ' 80' ' ' ASP . 8.3 mt-10 74.77 19.1 2.58 Favored 'General case' 0 CA--C 1.506 -0.727 0 C-N-CA 124.337 1.055 . . . . 0.0 111.48 -179.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.566 ' OD1' ' HE1' ' A' ' 62' ' ' PHE . 16.4 t70 -64.16 150.05 46.51 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.685 177.146 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 23.2 m -104.07 113.9 27.76 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.413 0.625 . . . . 0.0 112.044 -179.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.749 HG13 HG22 ' A' ' 22' ' ' VAL . 17.3 mm -83.59 145.08 8.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.532 178.278 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -102.83 116.86 33.38 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.124 -179.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.454 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 71.3 t -113.06 134.85 54.4 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-O 121.321 0.582 . . . . 0.0 111.175 176.496 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 13.0 p90 -132.9 155.5 48.94 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.749 -179.712 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.57 ' HG3' ' HG3' ' A' ' 90' ' ' GLN . 4.4 tp60 -75.55 132.1 40.47 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.49 0.662 . . . . 0.0 112.051 -176.693 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -114.82 11.08 16.63 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.2 178.238 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.57 ' HG3' ' HG3' ' A' ' 88' ' ' GLN . 0.0 OUTLIER -105.81 153.15 22.3 Favored 'General case' 0 C--N 1.317 -0.838 0 O-C-N 121.826 -0.546 . . . . 0.0 111.187 -178.203 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 36.0 m -149.11 97.31 2.67 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-O 121.198 0.523 . . . . 0.0 110.123 178.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -175.39 75.04 0.08 OUTLIER Glycine 0 N--CA 1.441 -0.981 0 N-CA-C 110.966 -0.854 . . . . 0.0 110.966 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.249 0 CA-C-O 118.351 -1.25 . . . . 0.0 111.386 -177.818 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.1 ttp . . . . . 0 N--CA 1.473 0.693 0 CA-C-O 120.844 0.354 . . . . 0.0 111.332 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -88.71 10.92 19.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.0 0.428 . . . . 0.0 112.02 -177.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -86.01 41.09 0.9 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 122.001 0.905 . . . . 0.0 109.959 179.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.414 ' H ' ' HG3' ' A' ' 4' ' ' GLU . 27.2 mt-10 -58.09 116.03 3.28 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.039 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -78.07 133.58 64.9 Favored Pre-proline 0 C--N 1.318 -0.779 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.219 -179.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.411 ' O ' ' N ' ' A' ' 8' ' ' GLU . 18.2 Cg_endo -66.43 143.29 69.05 Favored 'Trans proline' 0 CA--C 1.507 -0.849 0 C-N-CA 122.637 2.225 . . . . 0.0 113.296 -177.256 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.565 ' HD2' ' H ' ' A' ' 8' ' ' GLU . 0.9 OUTLIER -6.04 -46.15 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 116.724 2.12 . . . . 0.0 116.724 173.187 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.565 ' H ' ' HD2' ' A' ' 7' ' ' LYS . 45.4 mt-10 -85.5 52.3 2.42 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 121.192 -0.942 . . . . 0.0 109.89 178.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -147.05 70.49 0.35 Allowed Glycine 0 N--CA 1.441 -0.994 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.002 -178.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.9 p -114.2 22.67 5.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-O 122.575 1.179 . . . . 0.0 109.358 178.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -74.03 88.18 1.88 Allowed 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 114.891 -1.049 . . . . 0.0 111.684 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 13.4 t -139.21 3.35 2.16 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.537 177.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -155.3 159.43 39.99 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.872 -178.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 7.1 m-80 -136.78 43.97 2.38 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 74.66 16.55 3.11 Favored 'General case' 0 N--CA 1.48 1.069 0 CA-C-O 122.532 1.158 . . . . 0.0 109.192 -176.178 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -69.42 93.0 0.63 Allowed 'General case' 0 C--O 1.236 0.361 0 CA-C-N 114.632 -1.167 . . . . 0.0 110.749 -176.32 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -121.14 154.12 36.61 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.429 -179.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 31.9 pt -130.95 170.72 19.13 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.066 0 CA-C-O 121.379 0.609 . . . . 0.0 110.994 -178.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -104.85 136.23 44.74 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 115.903 -0.59 . . . . 0.0 109.563 178.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -127.93 135.93 50.64 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 177.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -121.81 146.82 46.7 Favored 'General case' 0 C--N 1.308 -1.215 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 179.018 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.669 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 3.4 p -124.62 131.44 72.7 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.582 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.797 -176.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -112.06 132.03 55.07 Favored 'General case' 0 C--O 1.244 0.79 0 CA-C-O 121.151 0.5 . . . . 0.0 110.762 -178.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -102.92 174.12 23.09 Favored Glycine 0 N--CA 1.435 -1.391 0 C-N-CA 121.292 -0.48 . . . . 0.0 112.725 -179.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.632 ' H ' ' NE2' ' A' ' 25' ' ' GLN . 0.1 OUTLIER -66.92 -31.41 71.98 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.531 0.681 . . . . 0.0 110.782 -177.529 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -77.31 -10.65 59.57 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.984 -178.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 98.82 7.37 55.51 Favored Glycine 0 N--CA 1.443 -0.894 0 C-N-CA 120.448 -0.882 . . . . 0.0 112.578 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 18.7 t -83.46 154.24 24.03 Favored 'General case' 0 N--CA 1.444 -0.765 0 O-C-N 122.416 -0.461 . . . . 0.0 109.976 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.669 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.2 p -146.68 132.69 13.01 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.269 0.557 . . . . 0.0 111.074 179.564 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.0 t -117.12 135.16 58.4 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -105.35 142.75 34.56 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.754 0.311 . . . . 0.0 110.92 -179.568 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.478 ' HE1' HG12 ' A' ' 22' ' ' VAL . 11.5 m-85 -138.44 156.46 47.54 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.109 0.48 . . . . 0.0 110.96 -179.568 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 35.5 pt -131.94 165.19 32.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.149 0.499 . . . . 0.0 111.32 -177.314 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.477 ' HB2' ' OG1' ' A' ' 38' ' ' THR . 15.6 mtpp -75.48 153.79 37.35 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.042 178.335 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 10.9 ptt180 -67.14 -22.38 65.78 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.507 0.67 . . . . 0.0 110.492 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -103.76 2.31 32.78 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 122.205 1.002 . . . . 0.0 109.357 -176.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.477 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.2 m -89.97 134.47 31.76 Favored Pre-proline 0 C--N 1.302 -1.476 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.808 178.551 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -61.34 125.51 17.07 Favored 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 122.33 2.02 . . . . 0.0 112.27 -178.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.531 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.0 OUTLIER -65.92 -17.42 64.65 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.112 0.482 . . . . 0.0 111.899 -179.57 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.455 ' N ' HD12 ' A' ' 40' ' ' LEU . 5.9 p -55.68 -28.25 54.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.416 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -60.91 -45.55 94.21 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 116.25 -0.432 . . . . 0.0 109.946 179.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.5 pp -72.91 -36.73 67.33 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.014 0.435 . . . . 0.0 110.231 178.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 45.1 mtm -63.58 -49.59 72.78 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 120.996 0.426 . . . . 0.0 110.855 -178.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.46 ' O ' ' HG3' ' A' ' 49' ' ' GLU . 92.5 mttt -66.25 -36.1 82.13 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-O 120.688 0.28 . . . . 0.0 110.866 178.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.54 -37.42 87.49 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.114 0.483 . . . . 0.0 109.981 178.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -58.73 -55.43 35.16 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.793 178.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.51 ' HB2' ' O ' ' A' ' 53' ' ' LEU . 24.4 p -64.8 -35.47 81.19 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 122.141 -0.349 . . . . 0.0 111.325 -177.061 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 60.7 mt-10 -67.04 -40.75 87.22 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.795 0.331 . . . . 0.0 111.507 179.653 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -81.82 -32.26 31.32 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 120.935 0.398 . . . . 0.0 111.472 -178.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.7 mm-40 -82.04 -22.69 36.28 Favored 'General case' 0 CA--C 1.513 -0.451 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -177.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 90.2 37.7 6.6 Favored Glycine 0 N--CA 1.437 -1.262 0 C-N-CA 120.114 -1.041 . . . . 0.0 111.174 -178.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.51 ' O ' ' HB2' ' A' ' 48' ' ' CYS . 3.9 mm? -123.62 165.35 17.33 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 179.297 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.1 m -119.49 155.48 32.02 Favored 'General case' 0 C--N 1.312 -1.031 0 O-C-N 121.922 -0.486 . . . . 0.0 110.971 178.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 12.9 mmt -63.15 -26.04 68.63 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.448 0.642 . . . . 0.0 111.453 178.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.54 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.84 -12.65 50.24 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.553 0.692 . . . . 0.0 110.52 177.219 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -96.94 -27.23 14.74 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.748 -0.66 . . . . 0.0 112.178 -178.112 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.8 pt -132.59 176.12 9.8 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.041 0 CA-C-O 121.076 0.465 . . . . 0.0 110.485 -178.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.413 ' HD3' ' HA ' ' A' ' 59' ' ' ARG . 16.1 mmt180 -149.72 141.67 23.83 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.729 178.696 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 37.0 m-85 -100.08 139.41 35.78 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.977 -179.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.63 ' HG2' ' N ' ' A' ' 62' ' ' PHE . 1.5 ttm180 -137.83 150.63 47.33 Favored 'General case' 0 C--N 1.302 -1.463 0 CA-C-O 121.179 0.514 . . . . 0.0 110.865 -178.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.63 ' N ' ' HG2' ' A' ' 61' ' ' ARG . 74.4 t80 -155.23 146.1 22.44 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.841 176.511 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 1.2 t70 57.45 24.6 10.4 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 121.637 0.732 . . . . 0.0 110.403 -178.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.95 0.18 84.62 Favored Glycine 0 N--CA 1.435 -1.417 0 C-N-CA 121.011 -0.614 . . . . 0.0 113.292 -179.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.42 HE21 HD23 ' A' ' 76' ' ' LEU . 12.1 pt20 -115.87 146.52 37.12 Favored Pre-proline 0 C--N 1.319 -0.728 0 O-C-N 122.13 -0.629 . . . . 0.0 110.067 179.221 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.55 139.74 45.58 Favored 'Trans proline' 0 C--O 1.238 0.495 0 C-N-CA 122.053 1.836 . . . . 0.0 111.806 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.523 HD11 ' HB2' ' A' ' 62' ' ' PHE . 42.8 mt -91.72 146.43 6.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 120.929 0.395 . . . . 0.0 110.242 -178.631 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.475 HD22 ' HB2' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -109.53 157.74 18.7 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 177.222 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.435 ' OE2' HG23 ' A' ' 70' ' ' THR . 0.1 OUTLIER -68.65 -19.53 64.41 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-O 121.649 0.738 . . . . 0.0 110.579 178.061 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.435 HG23 ' OE2' ' A' ' 69' ' ' GLU . 1.0 OUTLIER -96.32 14.81 23.03 Favored 'General case' 0 N--CA 1.421 -1.905 0 CA-C-N 116.011 -0.54 . . . . 0.0 112.107 179.693 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.475 ' HB2' HD22 ' A' ' 68' ' ' ASN . 3.3 t70 -96.4 150.84 20.14 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 120.881 0.372 . . . . 0.0 110.31 -179.576 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.734 ' HB ' ' OE1' ' A' ' 75' ' ' GLN . 0.9 OUTLIER -117.61 141.39 28.85 Favored Pre-proline 0 CA--C 1.545 0.754 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 179.179 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.518 ' HD2' HG22 ' A' ' 72' ' ' THR . 12.2 Cg_endo -53.66 -34.26 73.03 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 123.545 2.83 . . . . 0.0 113.122 -177.246 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.81 -26.25 65.98 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.76 -178.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.734 ' OE1' ' HB ' ' A' ' 72' ' ' THR . 6.3 mp0 -67.29 -38.83 85.65 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.936 0.398 . . . . 0.0 111.444 -179.332 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.42 HD23 HE21 ' A' ' 65' ' ' GLN . 1.1 mp -81.51 -10.48 59.47 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.513 -179.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 55.01 46.74 23.64 Favored 'General case' 0 C--N 1.347 0.474 0 CA-C-O 121.971 0.891 . . . . 0.0 109.785 -179.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 5.6 ptm -76.04 -141.22 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 114.703 -1.135 . . . . 0.0 112.048 -176.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.562 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 11.9 pt-20 -160.74 152.07 19.19 Favored 'General case' 0 CA--C 1.508 -0.641 0 O-C-N 121.673 -0.642 . . . . 0.0 109.367 -176.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -59.01 142.97 49.75 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 121.285 0.564 . . . . 0.0 111.163 173.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 71.56 15.63 6.03 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 124.14 0.976 . . . . 0.0 111.175 179.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.562 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 3.6 t0 -70.98 158.92 35.68 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.811 0.339 . . . . 0.0 110.131 179.261 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 27.3 m -108.31 126.51 52.92 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.616 0.722 . . . . 0.0 112.562 -176.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 44.7 mm -89.75 133.85 30.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.118 176.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -93.85 114.44 26.68 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 120.769 0.318 . . . . 0.0 110.605 -178.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 92.5 t -112.55 137.19 46.32 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-O 121.096 0.474 . . . . 0.0 110.533 178.134 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.7 p90 -139.64 154.1 47.46 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.109 -179.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -80.35 111.51 16.81 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.465 0.65 . . . . 0.0 111.691 -176.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 77.1 mm-40 -109.04 32.23 5.09 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.029 177.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 18.0 tm0? -54.62 -43.34 72.17 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.129 0.49 . . . . 0.0 110.377 178.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 11.5 m -102.79 132.48 48.93 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 65.59 34.27 88.57 Favored Glycine 0 C--O 1.239 0.42 0 C-N-CA 120.878 -0.677 . . . . 0.0 112.233 -176.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.439 -1.136 0 CA-C-O 118.587 -1.118 . . . . 0.0 111.616 -178.182 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.426 ' O ' ' HB3' ' A' ' 2' ' ' ALA . 1.8 pmm? . . . . . 0 N--CA 1.476 0.872 0 CA-C-O 120.34 0.114 . . . . 0.0 111.18 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.426 ' HB3' ' O ' ' A' ' 1' ' ' MET . . . 86.41 119.56 0.04 OUTLIER 'General case' 0 C--N 1.354 0.772 0 C-N-CA 124.272 1.029 . . . . 0.0 110.745 178.206 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -109.56 30.24 6.83 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.924 -178.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -28.88 112.02 0.07 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.392 1.077 . . . . 0.0 113.738 178.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -139.58 139.06 21.21 Favored Pre-proline 0 C--N 1.309 -1.17 0 CA-C-N 115.028 -0.987 . . . . 0.0 108.781 178.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -67.88 -163.29 0.08 OUTLIER 'Trans proline' 0 CA--C 1.535 0.552 0 C-N-CA 122.439 2.093 . . . . 0.0 112.244 179.021 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.23 1.11 46.95 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.549 0.69 . . . . 0.0 110.761 -179.054 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -148.87 129.9 14.41 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.915 178.161 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -147.1 39.29 1.07 Allowed Glycine 0 C--N 1.309 -0.933 0 N-CA-C 111.499 -0.641 . . . . 0.0 111.499 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 7.7 p -100.22 126.14 53.82 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.815 0 CA-C-O 121.677 0.751 . . . . 0.0 110.928 -179.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.48 123.39 16.46 Favored 'General case' 0 N--CA 1.437 -1.076 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 179.292 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.6 t -90.37 135.55 33.61 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.202 0.525 . . . . 0.0 110.444 178.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -125.57 173.87 8.64 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.774 -179.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -85.0 -4.28 59.09 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.391 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 31.0 m-80 -101.31 158.39 16.08 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.016 0.436 . . . . 0.0 110.376 -179.208 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -122.08 -167.2 1.51 Allowed 'General case' 0 C--N 1.306 -1.292 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 177.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 50.2 p-80 -120.35 152.46 37.84 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.369 0.605 . . . . 0.0 112.027 -176.449 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 38.9 pt -132.2 170.53 19.71 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.653 178.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.486 HD21 ' HB3' ' A' ' 31' ' ' GLN . 16.6 t-20 -104.57 129.64 52.63 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 121.02 0.438 . . . . 0.0 110.797 -179.819 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.432 HD23 HG12 ' A' ' 34' ' ' ILE . 3.0 mm? -123.1 135.18 54.27 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 176.481 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.411 ' HG2' ' HG3' ' A' ' 31' ' ' GLN . 51.5 mtmt -119.86 141.69 49.34 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 -179.625 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.726 HG22 HG13 ' A' ' 84' ' ' ILE . 62.9 t -121.58 131.51 72.91 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 N-CA-C 109.722 -0.473 . . . . 0.0 109.722 -177.785 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.25 125.71 50.67 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.152 0.501 . . . . 0.0 110.07 -178.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.428 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -103.23 156.29 17.97 Favored Glycine 0 N--CA 1.432 -1.576 0 C-N-CA 120.332 -0.937 . . . . 0.0 112.139 -179.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.08 -10.9 0.21 Allowed 'General case' 0 N--CA 1.48 1.066 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 178.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -78.31 -21.64 49.35 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.612 0.72 . . . . 0.0 109.854 178.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 98.72 24.23 11.08 Favored Glycine 0 N--CA 1.443 -0.84 0 N-CA-C 110.196 -1.161 . . . . 0.0 110.196 -177.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 13.5 t -117.54 131.44 56.7 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.084 -0.558 . . . . 0.0 110.186 -177.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.574 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 3.1 p -124.55 142.61 40.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-O 121.317 0.58 . . . . 0.0 110.912 179.26 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 10.8 t -125.19 140.91 46.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 179.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.486 ' HB3' HD21 ' A' ' 19' ' ' ASN . 0.7 OUTLIER -106.28 140.26 39.5 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 120.844 0.354 . . . . 0.0 110.944 -179.675 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 12.5 m-85 -133.79 152.14 51.78 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.851 0.358 . . . . 0.0 110.439 -179.043 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.536 HD13 HD23 ' A' ' 43' ' ' LEU . 24.9 pt -127.53 168.27 20.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.984 0.421 . . . . 0.0 111.314 -177.141 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 10.6 mptt -80.82 153.73 27.54 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.023 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 1.5 ptt180 -71.46 -13.95 61.98 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.217 0.532 . . . . 0.0 111.21 -178.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -105.75 -5.41 19.92 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 122.16 0.981 . . . . 0.0 108.479 -179.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.498 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 1.8 m -85.77 130.3 51.29 Favored Pre-proline 0 N--CA 1.427 -1.613 0 CA-C-N 114.594 -1.185 . . . . 0.0 109.776 -179.649 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -61.88 123.01 11.82 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 122.367 2.045 . . . . 0.0 112.198 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.622 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.3 pp -61.42 -16.56 47.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.707 179.221 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.459 ' N ' HD12 ' A' ' 40' ' ' LEU . 47.9 t -50.15 -35.29 25.42 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 123.34 0.656 . . . . 0.0 111.569 179.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -66.59 -42.77 86.43 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 120.985 -0.286 . . . . 0.0 110.902 -178.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.622 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.0 pp -69.98 -33.27 71.84 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 120.988 0.423 . . . . 0.0 109.991 178.396 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 48.1 mtm -65.75 -48.27 72.44 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.24 0.543 . . . . 0.0 110.731 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 10.8 mmmm -64.31 -38.12 89.9 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 121.002 0.43 . . . . 0.0 110.158 177.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.62 -40.59 97.47 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.196 178.35 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -58.26 -54.56 45.65 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.615 178.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.612 ' SG ' HD11 ' A' ' 58' ' ' ILE . 31.4 m -58.92 -44.16 91.25 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.881 0.372 . . . . 0.0 110.976 -178.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -62.01 -42.42 99.14 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.014 0.375 . . . . 0.0 112.014 -179.35 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -78.8 -36.9 42.07 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.177 0.513 . . . . 0.0 111.732 -177.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.439 ' CB ' HD23 ' A' ' 53' ' ' LEU . 24.9 mm-40 -79.09 -20.38 48.91 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 112.403 0.52 . . . . 0.0 112.403 -177.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.51 42.29 6.98 Favored Glycine 0 N--CA 1.429 -1.792 0 C-N-CA 119.926 -1.13 . . . . 0.0 110.856 -177.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.439 HD23 ' CB ' ' A' ' 51' ' ' GLN . 4.0 mm? -124.01 163.66 20.94 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.405 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.403 ' HB2' ' HB2' ' A' ' 57' ' ' GLN . 48.6 m -116.59 151.37 36.35 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 178.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 10.0 mmt -60.39 -28.01 67.89 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.321 0.581 . . . . 0.0 111.382 179.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.509 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -84.81 -17.33 38.48 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 121.529 0.681 . . . . 0.0 110.503 177.923 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.403 ' HB2' ' HB2' ' A' ' 54' ' ' SER . 1.0 OUTLIER -90.43 -22.96 21.17 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.215 -178.277 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.612 HD11 ' SG ' ' A' ' 48' ' ' CYS . 16.1 pt -136.49 177.84 5.73 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.909 0 CA-C-O 121.513 0.673 . . . . 0.0 111.944 -178.738 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.445 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 17.0 mmt-85 -151.82 140.01 20.3 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.344 178.126 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -96.18 142.7 28.04 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.249 179.035 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -142.42 144.99 33.34 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-O 121.112 0.482 . . . . 0.0 110.888 -176.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.507 ' HB2' HD11 ' A' ' 67' ' ' ILE . 73.1 t80 -150.72 146.1 26.22 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 178.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 22.7 t70 56.71 23.42 7.86 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 121.772 0.796 . . . . 0.0 110.836 -178.163 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 87.01 -19.81 28.41 Favored Glycine 0 N--CA 1.428 -1.84 0 C-N-CA 121.055 -0.593 . . . . 0.0 112.312 -178.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.481 HE21 HD23 ' A' ' 76' ' ' LEU . 12.5 pt20 -97.21 149.5 35.78 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-O 120.833 0.349 . . . . 0.0 111.199 -178.189 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.56 142.68 36.81 Favored 'Trans proline' 0 C--O 1.237 0.474 0 C-N-CA 122.651 2.234 . . . . 0.0 112.285 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.507 HD11 ' HB2' ' A' ' 62' ' ' PHE . 23.7 mt -95.69 149.68 4.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 121.104 0.478 . . . . 0.0 110.16 -179.442 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -127.03 173.01 10.0 Favored 'General case' 0 CA--C 1.5 -0.947 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 178.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -75.31 -9.68 58.77 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 121.399 0.619 . . . . 0.0 110.041 177.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 22.1 p -92.22 -4.76 53.66 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.585 -179.084 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -95.76 143.57 26.88 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-O 121.608 0.718 . . . . 0.0 112.229 179.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -110.95 152.13 43.43 Favored Pre-proline 0 C--N 1.312 -1.055 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.377 177.354 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.477 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 18.8 Cg_endo -58.64 -29.62 89.79 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.538 2.159 . . . . 0.0 112.251 -177.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -77.27 -13.37 59.95 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.952 -178.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -76.39 -37.54 57.02 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.374 0.607 . . . . 0.0 110.545 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.481 HD23 HE21 ' A' ' 65' ' ' GLN . 0.7 OUTLIER -91.15 9.68 30.07 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.99 -179.688 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 44.16 36.87 1.64 Allowed 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.253 1.021 . . . . 0.0 111.857 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.477 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 7.0 ptm -76.36 159.71 30.26 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.554 -178.485 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.559 ' O ' ' HB2' ' A' ' 82' ' ' ASP . 7.4 pt-20 -115.03 167.92 10.38 Favored 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.446 -176.705 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.429 ' O ' ' HB2' ' A' ' 81' ' ' GLU . 6.8 p-10 -59.49 144.97 45.66 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-O 121.017 0.436 . . . . 0.0 111.202 175.221 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 80' ' ' ASP . 56.3 mm-40 74.39 14.74 3.6 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.181 0.992 . . . . 0.0 111.7 -179.58 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.559 ' HB2' ' O ' ' A' ' 79' ' ' GLU . 0.6 OUTLIER -74.52 154.23 38.74 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.293 178.627 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 18.1 m -112.33 131.67 55.4 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.597 0.713 . . . . 0.0 112.919 -175.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.726 HG13 HG22 ' A' ' 22' ' ' VAL . 22.8 mm -94.92 142.78 12.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.838 178.208 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -101.84 116.14 32.06 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.935 0.398 . . . . 0.0 110.547 179.017 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.445 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 44.7 t -111.19 135.98 48.69 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.085 0 CA-C-O 121.302 0.572 . . . . 0.0 110.91 178.279 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.2 p90 -135.5 160.09 39.55 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.781 -179.103 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.431 ' HG3' ' H ' ' A' ' 90' ' ' GLN . 0.1 OUTLIER -88.47 120.87 30.25 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.411 0.624 . . . . 0.0 111.698 -176.13 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 -106.14 19.88 19.82 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.333 177.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.431 ' H ' ' HG3' ' A' ' 88' ' ' GLN . 34.2 tt0 -63.39 121.43 13.77 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.133 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 8.2 m -59.77 117.8 5.41 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.174 0.511 . . . . 0.0 111.35 -178.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -91.26 75.81 1.52 Allowed Glycine 0 N--CA 1.442 -0.929 0 C-N-CA 120.875 -0.678 . . . . 0.0 111.597 179.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.908 0 CA-C-O 118.717 -1.046 . . . . 0.0 111.936 -179.489 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 47.3 tpp . . . . . 0 N--CA 1.477 0.882 0 CA-C-O 121.095 0.474 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.517 ' HA ' ' HG3' ' A' ' 5' ' ' LYS . . . -117.05 26.24 9.93 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.508 0.67 . . . . 0.0 109.969 179.768 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -59.67 -43.16 94.07 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.58 -0.736 . . . . 0.0 112.03 -176.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -115.26 35.13 4.5 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.208 0.527 . . . . 0.0 110.867 -179.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.517 ' HG3' ' HA ' ' A' ' 2' ' ' ALA . 16.2 ptmt -169.16 88.97 0.6 Allowed Pre-proline 0 C--N 1.32 -0.708 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.593 -177.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -79.85 156.86 24.07 Favored 'Trans proline' 0 N--CA 1.45 -1.071 0 C-N-CA 122.565 2.177 . . . . 0.0 112.081 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.67 -16.57 30.15 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 121.446 0.641 . . . . 0.0 110.353 178.295 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -100.39 103.47 14.85 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.193 178.317 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 82.09 60.57 2.13 Favored Glycine 0 N--CA 1.439 -1.146 0 C-N-CA 120.634 -0.793 . . . . 0.0 111.998 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 14.9 p -57.68 147.6 6.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 177.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -98.02 -168.22 1.63 Allowed 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 121.544 -0.722 . . . . 0.0 111.007 -176.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.0 t -128.19 139.08 52.67 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.353 179.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -93.59 -6.83 45.68 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.235 0.54 . . . . 0.0 110.315 179.058 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 70.35 27.31 4.05 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.254 -0.884 . . . . 0.0 111.225 175.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -81.61 69.54 8.3 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.673 0.749 . . . . 0.0 111.205 179.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -62.83 169.45 3.2 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.898 177.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.517 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 42.5 p-80 -117.28 143.76 45.57 Favored 'General case' 0 C--N 1.291 -1.968 0 CA-C-O 121.363 0.602 . . . . 0.0 110.474 -177.518 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.419 HD11 ' HB2' ' A' ' 73' ' ' PRO . 35.3 pt -123.33 168.46 15.82 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.563 0 CA-C-O 121.466 0.65 . . . . 0.0 111.211 -176.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -105.65 135.86 46.3 Favored 'General case' 0 C--N 1.307 -1.278 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 179.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -125.96 134.03 51.64 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 109.814 -0.439 . . . . 0.0 109.814 178.075 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -120.21 141.63 49.74 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 179.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.722 HG22 HG13 ' A' ' 84' ' ' ILE . 61.5 t -124.27 134.77 65.75 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.388 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 -176.663 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.72 130.13 55.65 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.035 0.445 . . . . 0.0 110.574 -177.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -102.6 174.1 23.41 Favored Glycine 0 N--CA 1.436 -1.341 0 N-CA-C 111.446 -0.662 . . . . 0.0 111.446 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -72.57 -18.73 61.59 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.353 0.597 . . . . 0.0 111.185 -177.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -71.11 -16.91 62.59 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.868 177.511 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 96.46 16.37 37.39 Favored Glycine 0 CA--C 1.496 -1.124 0 N-CA-C 110.836 -0.906 . . . . 0.0 110.836 179.11 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.1 m -106.68 132.11 53.05 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 115.257 -0.471 . . . . 0.0 111.032 -177.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.563 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.2 p -122.48 139.03 50.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-O 121.199 0.523 . . . . 0.0 111.292 178.492 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.411 HG11 ' HD3' ' A' ' 50' ' ' ARG . 6.2 t -118.99 137.48 52.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.303 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -104.79 140.49 38.02 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.904 0.383 . . . . 0.0 111.022 -179.063 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.448 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 15.1 m-85 -136.15 155.68 49.81 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 121.01 0.433 . . . . 0.0 110.974 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 36.8 pt -141.29 164.77 19.7 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 CA-C-O 120.762 0.315 . . . . 0.0 110.514 -178.172 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.517 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 30.8 mtmm -78.26 154.14 31.24 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.808 0.337 . . . . 0.0 110.69 178.148 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 2.4 ptt180 -69.03 -18.13 63.99 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.084 0.468 . . . . 0.0 111.024 -179.26 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 -102.51 1.78 35.5 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.833 0.825 . . . . 0.0 109.045 -179.087 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.2 m -96.24 133.48 24.95 Favored Pre-proline 0 N--CA 1.437 -1.119 0 CA-C-N 114.959 -1.018 . . . . 0.0 109.569 179.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -65.97 134.88 38.76 Favored 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.517 2.145 . . . . 0.0 112.63 -177.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.606 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -68.55 -16.04 63.74 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -178.863 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.503 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 3.8 p -50.99 -31.31 17.61 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 47.8 mtpt -61.39 -47.88 83.82 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.241 0.543 . . . . 0.0 110.084 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.6 pp -73.93 -32.32 63.46 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.78 -179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 46.0 mtm -64.55 -45.47 86.97 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 121.19 0.519 . . . . 0.0 110.743 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.0 mtpm? -69.86 -34.94 74.27 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 120.681 -0.408 . . . . 0.0 110.401 178.276 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.06 -37.38 87.22 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.308 0.575 . . . . 0.0 109.801 179.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -59.92 -55.55 32.71 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.907 177.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.68 ' SG ' HD11 ' A' ' 58' ' ' ILE . 33.1 m -60.46 -44.32 96.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.403 -178.098 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -66.4 -31.51 72.32 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -177.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.411 ' HD3' HG11 ' A' ' 30' ' ' VAL . 11.6 ptm180 -87.02 -36.68 18.07 Favored 'General case' 0 C--N 1.328 -0.352 0 O-C-N 121.853 -0.529 . . . . 0.0 111.095 178.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -77.79 -22.46 50.1 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-O 121.148 0.499 . . . . 0.0 112.041 -177.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 89.18 38.76 6.64 Favored Glycine 0 N--CA 1.434 -1.479 0 C-N-CA 120.386 -0.911 . . . . 0.0 111.523 -179.088 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -121.09 159.63 25.35 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.124 0.487 . . . . 0.0 110.32 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.473 ' HB2' ' HB2' ' A' ' 57' ' ' GLN . 51.1 m -108.8 148.21 30.89 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 110.099 -0.334 . . . . 0.0 110.099 178.201 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.9 mmt -58.35 -30.18 66.54 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-O 121.16 0.505 . . . . 0.0 111.626 179.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.458 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.68 -10.56 55.51 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.136 0.493 . . . . 0.0 111.662 178.35 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.473 ' HB2' ' HB2' ' A' ' 54' ' ' SER . 2.3 mp0 -98.24 -17.19 19.09 Favored 'General case' 0 CA--C 1.504 -0.809 0 CA-C-O 120.96 0.41 . . . . 0.0 111.497 -178.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.68 HD11 ' SG ' ' A' ' 48' ' ' CYS . 17.0 pt -139.68 179.18 2.98 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 CA-C-O 120.937 0.398 . . . . 0.0 110.506 179.235 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.494 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 19.6 mmt-85 -154.43 144.74 22.07 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.097 0.475 . . . . 0.0 111.03 177.473 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -100.22 141.81 32.55 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.262 178.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -142.22 138.9 31.79 Favored 'General case' 0 C--N 1.306 -1.305 0 CA-C-O 121.155 0.502 . . . . 0.0 110.701 -177.084 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.497 ' HB2' HD11 ' A' ' 67' ' ' ILE . 71.5 t80 -146.16 147.45 31.51 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 179.717 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 54.93 24.48 5.89 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.172 0.589 . . . . 0.0 111.524 -179.174 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 81.84 3.3 90.63 Favored Glycine 0 N--CA 1.442 -0.961 0 C-N-CA 120.652 -0.785 . . . . 0.0 113.177 179.335 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -121.88 151.49 57.91 Favored Pre-proline 0 C--N 1.317 -0.84 0 O-C-N 121.846 -0.797 . . . . 0.0 110.798 178.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -67.56 141.24 54.68 Favored 'Trans proline' 0 N--CA 1.459 -0.542 0 C-N-CA 122.259 1.973 . . . . 0.0 111.121 177.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.497 HD11 ' HB2' ' A' ' 62' ' ' PHE . 45.7 mt -90.63 145.01 7.94 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.94 0 CA-C-O 120.816 0.341 . . . . 0.0 110.102 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.541 HD22 ' HB2' ' A' ' 71' ' ' ASP . 0.0 OUTLIER -111.92 157.53 20.55 Favored 'General case' 0 CA--C 1.498 -1.029 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 178.034 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.503 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 16.9 pt-20 -71.01 -19.56 62.5 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 121.644 0.735 . . . . 0.0 110.019 179.257 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 12.2 p -91.27 5.97 47.08 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.878 -178.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.541 ' HB2' HD22 ' A' ' 68' ' ' ASN . 2.9 t70 -93.35 151.53 19.71 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-O 121.001 0.429 . . . . 0.0 110.365 -178.448 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.509 ' HB ' ' OE1' ' A' ' 75' ' ' GLN . 1.7 m -118.62 140.16 27.99 Favored Pre-proline 0 C--N 1.316 -0.867 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 178.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.519 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 12.4 Cg_endo -52.55 -32.28 52.87 Favored 'Trans proline' 0 C--N 1.355 0.872 0 C-N-CA 123.657 2.905 . . . . 0.0 113.146 -176.294 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.43 -20.82 64.67 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.098 -177.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.509 ' OE1' ' HB ' ' A' ' 72' ' ' THR . 1.6 mp0 -73.4 -37.35 65.99 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.919 0.39 . . . . 0.0 111.096 -179.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.437 ' H ' HD12 ' A' ' 76' ' ' LEU . 1.0 OUTLIER -88.43 -2.91 58.86 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.92 0.39 . . . . 0.0 110.541 -178.146 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 58.5 34.14 23.68 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.343 0.592 . . . . 0.0 110.884 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.519 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.7 ptm -75.35 160.07 30.71 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.74 -178.573 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -116.4 168.26 10.31 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.582 -175.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -60.95 141.16 57.5 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 121.774 0.797 . . . . 0.0 111.636 177.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 70.12 17.98 7.13 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.412 -1.267 . . . . 0.0 112.609 179.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -70.03 156.83 38.59 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 176.332 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 10.5 m -107.83 132.33 53.53 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -174.055 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.722 HG13 HG22 ' A' ' 22' ' ' VAL . 20.8 mm -97.08 142.67 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-N 115.253 -0.885 . . . . 0.0 109.555 178.465 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 29.8 m-20 -100.42 117.96 35.67 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 120.637 0.256 . . . . 0.0 110.406 178.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.494 ' HA ' ' O ' ' A' ' 59' ' ' ARG . 47.9 t -112.92 132.92 60.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 CA-C-O 121.124 0.487 . . . . 0.0 110.346 176.069 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 16.6 p90 -131.65 149.04 52.63 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.938 -178.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -73.92 111.34 8.98 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.242 0.544 . . . . 0.0 111.344 -178.559 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.466 ' H ' ' HA ' ' A' ' 58' ' ' ILE . 8.9 mm-40 -93.85 22.94 5.17 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.357 0.599 . . . . 0.0 110.444 176.804 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -76.53 110.42 11.07 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 179.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 13.7 t -69.44 154.73 41.58 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 64.62 52.7 40.6 Favored Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 120.598 -0.811 . . . . 0.0 111.45 -177.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.41 0 CA-C-O 118.13 -1.372 . . . . 0.0 111.105 -178.985 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.489 1.498 0 CA-C-O 121.163 0.506 . . . . 0.0 111.284 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -154.53 24.55 0.46 Allowed 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.845 0.831 . . . . 0.0 109.209 -179.171 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -128.14 7.7 6.03 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 115.128 -0.942 . . . . 0.0 109.949 -176.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -55.44 111.91 0.99 Allowed 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.134 -0.939 . . . . 0.0 112.174 -178.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -136.13 125.27 15.76 Favored Pre-proline 0 C--N 1.315 -0.901 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.006 176.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -70.27 161.08 47.33 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.199 1.932 . . . . 0.0 111.695 178.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.451 ' HD2' ' N ' ' A' ' 8' ' ' GLU . 0.2 OUTLIER -79.98 -20.19 46.1 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -179.41 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.451 ' N ' ' HD2' ' A' ' 7' ' ' LYS . 23.5 mm-40 -136.62 175.55 9.51 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-O 121.257 0.551 . . . . 0.0 111.849 -178.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 86.09 -41.62 3.09 Favored Glycine 0 C--N 1.332 0.316 0 CA-C-N 116.027 -0.533 . . . . 0.0 112.818 178.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 61.8 t 55.49 74.46 0.09 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.407 0 CA-C-O 121.691 0.758 . . . . 0.0 111.2 -178.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.534 ' O ' ' HD3' ' A' ' 11' ' ' LYS . 0.1 OUTLIER -38.12 125.68 1.26 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 114.584 -1.189 . . . . 0.0 113.227 177.361 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.5 t -162.98 170.13 18.54 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.93 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -102.29 -72.39 0.69 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.816 0.341 . . . . 0.0 111.261 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 58.15 39.23 26.2 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-O 121.133 0.492 . . . . 0.0 111.344 -178.116 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -98.85 12.11 36.74 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.242 0.544 . . . . 0.0 110.067 -179.235 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -64.8 92.25 0.09 Allowed 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.758 0.79 . . . . 0.0 111.662 -179.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 52.5 p-80 -124.74 147.76 48.46 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.39 0.614 . . . . 0.0 111.757 -179.32 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.457 HG13 HD21 ' A' ' 20' ' ' LEU . 32.1 pt -130.87 170.75 19.03 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.061 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.297 -179.176 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.429 ' O ' ' HA ' ' A' ' 80' ' ' ASP . 26.3 t-20 -107.12 125.09 50.62 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 116.272 -0.422 . . . . 0.0 109.862 179.181 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.468 HD23 HG12 ' A' ' 34' ' ' ILE . 2.7 mm? -114.72 141.66 47.53 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.824 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -128.37 142.24 51.18 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 -178.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.745 HG22 HG13 ' A' ' 84' ' ' ILE . 57.7 t -122.79 132.75 70.7 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.364 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 -178.049 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.47 124.58 47.96 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 -179.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.516 ' HA2' ' HB ' ' A' ' 86' ' ' VAL . . . -102.66 169.13 19.0 Favored Glycine 0 N--CA 1.431 -1.643 0 C-N-CA 120.086 -1.054 . . . . 0.0 112.737 -178.306 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -61.43 -5.6 1.82 Allowed 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.205 0.602 . . . . 0.0 112.514 178.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -86.36 -21.66 27.09 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.62 0.724 . . . . 0.0 109.683 178.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 104.73 -16.46 47.46 Favored Glycine 0 CA--C 1.491 -1.409 0 N-CA-C 109.957 -1.257 . . . . 0.0 109.957 -178.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.9 m -76.72 131.91 39.02 Favored 'General case' 0 N--CA 1.429 -1.516 0 CA-C-N 114.639 -0.781 . . . . 0.0 111.233 -178.395 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.504 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.1 p -122.17 140.81 44.92 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.896 178.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.466 HG11 ' HD3' ' A' ' 50' ' ' ARG . 10.9 t -121.99 138.46 52.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 -179.192 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -107.18 140.11 40.56 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.041 0.448 . . . . 0.0 111.139 -179.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.496 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 15.5 m-85 -132.84 151.97 51.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.128 0.49 . . . . 0.0 110.727 -177.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.468 HG12 HD23 ' A' ' 20' ' ' LEU . 24.5 pt -138.15 168.97 19.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.052 0.453 . . . . 0.0 110.933 -177.146 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 7.1 mtmp? -80.92 144.87 31.6 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 120.81 0.338 . . . . 0.0 110.693 178.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -68.73 -14.12 62.82 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.186 0.517 . . . . 0.0 111.475 -177.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 13.9 t-80 -101.76 -3.27 28.4 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-O 122.247 1.022 . . . . 0.0 108.367 -178.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.463 ' HB ' ' O ' ' A' ' 35' ' ' LYS . 1.5 m -93.96 140.33 22.91 Favored Pre-proline 0 N--CA 1.437 -1.082 0 CA-C-N 114.244 -1.343 . . . . 0.0 110.796 -178.715 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.557 ' HG2' ' HE3' ' A' ' 42' ' ' LYS . 35.5 Cg_endo -59.71 126.11 19.64 Favored 'Trans proline' 0 C--O 1.238 0.478 0 C-N-CA 122.98 2.453 . . . . 0.0 112.29 -179.346 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.657 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.9 OUTLIER -69.92 -16.55 63.24 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.378 0.609 . . . . 0.0 111.346 179.579 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.474 ' N ' HD12 ' A' ' 40' ' ' LEU . 0.7 OUTLIER -50.53 -31.79 16.57 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 123.919 0.887 . . . . 0.0 111.742 -179.597 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.557 ' HE3' ' HG2' ' A' ' 39' ' ' PRO . 90.6 mttt -59.08 -50.63 73.34 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 121.431 0.634 . . . . 0.0 109.982 179.293 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.657 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 2.7 pp -70.17 -32.25 70.12 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.049 -178.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 45.2 mtm -64.71 -50.63 66.18 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 120.786 0.327 . . . . 0.0 111.305 -178.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.474 ' HA ' ' SG ' ' A' ' 48' ' ' CYS . 24.4 mmmt -65.61 -33.81 76.76 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 120.911 0.386 . . . . 0.0 110.469 178.104 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.77 -37.5 87.82 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-O 121.136 0.493 . . . . 0.0 109.979 178.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 41.8 t80 -60.08 -56.41 21.96 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.464 177.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.474 ' SG ' ' HA ' ' A' ' 45' ' ' LYS . 24.5 p -61.88 -35.63 78.89 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 111.814 0.301 . . . . 0.0 111.814 -178.167 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 45' ' ' LYS . 48.3 mt-10 -66.72 -43.52 84.06 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 122.214 -0.303 . . . . 0.0 111.525 179.59 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.466 ' HD3' HG11 ' A' ' 30' ' ' VAL . 14.0 ptm180 -76.66 -37.28 56.52 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.117 0.484 . . . . 0.0 111.483 -178.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.505 ' HB3' HD23 ' A' ' 53' ' ' LEU . 21.1 mm-40 -74.29 -21.92 59.52 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 120.967 0.413 . . . . 0.0 111.914 -178.561 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 83.96 42.14 7.78 Favored Glycine 0 N--CA 1.428 -1.882 0 C-N-CA 119.767 -1.206 . . . . 0.0 110.995 -177.318 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.505 HD23 ' HB3' ' A' ' 51' ' ' GLN . 4.0 mm? -125.05 167.0 15.37 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 179.361 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 51.1 m -116.88 151.67 36.11 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 178.076 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.3 mmt -59.62 -28.12 66.93 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-O 121.197 0.522 . . . . 0.0 111.779 178.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.498 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -84.67 -13.87 50.2 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.58 0.705 . . . . 0.0 110.587 177.646 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -93.48 -17.2 23.7 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.026 -178.618 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 14.3 pt -141.49 179.66 2.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-O 121.176 0.512 . . . . 0.0 111.426 -179.163 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.469 ' O ' ' HA ' ' A' ' 86' ' ' VAL . 6.1 mmt180 -155.23 140.23 17.35 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.689 177.725 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 26.9 m-85 -97.83 143.02 28.87 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.732 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.8 tmm_? -141.8 135.98 30.2 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.556 0.693 . . . . 0.0 111.402 -178.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.459 ' HB2' HD11 ' A' ' 67' ' ' ILE . 78.6 t80 -142.87 146.93 34.57 Favored 'General case' 0 N--CA 1.433 -1.302 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 177.343 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.4 ' C ' ' H ' ' A' ' 65' ' ' GLN . 13.0 t70 50.45 40.69 23.69 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 121.254 0.549 . . . . 0.0 109.906 -176.639 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 66.2 -20.9 0.17 Allowed Glycine 0 CA--C 1.532 1.152 0 N-CA-C 115.462 0.945 . . . . 0.0 115.462 -176.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.537 HE21 HD23 ' A' ' 76' ' ' LEU . 12.6 pt20 -92.81 147.11 33.43 Favored Pre-proline 0 C--N 1.316 -0.867 0 CA-C-N 117.516 0.658 . . . . 0.0 110.944 -177.597 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -69.68 142.51 48.46 Favored 'Trans proline' 0 N--CA 1.452 -0.919 0 C-N-CA 122.146 1.898 . . . . 0.0 110.912 179.34 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.459 HD11 ' HB2' ' A' ' 62' ' ' PHE . 34.4 mt -91.52 144.12 9.86 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.184 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 -178.727 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -121.42 162.7 19.97 Favored 'General case' 0 CA--C 1.499 -0.986 0 N-CA-C 109.697 -0.483 . . . . 0.0 109.697 -178.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -72.73 -13.75 61.4 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 121.244 0.545 . . . . 0.0 110.49 178.339 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 22.0 p -95.07 4.7 53.43 Favored 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 179.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -105.45 154.61 20.1 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.4 0.619 . . . . 0.0 112.01 178.719 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.46 155.49 48.52 Favored Pre-proline 0 C--N 1.319 -0.738 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.978 177.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.615 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 13.2 Cg_endo -57.28 -30.92 89.29 Favored 'Trans proline' 0 C--O 1.236 0.381 0 C-N-CA 122.835 2.357 . . . . 0.0 112.253 -179.329 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -74.95 -16.57 60.64 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.75 -178.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -73.2 -39.64 65.4 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.375 0.607 . . . . 0.0 110.314 178.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.537 HD23 HE21 ' A' ' 65' ' ' GLN . 1.1 mp -86.05 -2.57 58.44 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.682 179.047 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 59.33 30.84 20.62 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.261 179.077 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.615 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 5.7 ptm -76.55 168.21 20.48 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.031 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -136.59 -178.62 5.25 Favored 'General case' 0 C--N 1.313 -1.004 0 O-C-N 122.167 -0.333 . . . . 0.0 110.65 -177.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.431 ' O ' ' HB2' ' A' ' 81' ' ' GLU . 8.0 p-10 -61.56 141.08 57.99 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.553 0.692 . . . . 0.0 112.121 179.174 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.431 ' HB2' ' O ' ' A' ' 80' ' ' ASP . 4.6 mm-40 80.31 15.93 0.73 Allowed 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.278 1.431 . . . . 0.0 111.531 178.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.412 ' OD2' HD12 ' A' ' 20' ' ' LEU . 0.0 OUTLIER -62.24 146.11 51.76 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.857 176.897 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 17.6 m -114.17 111.73 22.04 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-O 121.822 0.82 . . . . 0.0 112.332 175.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.745 HG13 HG22 ' A' ' 22' ' ' VAL . 14.3 mm -80.82 144.39 10.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 114.955 -1.021 . . . . 0.0 109.741 179.283 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -107.43 123.48 48.46 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-O 120.962 0.411 . . . . 0.0 110.982 178.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.516 ' HB ' ' HA2' ' A' ' 24' ' ' GLY . 86.7 t -113.46 139.04 40.95 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-O 121.205 0.526 . . . . 0.0 110.998 177.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 6.6 p90 -133.61 150.12 51.6 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.052 179.34 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.55 127.53 33.31 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.741 0.782 . . . . 0.0 112.102 -177.35 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.465 ' HG3' ' HG2' ' A' ' 59' ' ' ARG . 28.2 mm-40 -101.98 16.15 26.86 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.563 176.365 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -96.57 86.68 4.18 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 15.1 p -126.55 119.57 27.45 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.424 -177.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 58.52 42.81 96.15 Favored Glycine 0 N--CA 1.453 -0.216 0 CA-C-N 116.378 -0.374 . . . . 0.0 113.1 178.474 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.274 0 CA-C-O 118.313 -1.271 . . . . 0.0 111.363 -179.946 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 54.2 tpp . . . . . 0 N--CA 1.473 0.681 0 CA-C-O 120.891 0.377 . . . . 0.0 110.721 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -116.84 35.06 4.77 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 121.578 0.704 . . . . 0.0 110.55 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -76.33 -42.74 43.97 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 121.348 0.594 . . . . 0.0 110.686 -176.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -95.05 22.57 6.46 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.182 -176.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -137.52 96.4 10.89 Favored Pre-proline 0 C--N 1.315 -0.918 0 O-C-N 122.074 -0.391 . . . . 0.0 110.058 -179.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -77.51 175.79 10.85 Favored 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 122.637 2.225 . . . . 0.0 111.526 178.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.573 ' HD2' ' H ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -71.93 -2.52 18.33 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.198 0.523 . . . . 0.0 111.035 178.087 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.5 mm-40 -84.03 173.73 10.89 Favored 'General case' 0 N--CA 1.436 -1.134 0 CA-C-O 121.251 0.548 . . . . 0.0 111.212 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 120.04 32.11 1.22 Allowed Glycine 0 N--CA 1.442 -0.93 0 N-CA-C 111.564 -0.614 . . . . 0.0 111.564 -179.508 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.3 t -106.35 99.88 9.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.073 0.463 . . . . 0.0 110.221 -179.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 14.4 tppt? -67.8 148.87 50.65 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.255 0.55 . . . . 0.0 111.185 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.4 t -151.03 148.29 28.17 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.006 177.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 60.81 13.16 4.22 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.609 0.763 . . . . 0.0 112.501 179.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -133.34 16.13 4.09 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-O 121.733 0.777 . . . . 0.0 109.28 178.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -114.82 -41.04 3.43 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.153 -0.93 . . . . 0.0 108.945 179.022 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.439 ' O ' ' HB3' ' A' ' 17' ' ' HIS . 2.9 p-10 -136.64 -158.17 0.84 Allowed 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 177.179 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.439 ' HB3' ' O ' ' A' ' 16' ' ' ASP . 6.0 t-160 75.64 96.94 0.07 Allowed 'General case' 0 CA--C 1.493 -1.247 0 CA-C-O 122.139 0.971 . . . . 0.0 108.853 -179.035 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 45.2 pt -121.52 170.55 11.48 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.215 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.952 -173.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -105.5 135.43 46.91 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.37 178.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.409 HD23 HG12 ' A' ' 34' ' ' ILE . 3.1 mm? -127.25 134.42 50.07 Favored 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 177.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -118.51 146.54 44.46 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-O 121.23 0.538 . . . . 0.0 110.14 179.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.571 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 4.8 p -125.09 128.93 73.32 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.897 0 CA-C-N 116.108 -0.497 . . . . 0.0 109.992 -179.705 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -119.52 131.34 55.54 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.223 0.535 . . . . 0.0 109.906 -178.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -107.08 158.02 15.3 Favored Glycine 0 N--CA 1.432 -1.615 0 C-N-CA 120.41 -0.9 . . . . 0.0 111.355 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.19 -18.71 6.3 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 177.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -69.26 -21.88 63.87 Favored 'General case' 0 C--O 1.224 -0.288 0 O-C-N 121.961 -0.462 . . . . 0.0 110.574 177.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 103.79 2.77 46.25 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.043 179.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.0 t -93.7 159.39 15.23 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 179.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.571 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.6 p -148.97 136.91 14.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-O 121.05 0.452 . . . . 0.0 110.662 -179.445 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.8 t -118.93 135.54 59.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -106.72 143.14 35.25 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.824 0.345 . . . . 0.0 110.733 -179.384 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.564 ' HE1' HG12 ' A' ' 22' ' ' VAL . 14.0 m-85 -137.16 161.56 35.83 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.167 0.508 . . . . 0.0 110.83 -178.666 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.409 HG12 HD23 ' A' ' 20' ' ' LEU . 19.4 pt -130.67 171.54 17.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 121.1 0.476 . . . . 0.0 110.826 -177.472 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.423 ' HA ' ' HA ' ' A' ' 17' ' ' HIS . 32.7 mtmm -83.51 150.33 26.06 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 176.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -71.73 -11.07 60.64 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.269 0.556 . . . . 0.0 111.082 -178.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 18.8 t60 -99.16 -2.01 37.93 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.535 0.683 . . . . 0.0 109.636 -178.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -99.33 148.17 34.29 Favored Pre-proline 0 N--CA 1.442 -0.864 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.006 -178.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -65.12 131.53 28.91 Favored 'Trans proline' 0 C--O 1.239 0.553 0 C-N-CA 122.582 2.188 . . . . 0.0 112.509 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.486 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.2 pp -70.28 -16.93 63.08 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.131 0.491 . . . . 0.0 111.628 179.444 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.486 ' HB3' ' HA ' ' A' ' 69' ' ' GLU . 9.0 p -53.16 -28.25 25.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.076 -179.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.0 mtmt -66.1 -42.98 88.55 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 120.861 0.362 . . . . 0.0 110.907 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.7 pp -71.89 -34.3 69.05 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 121.17 0.509 . . . . 0.0 109.794 178.382 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 47.9 mtm -65.07 -46.62 80.39 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 120.997 0.427 . . . . 0.0 110.722 -179.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.488 ' HA ' ' SG ' ' A' ' 48' ' ' CYS . 80.8 mttt -66.76 -36.15 81.77 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 120.855 0.36 . . . . 0.0 110.796 177.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.463 ' O ' ' HG2' ' A' ' 50' ' ' ARG . . . -63.34 -37.88 88.98 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.232 0.539 . . . . 0.0 109.666 178.732 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -61.14 -56.4 21.28 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.945 178.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.488 ' SG ' ' HA ' ' A' ' 45' ' ' LYS . 24.3 p -62.52 -38.65 90.8 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.727 0.298 . . . . 0.0 111.436 -177.435 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -65.95 -37.4 85.93 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 111.785 0.291 . . . . 0.0 111.785 -179.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.463 ' HG2' ' O ' ' A' ' 46' ' ' ALA . 14.7 ptm180 -83.26 -33.25 26.07 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 121.87 -0.519 . . . . 0.0 111.438 -179.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.405 ' HB3' HD23 ' A' ' 53' ' ' LEU . 26.7 mm-40 -78.61 -21.85 47.89 Favored 'General case' 0 CA--C 1.508 -0.649 0 CA-C-O 120.998 0.428 . . . . 0.0 112.053 -178.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 86.71 39.83 7.46 Favored Glycine 0 N--CA 1.433 -1.531 0 C-N-CA 120.167 -1.016 . . . . 0.0 111.24 -178.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.405 HD23 ' HB3' ' A' ' 51' ' ' GLN . 3.4 mm? -126.37 168.2 14.48 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.013 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 66.6 m -120.61 157.22 30.01 Favored 'General case' 0 C--N 1.312 -1.041 0 O-C-N 122.264 -0.273 . . . . 0.0 110.647 179.038 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 15.5 mmt -63.13 -26.76 68.97 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.422 0.63 . . . . 0.0 111.457 179.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.493 ' H ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -85.53 -12.99 50.34 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 121.548 0.689 . . . . 0.0 110.437 177.74 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -96.48 -26.03 15.44 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.911 -178.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 12.3 pt -135.29 176.37 8.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-O 120.819 0.342 . . . . 0.0 110.714 -179.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.413 ' HD3' ' HA ' ' A' ' 59' ' ' ARG . 17.4 mmt180 -152.88 146.57 25.12 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.209 0.528 . . . . 0.0 111.07 179.018 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -104.6 143.25 33.32 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.496 -0.774 . . . . 0.0 110.439 -177.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.445 ' HG2' ' O ' ' A' ' 65' ' ' GLN . 7.7 tmm_? -143.03 141.31 31.29 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-O 121.172 0.511 . . . . 0.0 110.859 179.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.536 ' HB2' HD11 ' A' ' 67' ' ' ILE . 69.5 t80 -146.8 147.42 30.87 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 178.45 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 24.8 t70 58.59 23.19 10.62 Favored 'General case' 0 N--CA 1.483 1.182 0 CA-C-O 121.869 0.842 . . . . 0.0 110.728 -178.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 79.2 1.32 85.48 Favored Glycine 0 N--CA 1.428 -1.835 0 C-N-CA 120.939 -0.648 . . . . 0.0 112.849 -179.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.445 ' O ' ' HG2' ' A' ' 61' ' ' ARG . 12.0 pt20 -116.72 147.44 39.9 Favored Pre-proline 0 C--N 1.324 -0.523 0 O-C-N 122.148 -0.619 . . . . 0.0 110.599 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_endo -67.62 141.05 53.71 Favored 'Trans proline' 0 C--O 1.237 0.431 0 C-N-CA 122.602 2.202 . . . . 0.0 111.824 -179.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.536 HD11 ' HB2' ' A' ' 62' ' ' PHE . 24.1 mt -98.79 141.24 16.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 CA-C-O 121.049 0.452 . . . . 0.0 110.088 -179.183 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -112.39 170.61 8.05 Favored 'General case' 0 CA--C 1.497 -1.08 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 177.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.486 ' HA ' ' HB3' ' A' ' 41' ' ' SER . 8.9 pt-20 -73.76 -17.01 61.15 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-O 121.564 0.697 . . . . 0.0 110.119 177.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 17.6 p -82.96 -21.62 33.97 Favored 'General case' 0 N--CA 1.434 -1.225 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.707 -177.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -77.64 154.08 32.55 Favored 'General case' 0 N--CA 1.437 -1.11 0 N-CA-C 112.999 0.741 . . . . 0.0 112.999 -178.079 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.412 ' OG1' ' HG2' ' A' ' 75' ' ' GLN . 0.9 OUTLIER -115.31 154.22 47.5 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.892 175.5 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_endo -57.88 -29.3 85.85 Favored 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.981 2.454 . . . . 0.0 111.915 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -73.83 -20.24 60.51 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.673 -178.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.412 ' HG2' ' OG1' ' A' ' 72' ' ' THR . 27.4 mm-40 -69.52 -37.06 76.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.363 0.602 . . . . 0.0 111.146 179.6 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.438 ' H ' HD12 ' A' ' 76' ' ' LEU . 1.1 mp -88.76 -2.15 58.45 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.204 -178.677 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 53.87 38.14 28.04 Favored 'General case' 0 C--N 1.345 0.388 0 CA-C-O 121.772 0.796 . . . . 0.0 110.985 179.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 6.1 ptm -77.79 169.49 18.2 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.631 -178.543 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -117.68 169.15 9.81 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -177.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -62.58 142.63 57.92 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 121.64 0.733 . . . . 0.0 111.439 176.481 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 74.71 16.77 3.03 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 124.847 1.259 . . . . 0.0 111.953 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.69 155.4 40.58 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.769 0.318 . . . . 0.0 110.276 176.365 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 84.3 m -111.0 132.15 54.45 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.696 0.76 . . . . 0.0 112.708 -175.543 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.429 ' HB ' ' HA ' ' A' ' 22' ' ' VAL . 41.5 mm -96.7 141.93 14.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.341 -0.845 . . . . 0.0 108.906 177.651 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -103.51 124.12 48.17 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-O 120.957 0.408 . . . . 0.0 110.919 179.233 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 99.0 t -115.28 136.16 52.94 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-O 121.264 0.555 . . . . 0.0 111.113 178.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 10.4 p90 -135.98 152.95 51.47 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.916 -179.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.412 ' HG3' ' H ' ' A' ' 90' ' ' GLN . 0.1 OUTLIER -80.04 113.91 18.57 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.339 0.59 . . . . 0.0 112.504 -176.555 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.401 ' HG3' ' CG ' ' A' ' 59' ' ' ARG . 26.3 mm-40 -95.14 22.81 6.28 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.359 0.599 . . . . 0.0 111.303 176.517 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.434 HE21 ' HB3' ' A' ' 90' ' ' GLN . 0.9 OUTLIER -105.92 101.5 11.0 Favored 'General case' 0 N--CA 1.438 -1.069 0 N-CA-C 109.221 -0.659 . . . . 0.0 109.221 -179.755 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 9.8 t -145.74 143.75 29.92 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.251 -178.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 110.98 148.52 11.41 Favored Glycine 0 N--CA 1.431 -1.638 0 C-N-CA 120.543 -0.837 . . . . 0.0 111.996 178.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.372 0 CA-C-O 118.63 -1.094 . . . . 0.0 111.472 179.628 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.8 ptt? . . . . . 0 N--CA 1.482 1.16 0 N-CA-C 111.775 0.287 . . . . 0.0 111.775 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.56 4.71 17.56 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.381 0.61 . . . . 0.0 111.091 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -80.73 -13.94 58.55 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.634 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.502 ' O ' ' HB2' ' A' ' 5' ' ' LYS . 45.0 mt-10 -108.91 138.3 45.46 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 177.258 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.502 ' HB2' ' O ' ' A' ' 4' ' ' GLU . 0.9 OUTLIER 76.13 155.6 0.15 Allowed Pre-proline 0 N--CA 1.472 0.637 0 C-N-CA 123.295 0.638 . . . . 0.0 111.343 178.18 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_endo -79.29 -160.19 0.12 Allowed 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.595 2.197 . . . . 0.0 110.904 177.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.445 ' HD2' ' N ' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -76.3 -12.79 60.13 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.382 0.611 . . . . 0.0 110.871 177.908 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.445 ' N ' ' HD2' ' A' ' 7' ' ' LYS . 9.5 pt-20 -108.4 176.59 5.07 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.213 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 93.47 22.5 26.5 Favored Glycine 0 N--CA 1.446 -0.695 0 N-CA-C 110.786 -0.926 . . . . 0.0 110.786 -176.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 8.2 p -97.45 134.08 36.81 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 CA-C-O 120.892 0.377 . . . . 0.0 110.407 -178.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.2 mptt 56.66 68.13 0.9 Allowed 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.737 0.78 . . . . 0.0 111.424 -177.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.0 t -85.38 165.8 16.93 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.217 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -81.79 28.37 0.42 Allowed 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.603 0.716 . . . . 0.0 111.355 -178.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -105.68 8.32 33.0 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.305 0.574 . . . . 0.0 109.815 177.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -84.13 -3.83 58.37 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.725 0.774 . . . . 0.0 109.953 179.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -73.95 103.83 4.59 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.099 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 35' ' ' LYS . 55.8 p-80 -122.88 152.5 40.72 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.042 -177.168 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 36.5 pt -131.66 164.02 35.69 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-O 121.376 0.608 . . . . 0.0 111.037 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -96.11 136.92 35.93 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.377 179.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.487 HD23 HG12 ' A' ' 34' ' ' ILE . 3.0 mm? -129.75 139.66 51.25 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 176.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -125.03 144.98 50.12 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-O 121.213 0.53 . . . . 0.0 110.305 -179.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.604 ' O ' ' HA ' ' A' ' 29' ' ' VAL . 5.2 p -122.72 132.06 72.02 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.532 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.551 -178.496 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -118.1 119.07 33.64 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-O 121.376 0.608 . . . . 0.0 110.151 -179.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -96.33 146.5 18.29 Favored Glycine 0 N--CA 1.428 -1.854 0 C-N-CA 120.836 -0.697 . . . . 0.0 111.493 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.486 ' HG3' ' O ' ' A' ' 86' ' ' VAL . 0.0 OUTLIER -53.29 -16.36 1.28 Allowed 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 113.479 0.918 . . . . 0.0 113.479 178.866 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -71.91 -21.37 61.64 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.206 0.527 . . . . 0.0 110.394 177.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 103.71 27.22 6.45 Favored Glycine 0 N--CA 1.443 -0.855 0 N-CA-C 110.651 -0.98 . . . . 0.0 110.651 -178.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 7.1 p -122.01 131.84 54.21 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-O 120.977 0.418 . . . . 0.0 111.475 -178.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.604 ' HA ' ' O ' ' A' ' 22' ' ' VAL . 2.4 p -124.08 137.1 58.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 121.161 0.505 . . . . 0.0 111.525 178.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.1 t -120.79 137.16 55.45 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.273 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 179.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -107.15 144.16 34.28 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.934 0.397 . . . . 0.0 111.265 -179.394 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.527 ' HE1' HG12 ' A' ' 22' ' ' VAL . 10.6 m-85 -140.79 158.86 43.35 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.282 0.563 . . . . 0.0 110.982 -178.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.487 HG12 HD23 ' A' ' 20' ' ' LEU . 33.7 pt -136.86 167.93 22.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-O 120.829 0.347 . . . . 0.0 110.44 -177.43 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.511 ' HB2' ' OG1' ' A' ' 38' ' ' THR . 0.0 OUTLIER -79.39 151.74 30.77 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.184 0.516 . . . . 0.0 110.919 179.584 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 36' ' ' ARG . 5.9 ptt180 -67.05 -18.0 65.15 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.384 0.611 . . . . 0.0 110.723 179.258 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 59.8 t60 -102.93 -3.5 26.06 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 122.186 0.993 . . . . 0.0 108.897 -177.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.511 ' OG1' ' HB2' ' A' ' 35' ' ' LYS . 2.3 m -90.16 136.01 29.26 Favored Pre-proline 0 C--N 1.306 -1.311 0 CA-C-N 114.502 -1.227 . . . . 0.0 110.473 -178.711 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -63.45 125.26 15.26 Favored 'Trans proline' 0 C--O 1.24 0.578 0 C-N-CA 122.447 2.098 . . . . 0.0 111.979 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.485 HD12 ' N ' ' A' ' 41' ' ' SER . 1.2 pp -62.61 -17.34 60.04 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.445 0.64 . . . . 0.0 111.303 179.247 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.485 ' N ' HD12 ' A' ' 40' ' ' LEU . 0.7 OUTLIER -51.42 -29.49 16.1 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 124.11 0.964 . . . . 0.0 111.37 179.312 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -62.85 -49.1 76.2 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.618 179.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 40' ' ' LEU . 1.8 pp -68.83 -34.78 76.07 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 120.968 0.413 . . . . 0.0 110.058 179.57 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 48.1 mtm -61.36 -45.92 92.39 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 121.059 0.457 . . . . 0.0 110.447 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.688 ' O ' ' HG2' ' A' ' 49' ' ' GLU . 7.9 mtpm? -69.28 -40.44 77.75 Favored 'General case' 0 C--O 1.212 -0.897 0 C-N-CA 120.445 -0.502 . . . . 0.0 110.642 177.802 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.64 -40.17 82.66 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-O 121.444 0.64 . . . . 0.0 109.83 -179.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 58.8 t80 -56.89 -55.67 31.56 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.224 176.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.664 ' SG ' HD11 ' A' ' 58' ' ' ILE . 21.7 m -61.16 -39.94 91.98 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.87 0.367 . . . . 0.0 110.698 -179.231 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.688 ' HG2' ' O ' ' A' ' 45' ' ' LYS . 69.2 mm-40 -58.75 -49.91 75.89 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 121.274 0.559 . . . . 0.0 111.098 178.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 -77.71 -36.83 50.61 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.805 -176.187 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.465 ' HB3' HD23 ' A' ' 53' ' ' LEU . 23.0 mm-40 -76.25 -22.14 55.51 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -177.506 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.401 ' C ' HD22 ' A' ' 53' ' ' LEU . . . 85.22 42.52 7.0 Favored Glycine 0 N--CA 1.431 -1.659 0 C-N-CA 119.523 -1.323 . . . . 0.0 110.782 -176.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.465 HD23 ' HB3' ' A' ' 51' ' ' GLN . 4.1 mm? -125.16 164.15 20.89 Favored 'General case' 0 N--CA 1.445 -0.684 0 CA-C-O 121.149 0.5 . . . . 0.0 110.157 -179.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 15.8 m -117.0 154.15 31.41 Favored 'General case' 0 C--N 1.309 -1.156 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 178.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 14.0 mmt -63.88 -25.59 68.23 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-O 121.336 0.589 . . . . 0.0 111.093 179.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.85 -17.89 36.58 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.42 0.628 . . . . 0.0 110.772 177.554 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -88.78 -25.74 22.1 Favored 'General case' 0 CA--C 1.507 -0.697 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.352 -178.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.664 HD11 ' SG ' ' A' ' 48' ' ' CYS . 15.1 pt -136.08 -178.02 2.21 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.088 0 CA-C-O 121.022 0.439 . . . . 0.0 111.344 -179.204 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.438 ' HD3' ' HA ' ' A' ' 59' ' ' ARG . 19.3 mmt180 -157.89 146.9 19.46 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.505 177.222 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -102.77 146.34 28.39 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.151 -178.437 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 8.0 tmm_? -143.58 142.32 31.03 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.545 0.688 . . . . 0.0 111.326 -179.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.58 ' HB2' HD11 ' A' ' 67' ' ' ILE . 65.7 t80 -148.59 148.11 29.78 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 18.5 t70 57.59 22.7 8.47 Favored 'General case' 0 N--CA 1.484 1.273 0 CA-C-O 121.667 0.746 . . . . 0.0 110.978 -177.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 76.05 11.61 84.66 Favored Glycine 0 N--CA 1.43 -1.744 0 C-N-CA 120.477 -0.868 . . . . 0.0 112.627 -179.005 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -126.87 147.08 59.77 Favored Pre-proline 0 CA--C 1.534 0.338 0 O-C-N 122.222 -0.575 . . . . 0.0 109.891 178.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -66.21 143.34 70.65 Favored 'Trans proline' 0 CA--C 1.532 0.42 0 C-N-CA 122.314 2.01 . . . . 0.0 111.959 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.58 HD11 ' HB2' ' A' ' 62' ' ' PHE . 28.7 mt -97.7 148.84 5.43 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-O 120.95 0.405 . . . . 0.0 110.244 -178.484 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -125.79 169.96 12.08 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 178.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -77.19 -8.72 58.02 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-O 121.316 0.579 . . . . 0.0 110.311 177.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 41.0 p -91.12 -3.65 56.9 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.34 179.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -100.52 148.4 24.83 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.413 0.625 . . . . 0.0 112.173 -179.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -111.8 157.26 40.01 Favored Pre-proline 0 C--N 1.323 -0.559 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.766 178.137 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.583 ' HA ' ' SD ' ' A' ' 78' ' ' MET . 18.0 Cg_endo -60.32 -31.24 92.59 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.733 2.289 . . . . 0.0 111.595 178.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -77.91 -11.02 59.86 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.555 -179.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . 0.471 ' NE2' ' HA ' ' A' ' 75' ' ' GLN . 8.6 tp60 -71.44 -48.37 49.95 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 121.638 0.732 . . . . 0.0 110.118 -179.465 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.498 ' H ' HD12 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -86.11 0.46 53.45 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.364 -178.169 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 51.98 44.17 29.71 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 121.731 0.777 . . . . 0.0 110.674 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.583 ' SD ' ' HA ' ' A' ' 73' ' ' PRO . 6.0 ptm -76.35 158.81 31.1 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.956 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -108.84 167.11 10.31 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-O 120.804 0.335 . . . . 0.0 110.577 -176.008 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -52.08 137.63 27.11 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.326 0.584 . . . . 0.0 111.443 174.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 67.65 23.76 8.66 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.083 -0.962 . . . . 0.0 112.482 178.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.98 150.41 47.72 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 175.307 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 28.8 m -106.31 126.75 52.62 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 121.558 0.694 . . . . 0.0 112.807 -174.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.439 HD11 ' HE1' ' A' ' 78' ' ' MET . 42.0 mm -93.06 140.93 15.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 176.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -106.36 123.33 47.9 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-O 121.054 0.454 . . . . 0.0 110.916 179.102 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.486 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 85.9 t -111.38 137.08 45.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.029 0.442 . . . . 0.0 111.193 179.682 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.2 p90 -134.3 152.87 52.05 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.855 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.467 ' HG3' ' H ' ' A' ' 90' ' ' GLN . 0.1 OUTLIER -77.31 118.56 19.91 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.516 0.674 . . . . 0.0 111.507 -178.106 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.434 ' HG3' ' CG ' ' A' ' 59' ' ' ARG . 55.5 mm-40 -102.72 20.26 17.62 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.075 178.017 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.467 ' H ' ' HG3' ' A' ' 88' ' ' GLN . 6.9 tt0 -88.36 109.37 19.93 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 178.133 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 62.3 m -131.1 99.51 4.9 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.232 0.539 . . . . 0.0 110.572 179.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 79.5 -76.59 1.96 Allowed Glycine 0 N--CA 1.444 -0.812 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.122 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.51 0 CA-C-O 118.181 -1.344 . . . . 0.0 111.477 -179.486 . . . . . . . . 0 0 . 1 stop_ save_